data_1ttx_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 1ttx _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.6 pp . . . . . 0 CA--C 1.53 0.206 0 CA-C-O 121.616 0.722 . . . . 2.02 110.567 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 12.5 t -66.0 -9.85 34.12 Favored 'General case' 0 N--CA 1.426 -1.667 0 C-N-CA 127.673 2.389 . . . . 2.42 112.078 -174.386 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 26.4 t0 -138.59 28.46 2.44 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.14 0.976 . . . . 2.81 109.822 178.206 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 1.1 p -100.55 -46.74 11.77 Favored 'Isoleucine or valine' 0 C--N 1.344 0.327 0 O-C-N 121.682 -0.636 . . . . 3.05 109.907 173.554 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 173.24 -58.8 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 106.956 -1.498 . . . . 2.26 106.956 -165.742 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -43.48 -31.62 0.74 Allowed 'General case' 0 C--O 1.218 -0.556 0 C-N-CA 126.291 1.836 . . . . 2.78 114.478 -169.386 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -45.5 -47.9 14.08 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 119.235 0.925 . . . . 1.72 112.874 173.775 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -67.21 -42.31 84.31 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-O 122.239 1.019 . . . . 1.78 109.789 -179.86 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -64.86 -43.52 92.72 Favored 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 123.734 0.814 . . . . 2.41 109.425 -175.059 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 26.6 pt -67.1 -39.38 83.1 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.858 0 O-C-N 121.426 -0.796 . . . . 1.65 111.02 176.522 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.63 -40.56 72.31 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 118.649 0.659 . . . . 1.5 110.787 171.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.85 -57.09 10.91 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 121.914 -0.491 . . . . 1.74 111.057 171.557 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -46.81 -47.59 21.0 Favored 'General case' 0 N--CA 1.462 0.158 0 C-N-CA 125.895 1.678 . . . . 1.6 111.138 -177.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 16.0 tp -48.45 -48.54 37.42 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 125.941 1.696 . . . . 3.61 109.595 178.243 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 -82.94 -43.3 16.63 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 110.517 -0.179 . . . . 3.93 110.517 -174.297 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -66.87 -38.85 87.12 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 110.527 -0.175 . . . . 2.29 110.527 -173.561 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 56.6 m -106.92 62.55 0.63 Allowed 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 124.537 1.135 . . . . 2.0 108.084 166.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -74.95 -41.93 58.66 Favored 'General case' 0 N--CA 1.464 0.265 0 O-C-N 121.799 -0.563 . . . . 6.54 109.514 170.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -78.81 148.39 72.4 Favored Pre-proline 0 N--CA 1.45 -0.459 0 C-N-CA 123.741 0.816 . . . . 1.98 111.126 -160.238 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -66.3 130.11 23.18 Favored 'Trans proline' 0 N--CA 1.449 -1.114 0 C-N-CA 123.006 2.471 . . . . 1.3 110.915 -175.146 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 74.4 37.62 0.56 Allowed 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 127.689 2.396 . . . . 2.97 110.343 173.317 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 16.1 m -115.71 -6.56 12.14 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.214 1.006 . . . . 1.78 112.759 -173.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -80.62 83.42 6.4 Favored 'General case' 0 CA--C 1.535 0.393 0 O-C-N 120.694 -1.254 . . . . 3.24 111.248 -160.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -68.17 143.54 96.02 Favored Pre-proline 0 CA--C 1.534 0.332 0 O-C-N 121.596 -0.69 . . . . 2.57 110.183 178.143 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -71.6 -62.52 0.04 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.24 0 C-N-CA 122.562 2.175 . . . . 0.78 111.883 -175.095 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 37.1 mt-30 -55.07 -46.05 75.38 Favored 'General case' 0 C--O 1.233 0.193 0 C-N-CA 123.254 0.621 . . . . 2.4 109.801 179.336 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 42.8 tptt -49.96 -56.64 9.82 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 116.009 -0.541 . . . . 4.13 109.786 173.218 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 54.9 t80 -56.26 -50.97 69.84 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 111.534 0.198 . . . . 3.52 111.534 179.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 31.0 m-85 -56.67 -34.6 67.53 Favored 'General case' 0 CA--C 1.532 0.272 0 O-C-N 121.319 -0.863 . . . . 6.48 112.008 -178.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 5.5 mm-40 -71.93 -58.6 3.32 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 108.568 -0.901 . . . . 4.0 108.568 174.567 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -63.99 -25.28 68.06 Favored 'General case' 0 N--CA 1.439 -1.005 0 C-N-CA 123.945 0.898 . . . . 1.55 111.839 -169.401 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 18.5 t -85.02 -7.83 58.97 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 126.02 1.728 . . . . 2.4 111.44 179.318 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 86.24 -11.78 62.21 Favored Glycine 0 C--N 1.338 0.674 0 N-CA-C 111.376 -0.69 . . . . 0.9 111.376 174.512 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 93.5 mt -54.78 -42.83 72.23 Favored 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 125.516 1.526 . . . . 2.32 111.029 -179.654 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 5.3 t -72.02 -13.5 61.62 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.102 0.561 . . . . 2.5 111.977 177.159 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -89.45 -35.94 15.71 Favored 'General case' 0 N--CA 1.452 -0.345 0 O-C-N 121.337 -0.852 . . . . 4.13 109.863 174.469 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 59.9 mtt -57.13 152.39 13.57 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 121.603 0.716 . . . . 3.84 111.361 174.295 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 23.8 t -78.69 154.76 29.86 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 116.213 -0.449 . . . . 2.41 109.905 174.579 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -41.0 -44.57 2.4 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 125.602 1.561 . . . . 1.58 112.129 176.018 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 68.3 m-80 -54.33 -58.22 8.24 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.304 0.642 . . . . 1.91 110.339 178.85 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 3.6 mm-40 -59.82 -44.61 93.93 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 123.077 0.551 . . . . 2.67 109.849 -179.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.416 ' CG1' ' CZ ' ' A' ' 48' ' ' PHE . 53.1 t -57.91 -43.95 85.59 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 CA-C-O 121.293 0.568 . . . . 1.66 109.523 -179.264 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 21.6 tttt -63.27 -48.92 76.14 Favored 'General case' 0 N--CA 1.452 -0.37 0 O-C-N 121.289 -0.882 . . . . 3.87 110.922 176.288 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -51.54 -54.09 31.02 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 118.18 0.446 . . . . 3.07 110.671 176.363 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . 0.27 17.4 m -54.7 -44.34 70.04 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.206 0 CA-C-O 118.826 -0.607 . . . . 1.77 110.984 178.802 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . 0.496 ' CZ ' ' HB3' ' A' ' 103' ' ' PHE . 15.1 m-30 -54.21 -40.39 67.6 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 119.153 0.888 . . . . 7.47 112.783 174.343 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 69.7 mtp85 -57.25 -42.02 80.72 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 118.613 0.642 . . . . 3.77 109.947 174.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 -68.64 -33.24 73.67 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 118.67 -0.681 . . . . 7.01 110.949 176.77 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 14.0 mm -63.65 -59.81 3.72 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 CA-C-O 118.433 -0.794 . . . . 2.41 110.89 175.718 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 55.6 t0 -74.13 71.18 1.63 Allowed 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 119.194 0.906 . . . . 1.87 110.554 -175.791 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 27.7 t30 -46.32 -47.24 18.49 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 125.888 1.675 . . . . 1.92 111.0 176.617 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -64.39 -19.26 65.38 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 126.639 1.976 . . . . 3.96 112.12 -177.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 59.64 12.64 2.97 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 127.08 2.152 . . . . 4.71 113.58 178.677 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 3.9 p -70.12 -10.32 58.39 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 113.83 1.048 . . . . 2.54 113.83 -170.138 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 85.71 34.89 12.4 Favored Glycine 0 CA--C 1.529 0.937 0 CA-C-N 118.933 0.788 . . . . 2.43 111.968 172.067 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -171.05 143.71 2.01 Favored 'General case' 0 CA--C 1.519 -0.233 0 C-N-CA 127.289 2.235 . . . . 4.01 105.001 175.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -102.93 68.54 1.0 Allowed 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 107.309 -1.367 . . . . 3.18 107.309 176.272 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -56.81 146.45 26.16 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.744 1.618 . . . . 1.67 110.761 179.362 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -44.89 -51.26 9.84 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 123.512 0.725 . . . . 3.54 112.953 -175.395 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -69.67 -19.62 63.59 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 121.968 -0.457 . . . . 3.28 111.917 -173.39 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 91.4 mt-10 -77.64 -44.57 27.77 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-O 121.293 0.568 . . . . 3.08 109.598 167.413 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 6.4 tp -53.23 -28.24 26.2 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.644 0.777 . . . . 3.89 110.978 174.191 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 30.2 ttpt -50.67 -16.71 0.42 Allowed 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 113.904 1.076 . . . . 3.26 113.904 169.326 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 27.5 p90 -127.48 33.93 4.76 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 120.097 1.317 . . . . 6.57 112.634 170.138 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 46.4 t80 -57.76 -67.36 0.34 Allowed 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.649 0.78 . . . . 3.75 110.794 178.431 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 2.9 tp -85.38 -9.27 57.79 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.473 -0.767 . . . . 3.52 112.066 -175.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 49.5 mm-40 -56.0 -18.72 10.11 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.098 0.959 . . . . 1.98 111.399 171.405 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -83.04 -16.39 47.22 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 121.196 -0.94 . . . . 4.33 111.476 177.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 6.3 m-30 -101.16 -53.87 2.92 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 124.674 1.189 . . . . 4.57 108.916 -179.1 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -112.83 161.2 17.21 Favored 'General case' 0 C--O 1.222 -0.371 0 N-CA-C 106.606 -1.627 . . . . 3.35 106.606 175.8 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 24.1 m -85.66 -34.62 21.27 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 118.896 0.771 . . . . 2.64 110.524 172.629 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -114.48 42.61 1.88 Allowed Glycine 0 CA--C 1.519 0.324 0 N-CA-C 109.568 -1.413 . . . . 1.79 109.568 -170.444 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.08 -171.57 0.92 Allowed 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 120.953 0.406 . . . . 2.08 111.01 177.552 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.7 -13.59 39.31 Favored 'General case' 0 N--CA 1.453 -0.287 0 O-C-N 121.696 -0.628 . . . . 4.2 112.545 -166.112 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -46.47 -40.59 12.64 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 126.842 2.057 . . . . 3.11 112.802 -163.445 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -49.04 -43.1 40.37 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.607 1.163 . . . . 1.64 112.144 175.584 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 91.8 m -69.26 104.77 2.31 Favored 'General case' 0 C--O 1.235 0.304 0 O-C-N 121.523 -0.736 . . . . 1.6 109.98 175.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -54.77 -41.98 71.14 Favored 'General case' 0 C--O 1.219 -0.542 0 CA-C-N 115.609 -0.723 . . . . 3.2 111.671 178.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 34.7 t -54.28 -53.91 47.37 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-O 121.463 0.649 . . . . 1.94 111.081 -178.463 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -63.36 -47.67 81.12 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 124.074 0.949 . . . . 2.89 108.577 -178.765 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -52.22 -44.91 65.03 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 116.177 -0.465 . . . . 1.67 111.229 174.232 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -76.42 -27.3 56.2 Favored 'General case' 0 C--O 1.221 -0.422 0 C-N-CA 124.219 1.007 . . . . 5.82 110.718 -175.793 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 24.6 m -61.6 -45.96 91.87 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 119.089 0.859 . . . . 2.41 109.798 168.667 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -59.3 -57.91 10.96 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 110.039 -0.356 . . . . 3.61 110.039 172.194 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 22.2 ttp -47.16 -52.64 15.05 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.22 0.608 . . . . 3.9 111.366 178.214 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -49.65 -51.37 38.41 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 126.117 1.767 . . . . 1.37 111.537 -172.028 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -78.02 -41.73 34.81 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-O 119.853 -0.118 . . . . 1.33 111.294 179.835 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -54.81 -41.36 70.54 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-O 120.682 0.277 . . . . 1.62 111.036 179.263 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -77.76 80.96 4.21 Favored 'General case' 0 N--CA 1.445 -0.688 0 C-N-CA 123.245 0.618 . . . . 0.93 111.083 -176.574 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 52.8 p-10 -76.26 41.31 0.23 Allowed 'General case' 0 CA--C 1.541 0.633 0 O-C-N 121.405 -0.809 . . . . 2.97 112.16 176.374 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 29.2 m-20 -126.11 -58.98 1.35 Allowed 'General case' 0 C--N 1.342 0.251 0 C-N-CA 126.193 1.797 . . . . 1.25 108.299 172.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 93.94 44.33 3.62 Favored Glycine 0 CA--C 1.53 0.971 0 N-CA-C 109.147 -1.581 . . . . 0.82 109.147 -157.304 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 41.0 p-10 -124.87 -47.43 1.8 Allowed 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 124.621 1.168 . . . . 2.05 110.318 172.395 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 115.7 -31.24 6.22 Favored Glycine 0 CA--C 1.524 0.638 0 C-N-CA 124.618 1.104 . . . . 0.64 111.227 170.655 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 21.5 pttp -69.34 114.22 7.39 Favored 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 107.692 -1.225 . . . . 5.93 107.692 168.715 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 19.7 mt -103.83 115.57 46.02 Favored 'Isoleucine or valine' 0 C--O 1.231 0.13 0 C-N-CA 123.551 0.74 . . . . 1.72 109.36 -171.842 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -72.28 162.15 54.48 Favored Glycine 0 CA--C 1.534 1.267 0 CA-C-O 121.831 0.684 . . . . 0.84 112.143 172.463 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -57.11 -40.09 76.38 Favored 'General case' 0 C--O 1.226 -0.184 0 O-C-N 121.78 -0.835 . . . . 1.64 109.673 172.106 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -56.19 -54.18 48.23 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.978 0.911 . . . . 2.57 110.274 177.262 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -51.66 -50.53 60.19 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.079 0.952 . . . . 1.27 110.422 176.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . 0.496 ' HB3' ' CZ ' ' A' ' 48' ' ' PHE . 3.4 m-85 -61.12 -44.22 97.68 Favored 'General case' 0 CA--C 1.534 0.364 0 O-C-N 121.87 -0.519 . . . . 5.11 111.709 177.847 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 30.9 tt0 -57.42 -49.83 74.95 Favored 'General case' 0 C--O 1.222 -0.384 0 N-CA-C 108.796 -0.816 . . . . 2.6 108.796 178.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -47.01 -60.39 2.48 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 123.521 0.729 . . . . 3.24 110.548 172.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.22 -43.42 98.87 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 120.378 -0.529 . . . . 3.52 110.976 -172.257 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 66.2 t -64.23 -38.93 83.78 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.428 0 CA-C-O 119.306 -0.378 . . . . 2.0 111.227 176.596 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 79.5 t60 -66.42 -22.48 66.23 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 124.376 1.07 . . . . 3.73 110.055 -173.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 22.7 t . . . . . 0 C--O 1.253 1.273 0 CA-C-O 115.343 -2.265 . . . . 2.58 112.986 176.886 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.6 pp . . . . . 0 CA--C 1.53 0.206 0 CA-C-O 121.616 0.722 . . . . 2.02 110.567 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 12.5 t -66.0 -9.85 34.12 Favored 'General case' 0 N--CA 1.426 -1.667 0 C-N-CA 127.673 2.389 . . . . 2.42 112.078 -174.386 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 26.4 t0 -138.59 28.46 2.44 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.14 0.976 . . . . 2.81 109.822 178.206 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 1.1 p -100.55 -46.74 11.77 Favored 'Isoleucine or valine' 0 C--N 1.344 0.327 0 O-C-N 121.682 -0.636 . . . . 3.05 109.907 173.554 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 173.24 -58.8 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 106.956 -1.498 . . . . 2.26 106.956 -165.742 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -43.48 -31.62 0.74 Allowed 'General case' 0 C--O 1.218 -0.556 0 C-N-CA 126.291 1.836 . . . . 2.78 114.478 -169.386 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -45.5 -47.9 14.08 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 119.235 0.925 . . . . 1.72 112.874 173.775 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -67.21 -42.31 84.31 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-O 122.239 1.019 . . . . 1.78 109.789 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -64.86 -43.52 92.72 Favored 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 123.734 0.814 . . . . 2.41 109.425 -175.059 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 26.6 pt -67.1 -39.38 83.1 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.858 0 O-C-N 121.426 -0.796 . . . . 1.65 111.02 176.522 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.63 -40.56 72.31 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 118.649 0.659 . . . . 1.5 110.787 171.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.85 -57.09 10.91 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 121.914 -0.491 . . . . 1.74 111.057 171.557 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -46.81 -47.59 21.0 Favored 'General case' 0 N--CA 1.462 0.158 0 C-N-CA 125.895 1.678 . . . . 1.6 111.138 -177.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 16.0 tp -48.45 -48.54 37.42 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 125.941 1.696 . . . . 3.61 109.595 178.243 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 -82.94 -43.3 16.63 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 110.517 -0.179 . . . . 3.93 110.517 -174.297 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -66.87 -38.85 87.12 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 110.527 -0.175 . . . . 2.29 110.527 -173.561 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 56.6 m -106.92 62.55 0.63 Allowed 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 124.537 1.135 . . . . 2.0 108.084 166.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -74.95 -41.93 58.66 Favored 'General case' 0 N--CA 1.464 0.265 0 O-C-N 121.799 -0.563 . . . . 6.54 109.514 170.972 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -78.81 148.39 72.4 Favored Pre-proline 0 N--CA 1.45 -0.459 0 C-N-CA 123.741 0.816 . . . . 1.98 111.126 -160.238 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -66.3 130.11 23.18 Favored 'Trans proline' 0 N--CA 1.449 -1.114 0 C-N-CA 123.006 2.471 . . . . 1.3 110.915 -175.146 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 74.4 37.62 0.56 Allowed 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 127.689 2.396 . . . . 2.97 110.343 173.317 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 16.1 m -115.71 -6.56 12.14 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.214 1.006 . . . . 1.78 112.759 -173.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -80.62 83.42 6.4 Favored 'General case' 0 CA--C 1.535 0.393 0 O-C-N 120.694 -1.254 . . . . 3.24 111.248 -160.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -68.17 143.54 96.02 Favored Pre-proline 0 CA--C 1.534 0.332 0 O-C-N 121.596 -0.69 . . . . 2.57 110.183 178.143 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -71.6 -62.52 0.04 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.24 0 C-N-CA 122.562 2.175 . . . . 0.78 111.883 -175.095 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 37.1 mt-30 -55.07 -46.05 75.38 Favored 'General case' 0 C--O 1.233 0.193 0 C-N-CA 123.254 0.621 . . . . 2.4 109.801 179.336 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 42.8 tptt -49.96 -56.64 9.82 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 116.009 -0.541 . . . . 4.13 109.786 173.218 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 54.9 t80 -56.26 -50.97 69.84 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 111.534 0.198 . . . . 3.52 111.534 179.841 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 31.0 m-85 -56.67 -34.6 67.53 Favored 'General case' 0 CA--C 1.532 0.272 0 O-C-N 121.319 -0.863 . . . . 6.48 112.008 -178.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 5.5 mm-40 -71.93 -58.6 3.32 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 108.568 -0.901 . . . . 4.0 108.568 174.567 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -63.99 -25.28 68.06 Favored 'General case' 0 N--CA 1.439 -1.005 0 C-N-CA 123.945 0.898 . . . . 1.55 111.839 -169.401 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 18.5 t -85.02 -7.83 58.97 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 126.02 1.728 . . . . 2.4 111.44 179.318 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 86.24 -11.78 62.21 Favored Glycine 0 C--N 1.338 0.674 0 N-CA-C 111.376 -0.69 . . . . 0.9 111.376 174.512 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 93.5 mt -54.78 -42.83 72.23 Favored 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 125.516 1.526 . . . . 2.32 111.029 -179.654 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 5.3 t -72.02 -13.5 61.62 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.102 0.561 . . . . 2.5 111.977 177.159 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -89.45 -35.94 15.71 Favored 'General case' 0 N--CA 1.452 -0.345 0 O-C-N 121.337 -0.852 . . . . 4.13 109.863 174.469 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 59.9 mtt -57.13 152.39 13.57 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 121.603 0.716 . . . . 3.84 111.361 174.295 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 23.8 t -78.69 154.76 29.86 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 116.213 -0.449 . . . . 2.41 109.905 174.579 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -41.0 -44.57 2.4 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 125.602 1.561 . . . . 1.58 112.129 176.018 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 68.3 m-80 -54.33 -58.22 8.24 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.304 0.642 . . . . 1.91 110.339 178.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 3.6 mm-40 -59.82 -44.61 93.93 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 123.077 0.551 . . . . 2.67 109.849 -179.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.416 ' CG1' ' CZ ' ' A' ' 48' ' ' PHE . 53.1 t -57.91 -43.95 85.59 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 CA-C-O 121.293 0.568 . . . . 1.66 109.523 -179.264 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 21.6 tttt -63.27 -48.92 76.14 Favored 'General case' 0 N--CA 1.452 -0.37 0 O-C-N 121.289 -0.882 . . . . 3.87 110.922 176.288 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -51.54 -54.09 31.02 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 118.18 0.446 . . . . 3.07 110.671 176.363 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . 0.27 17.4 m -54.7 -44.34 70.04 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.206 0 CA-C-O 118.826 -0.607 . . . . 1.77 110.984 178.802 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . 0.496 ' CZ ' ' HB3' ' A' ' 103' ' ' PHE . 15.1 m-30 -54.21 -40.39 67.6 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 119.153 0.888 . . . . 7.47 112.783 174.343 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 69.7 mtp85 -57.25 -42.02 80.72 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 118.613 0.642 . . . . 3.77 109.947 174.906 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 -68.64 -33.24 73.67 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 118.67 -0.681 . . . . 7.01 110.949 176.77 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 14.0 mm -63.65 -59.81 3.72 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 CA-C-O 118.433 -0.794 . . . . 2.41 110.89 175.718 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 55.6 t0 -74.13 71.18 1.63 Allowed 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 119.194 0.906 . . . . 1.87 110.554 -175.791 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 27.7 t30 -46.32 -47.24 18.49 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 125.888 1.675 . . . . 1.92 111.0 176.617 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -64.39 -19.26 65.38 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 126.639 1.976 . . . . 3.96 112.12 -177.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 59.64 12.64 2.97 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 127.08 2.152 . . . . 4.71 113.58 178.677 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 3.9 p -70.12 -10.32 58.39 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 113.83 1.048 . . . . 2.54 113.83 -170.138 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 85.71 34.89 12.4 Favored Glycine 0 CA--C 1.529 0.937 0 CA-C-N 118.933 0.788 . . . . 2.43 111.968 172.067 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -171.05 143.71 2.01 Favored 'General case' 0 CA--C 1.519 -0.233 0 C-N-CA 127.289 2.235 . . . . 4.01 105.001 175.625 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -102.93 68.54 1.0 Allowed 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 107.309 -1.367 . . . . 3.18 107.309 176.272 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -56.81 146.45 26.16 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.744 1.618 . . . . 1.67 110.761 179.362 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -44.89 -51.26 9.84 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 123.512 0.725 . . . . 3.54 112.953 -175.395 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -69.67 -19.62 63.59 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 121.968 -0.457 . . . . 3.28 111.917 -173.39 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 91.4 mt-10 -77.64 -44.57 27.77 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-O 121.293 0.568 . . . . 3.08 109.598 167.413 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 6.4 tp -53.23 -28.24 26.2 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.644 0.777 . . . . 3.89 110.978 174.191 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 30.2 ttpt -50.67 -16.71 0.42 Allowed 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 113.904 1.076 . . . . 3.26 113.904 169.326 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 27.5 p90 -127.48 33.93 4.76 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 120.097 1.317 . . . . 6.57 112.634 170.138 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 46.4 t80 -57.76 -67.36 0.34 Allowed 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.649 0.78 . . . . 3.75 110.794 178.431 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 2.9 tp -85.38 -9.27 57.79 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.473 -0.767 . . . . 3.52 112.066 -175.79 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 49.5 mm-40 -56.0 -18.72 10.11 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.098 0.959 . . . . 1.98 111.399 171.405 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -83.04 -16.39 47.22 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 121.196 -0.94 . . . . 4.33 111.476 177.969 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 6.3 m-30 -101.16 -53.87 2.92 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 124.674 1.189 . . . . 4.57 108.916 -179.1 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -112.83 161.2 17.21 Favored 'General case' 0 C--O 1.222 -0.371 0 N-CA-C 106.606 -1.627 . . . . 3.35 106.606 175.8 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 24.1 m -85.66 -34.62 21.27 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 118.896 0.771 . . . . 2.64 110.524 172.629 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -114.48 42.61 1.88 Allowed Glycine 0 CA--C 1.519 0.324 0 N-CA-C 109.568 -1.413 . . . . 1.79 109.568 -170.444 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.08 -171.57 0.92 Allowed 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 120.953 0.406 . . . . 2.08 111.01 177.552 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.7 -13.59 39.31 Favored 'General case' 0 N--CA 1.453 -0.287 0 O-C-N 121.696 -0.628 . . . . 4.2 112.545 -166.112 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -46.47 -40.59 12.64 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 126.842 2.057 . . . . 3.11 112.802 -163.445 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -49.04 -43.1 40.37 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.607 1.163 . . . . 1.64 112.144 175.584 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 91.8 m -69.26 104.77 2.31 Favored 'General case' 0 C--O 1.235 0.304 0 O-C-N 121.523 -0.736 . . . . 1.6 109.98 175.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -54.77 -41.98 71.14 Favored 'General case' 0 C--O 1.219 -0.542 0 CA-C-N 115.609 -0.723 . . . . 3.2 111.671 178.807 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 34.7 t -54.28 -53.91 47.37 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-O 121.463 0.649 . . . . 1.94 111.081 -178.463 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -63.36 -47.67 81.12 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 124.074 0.949 . . . . 2.89 108.577 -178.765 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -52.22 -44.91 65.03 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 116.177 -0.465 . . . . 1.67 111.229 174.232 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -76.42 -27.3 56.2 Favored 'General case' 0 C--O 1.221 -0.422 0 C-N-CA 124.219 1.007 . . . . 5.82 110.718 -175.793 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 24.6 m -61.6 -45.96 91.87 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 119.089 0.859 . . . . 2.41 109.798 168.667 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -59.3 -57.91 10.96 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 110.039 -0.356 . . . . 3.61 110.039 172.194 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 22.2 ttp -47.16 -52.64 15.05 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.22 0.608 . . . . 3.9 111.366 178.214 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -49.65 -51.37 38.41 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 126.117 1.767 . . . . 1.37 111.537 -172.028 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -78.02 -41.73 34.81 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-O 119.853 -0.118 . . . . 1.33 111.294 179.835 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -54.81 -41.36 70.54 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-O 120.682 0.277 . . . . 1.62 111.036 179.263 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -77.76 80.96 4.21 Favored 'General case' 0 N--CA 1.445 -0.688 0 C-N-CA 123.245 0.618 . . . . 0.93 111.083 -176.574 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 52.8 p-10 -76.26 41.31 0.23 Allowed 'General case' 0 CA--C 1.541 0.633 0 O-C-N 121.405 -0.809 . . . . 2.97 112.16 176.374 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 29.2 m-20 -126.11 -58.98 1.35 Allowed 'General case' 0 C--N 1.342 0.251 0 C-N-CA 126.193 1.797 . . . . 1.25 108.299 172.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 93.94 44.33 3.62 Favored Glycine 0 CA--C 1.53 0.971 0 N-CA-C 109.147 -1.581 . . . . 0.82 109.147 -157.304 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 41.0 p-10 -124.87 -47.43 1.8 Allowed 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 124.621 1.168 . . . . 2.05 110.318 172.395 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 115.7 -31.24 6.22 Favored Glycine 0 CA--C 1.524 0.638 0 C-N-CA 124.618 1.104 . . . . 0.64 111.227 170.655 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 21.5 pttp -69.34 114.22 7.39 Favored 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 107.692 -1.225 . . . . 5.93 107.692 168.715 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 19.7 mt -103.83 115.57 46.02 Favored 'Isoleucine or valine' 0 C--O 1.231 0.13 0 C-N-CA 123.551 0.74 . . . . 1.72 109.36 -171.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -72.28 162.15 54.48 Favored Glycine 0 CA--C 1.534 1.267 0 CA-C-O 121.831 0.684 . . . . 0.84 112.143 172.463 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -57.11 -40.09 76.38 Favored 'General case' 0 C--O 1.226 -0.184 0 O-C-N 121.78 -0.835 . . . . 1.64 109.673 172.106 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -56.19 -54.18 48.23 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.978 0.911 . . . . 2.57 110.274 177.262 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -51.66 -50.53 60.19 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.079 0.952 . . . . 1.27 110.422 176.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . 0.496 ' HB3' ' CZ ' ' A' ' 48' ' ' PHE . 3.4 m-85 -61.12 -44.22 97.68 Favored 'General case' 0 CA--C 1.534 0.364 0 O-C-N 121.87 -0.519 . . . . 5.11 111.709 177.847 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 30.9 tt0 -57.42 -49.83 74.95 Favored 'General case' 0 C--O 1.222 -0.384 0 N-CA-C 108.796 -0.816 . . . . 2.6 108.796 178.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -47.01 -60.39 2.48 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 123.521 0.729 . . . . 3.24 110.548 172.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.22 -43.42 98.87 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 120.378 -0.529 . . . . 3.52 110.976 -172.257 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 66.2 t -64.23 -38.93 83.78 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.428 0 CA-C-O 119.306 -0.378 . . . . 2.0 111.227 176.596 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 79.5 t60 -66.42 -22.48 66.23 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 124.376 1.07 . . . . 3.73 110.055 -173.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 22.7 t . . . . . 0 C--O 1.253 1.273 0 CA-C-O 115.343 -2.265 . . . . 2.58 112.986 176.886 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.3 pp . . . . . 0 CA--C 1.543 0.679 0 N-CA-C 112.662 0.615 . . . . 2.34 112.662 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 14.8 t -68.89 -7.06 31.22 Favored 'General case' 0 N--CA 1.429 -1.491 0 C-N-CA 127.866 2.466 . . . . 2.84 112.812 -177.241 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 47.1 t0 -153.11 44.34 0.64 Allowed 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.438 1.495 . . . . 2.54 108.891 -177.766 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 13.2 t -128.29 -59.14 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.339 0.133 0 C-N-CA 126.171 1.788 . . . . 2.45 108.936 174.49 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -172.54 -47.55 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.14 0 N-CA-C 106.986 -1.487 . . . . 2.72 106.986 -175.194 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 2.4 m -48.15 -32.66 7.24 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 114.46 1.282 . . . . 1.63 114.46 -175.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -51.19 -40.72 59.3 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 119.363 0.983 . . . . 1.95 113.218 174.818 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -76.04 -37.15 58.67 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 121.54 0.686 . . . . 2.17 109.791 177.854 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 23.2 m-20 -57.47 -52.31 65.9 Favored 'General case' 0 C--O 1.234 0.278 0 C-N-CA 124.083 0.953 . . . . 2.59 108.569 -179.43 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 28.3 pt -61.8 -39.3 82.9 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.278 0 CA-C-N 115.352 -0.84 . . . . 1.86 109.929 -178.131 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -54.23 -44.68 71.91 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 118.267 0.485 . . . . 1.98 111.045 174.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.96 -59.14 5.24 Favored 'General case' 0 CA--C 1.53 0.185 0 O-C-N 121.908 -0.495 . . . . 1.75 110.84 174.495 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -48.79 -46.06 41.05 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 124.132 0.973 . . . . 1.8 112.015 -177.56 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -50.11 -44.07 52.02 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 125.369 1.468 . . . . 3.72 109.346 177.52 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 13.7 mt-30 -85.09 -30.19 24.26 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-O 118.285 -0.864 . . . . 3.61 112.623 -178.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -74.33 -25.56 59.62 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 119.956 1.253 . . . . 2.43 111.207 -179.66 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 91.6 m -128.16 46.51 2.56 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.037 1.335 . . . . 2.19 110.009 177.419 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.67 -40.43 63.7 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 119.048 0.84 . . . . 7.63 109.309 171.769 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -62.18 133.96 94.42 Favored Pre-proline 0 N--CA 1.445 -0.702 0 C-N-CA 124.756 1.222 . . . . 3.06 108.151 -171.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 55.1 Cg_endo -60.17 142.83 99.16 Favored 'Trans proline' 0 N--CA 1.448 -1.189 0 C-N-CA 121.957 1.771 . . . . 1.42 109.751 -174.128 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 69.45 21.73 6.74 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.905 0.882 . . . . 3.32 111.615 170.049 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.1 m -113.81 11.02 17.89 Favored 'General case' 0 C--N 1.347 0.458 0 C-N-CA 125.142 1.377 . . . . 1.84 112.148 -179.531 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -84.98 114.16 21.95 Favored 'General case' 0 C--O 1.232 0.143 0 N-CA-C 107.863 -1.162 . . . . 3.17 107.863 179.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -110.78 149.05 39.79 Favored Pre-proline 0 CA--C 1.534 0.331 0 C-N-CA 124.264 1.026 . . . . 2.76 109.473 174.319 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_endo -65.7 -73.34 0.02 OUTLIER 'Trans proline' 0 N--CA 1.452 -0.917 0 C-N-CA 123.353 2.702 . . . . 0.8 111.614 -173.578 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -49.73 -43.79 48.0 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 124.964 1.306 . . . . 2.54 110.772 -179.858 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.53 -64.57 0.77 Allowed 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 125.834 1.654 . . . . 3.75 110.454 175.81 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 65.8 t80 -58.14 -43.51 87.35 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-O 122.85 1.31 . . . . 3.21 110.981 -179.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.435 ' CE1' ' HA ' ' A' ' 107' ' ' VAL . 3.8 t80 -52.16 -51.57 57.18 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.117 0.967 . . . . 5.85 112.1 178.485 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 30.1 mt-30 -72.56 -36.81 68.31 Favored 'General case' 0 N--CA 1.45 -0.43 0 O-C-N 121.431 -0.793 . . . . 3.81 110.724 176.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -64.14 -41.18 97.3 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-N 119.139 0.881 . . . . 1.5 110.983 -176.559 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 11.5 p -62.3 -50.3 72.19 Favored 'General case' 0 N--CA 1.441 -0.895 0 N-CA-C 106.777 -1.564 . . . . 3.28 106.777 173.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 102.39 20.58 11.9 Favored Glycine 0 CA--C 1.521 0.464 0 N-CA-C 109.619 -1.392 . . . . 2.31 109.619 -176.829 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 32.5 mt -60.08 -24.81 64.91 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 121.866 -0.785 . . . . 2.88 109.772 168.809 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 22.8 t -62.05 -24.78 67.29 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 123.459 0.704 . . . . 2.87 110.52 173.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -92.83 -24.74 18.4 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 123.006 0.522 . . . . 5.29 109.831 178.457 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 21.1 mmt -66.85 144.88 56.02 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 121.674 0.749 . . . . 4.52 111.141 176.387 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 8.5 t -75.01 156.26 36.44 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.983 -0.553 . . . . 2.41 109.512 179.336 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -45.53 -43.35 11.76 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 124.335 1.054 . . . . 1.84 111.435 176.447 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -49.96 -62.85 1.33 Allowed 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.66 0.784 . . . . 3.25 110.587 175.339 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 1.7 mm-40 -56.25 -46.45 79.63 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 122.983 0.513 . . . . 3.19 109.924 -179.315 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 78.4 t -58.4 -38.67 71.07 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.646 0 O-C-N 122.07 -0.394 . . . . 1.97 110.419 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 14.7 tptt -68.68 -44.26 74.39 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 121.182 -0.948 . . . . 5.11 111.091 176.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 73.6 m-20 -59.09 -53.43 58.47 Favored 'General case' 0 C--O 1.232 0.163 0 N-CA-C 109.767 -0.457 . . . . 2.9 109.767 178.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 7.8 m -58.2 -43.75 86.36 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 N-CA-C 109.505 -0.554 . . . . 1.8 109.505 176.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 7.7 t80 -49.19 -48.69 45.01 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 118.482 0.583 . . . . 5.3 111.019 175.274 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 73.2 mtp180 -58.73 -37.68 76.71 Favored 'General case' 0 CA--C 1.532 0.266 0 O-C-N 121.684 -0.635 . . . . 4.74 112.432 177.583 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 9.8 m-85 -62.7 -33.71 75.66 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 118.497 0.589 . . . . 4.9 110.18 174.122 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.3 mm -73.59 -47.14 45.97 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 CA-C-O 118.707 -0.663 . . . . 2.38 110.407 -179.303 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 20.1 t0 -73.32 65.29 0.85 Allowed 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 118.898 0.772 . . . . 1.9 108.969 176.445 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 10.8 t30 -58.29 -36.17 72.91 Favored 'General case' 0 C--N 1.332 -0.179 0 C-N-CA 125.104 1.361 . . . . 2.29 111.863 -170.598 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -73.38 -20.06 60.85 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.438 1.095 . . . . 2.55 111.955 175.782 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 14.0 mt-30 53.87 72.09 0.47 Allowed 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.831 1.652 . . . . 3.11 110.954 -175.016 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 89.4 p -105.72 -28.97 10.37 Favored 'General case' 0 C--N 1.34 0.171 0 C-N-CA 123.824 0.849 . . . . 1.84 111.909 174.609 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 87.74 7.41 74.97 Favored Glycine 0 CA--C 1.532 1.096 0 CA-C-O 119.398 -0.668 . . . . 1.53 112.063 -167.513 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 16.2 m-85 -134.11 133.57 41.23 Favored 'General case' 0 C--O 1.233 0.218 0 N-CA-C 108.214 -1.032 . . . . 3.76 108.214 164.526 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -93.33 80.58 4.42 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 126.689 1.995 . . . . 2.89 105.809 163.716 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -63.65 153.73 35.13 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 114.393 -1.276 . . . . 1.93 109.431 169.568 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -50.41 -46.1 56.08 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 124.345 1.058 . . . . 3.79 112.252 -173.15 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.5 tm-20 -59.56 -46.1 89.88 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 123.293 0.637 . . . . 3.61 110.355 -177.059 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 90.3 mt-10 -59.17 -43.79 92.13 Favored 'General case' 0 N--CA 1.451 -0.425 0 O-C-N 121.763 -0.585 . . . . 2.85 110.129 175.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -58.25 -37.63 75.31 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 122.289 -0.257 . . . . 3.29 110.607 175.559 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 21.0 ttmt -58.77 -12.32 4.18 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.966 0.906 . . . . 4.02 112.968 172.287 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 9.0 t80 -123.08 28.21 7.27 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.573 1.149 . . . . 6.44 110.47 173.176 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -66.06 -74.63 0.1 Allowed 'General case' 0 CA--C 1.53 0.181 0 O-C-N 121.247 -0.908 . . . . 3.8 110.604 -179.764 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.01 -17.2 64.35 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 121.619 -0.675 . . . . 4.05 110.999 -164.592 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 78.0 mm-40 -51.03 -21.63 1.91 Allowed 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.911 1.684 . . . . 2.06 112.354 166.125 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 1.9 mmpt? -80.07 -25.35 40.09 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 121.07 -1.019 . . . . 4.15 111.385 176.077 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 16.6 m-30 -94.07 -62.7 1.3 Allowed 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 125.435 1.494 . . . . 4.37 109.551 -179.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -105.65 -178.91 3.79 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 125.983 1.713 . . . . 2.99 107.864 -179.276 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 20.0 m -124.04 47.45 2.06 Favored 'General case' 0 N--CA 1.461 0.101 0 C-N-CA 123.123 0.569 . . . . 2.7 111.088 177.535 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 154.18 59.39 0.01 OUTLIER Glycine 0 CA--C 1.519 0.343 0 N-CA-C 110.019 -1.232 . . . . 1.62 110.019 179.147 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -91.1 -142.41 0.18 Allowed 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 108.558 -0.904 . . . . 2.05 108.558 175.104 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -123.26 41.69 3.4 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 123.91 0.884 . . . . 6.11 110.659 -175.831 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 4.2 mp0 -77.06 -36.84 55.64 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 125.296 1.439 . . . . 4.78 109.028 177.557 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -52.99 -44.85 67.53 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 114.75 -1.114 . . . . 1.96 110.54 178.026 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 23.8 m -67.87 113.47 5.63 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 121.7 0.762 . . . . 1.81 110.43 179.55 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -58.75 -41.95 87.71 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-N 114.737 -1.12 . . . . 2.95 111.002 177.591 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 15.8 m -47.66 -60.21 2.72 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 119.066 0.848 . . . . 1.6 111.318 173.634 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.74 -40.39 79.86 Favored 'General case' 0 N--CA 1.454 -0.229 0 O-C-N 121.896 -0.503 . . . . 3.41 109.932 -171.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 1.1 m -53.28 -47.74 68.92 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-O 122.06 0.933 . . . . 1.96 108.89 171.303 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 33.5 tttp -70.14 -27.77 64.82 Favored 'General case' 0 N--CA 1.44 -0.973 0 C-N-CA 124.236 1.014 . . . . 5.83 111.473 -174.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 52.5 m -55.94 -47.91 76.7 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 120.195 1.362 . . . . 1.79 109.998 168.189 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 9.0 mt -60.76 -58.21 9.43 Favored 'General case' 0 C--O 1.233 0.226 0 N-CA-C 109.47 -0.567 . . . . 3.16 109.47 172.612 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 2.6 ttp -46.96 -43.6 19.33 Favored 'General case' 0 CA--C 1.535 0.366 0 O-C-N 123.528 0.517 . . . . 4.29 112.39 -178.092 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -56.45 -45.92 80.58 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 125.886 1.675 . . . . 1.63 111.668 -173.34 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -84.91 -44.6 13.02 Favored 'General case' 0 CA--C 1.521 -0.137 0 N-CA-C 110.575 -0.157 . . . . 1.5 110.575 178.51 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -55.99 -45.4 79.02 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 122.706 0.403 . . . . 1.64 110.483 -176.644 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -73.75 77.8 1.56 Allowed 'General case' 0 N--CA 1.448 -0.566 0 CA-C-O 121.274 0.559 . . . . 0.93 109.571 177.325 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -76.19 45.48 0.37 Allowed 'General case' 0 CA--C 1.538 0.496 0 O-C-N 121.477 -0.764 . . . . 3.45 111.827 178.286 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 62.5 m-20 -135.37 -58.93 0.78 Allowed 'General case' 0 C--N 1.338 0.07 0 C-N-CA 125.463 1.505 . . . . 1.57 109.278 -177.517 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 103.26 45.67 1.54 Allowed Glycine 0 CA--C 1.532 1.106 0 N-CA-C 110.025 -1.23 . . . . 0.87 110.025 -163.329 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -124.6 -61.89 1.29 Allowed 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 125.078 1.351 . . . . 1.97 109.687 171.085 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 127.43 -24.28 5.3 Favored Glycine 0 CA--C 1.529 0.948 0 C-N-CA 124.678 1.133 . . . . 0.7 111.563 177.733 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 40.0 mtpt -80.71 114.08 19.34 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 106.823 -1.547 . . . . 4.99 106.823 175.544 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 5.5 mt -95.16 153.6 3.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 N-CA-C 107.232 -1.395 . . . . 1.85 107.232 -178.09 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -132.03 -179.35 16.14 Favored Glycine 0 CA--C 1.522 0.47 0 N-CA-C 108.903 -1.679 . . . . 1.3 108.903 175.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -66.06 -36.79 84.18 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 117.601 0.701 . . . . 1.83 110.404 -177.242 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 -60.02 -59.13 5.9 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-O 118.797 -0.62 . . . . 2.51 110.13 173.594 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -52.24 -47.98 65.44 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-O 121.767 0.794 . . . . 1.43 110.648 -179.664 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 58.7 t80 -62.46 -54.22 43.34 Favored 'General case' 0 N--CA 1.454 -0.27 0 O-C-N 121.821 -0.55 . . . . 5.0 110.363 -178.205 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 46.7 tt0 -55.44 -46.44 76.73 Favored 'General case' 0 C--O 1.22 -0.497 0 CA-C-O 118.294 -0.86 . . . . 2.58 110.613 177.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -51.96 -58.88 5.19 Favored 'General case' 0 CA--C 1.522 -0.126 0 CA-C-N 119.462 1.028 . . . . 3.09 110.075 176.67 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -55.8 -47.21 77.52 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 109.44 -0.578 . . . . 5.74 109.44 -179.475 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' VAL . . . . . 0.435 ' HA ' ' CE1' ' A' ' 31' ' ' PHE . 76.1 t -75.35 -6.06 8.08 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.795 0 C-N-CA 124.293 1.037 . . . . 1.91 112.552 -177.284 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 6.6 t60 -90.15 -11.58 40.75 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 120.086 -1.634 . . . . 3.7 110.221 173.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 28.5 t . . . . . 0 C--O 1.252 1.219 0 CA-C-O 114.935 -2.459 . . . . 2.31 114.016 -174.109 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.7 pp . . . . . 0 N--CA 1.465 0.289 0 CA-C-O 121.65 0.738 . . . . 1.98 111.942 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 12.9 t -65.91 -15.38 62.9 Favored 'General case' 0 N--CA 1.422 -1.844 0 C-N-CA 126.879 2.071 . . . . 2.74 111.616 -174.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 36.6 t0 -134.0 44.72 2.7 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.914 0.886 . . . . 2.86 109.537 -179.326 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 20.1 t -121.02 -61.82 2.09 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.229 0 C-N-CA 124.912 1.285 . . . . 2.45 109.4 177.636 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 9.1 tp -171.95 -61.55 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 104.991 -2.226 . . . . 2.78 104.991 -174.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -33.03 -37.83 0.03 OUTLIER 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 128.921 2.888 . . . . 2.67 115.8 -173.213 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -51.27 -41.12 60.18 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 118.94 0.791 . . . . 1.9 112.893 179.54 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.3 t0 -68.2 -45.5 73.17 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 122.86 1.314 . . . . 1.9 108.56 177.027 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -62.62 -47.63 82.9 Favored 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 125.143 1.377 . . . . 2.51 109.34 -170.171 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 26.6 pt -60.57 -38.28 77.8 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.877 0 C-N-CA 123.188 0.595 . . . . 1.94 111.394 176.402 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.84 -44.72 93.94 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 118.34 0.518 . . . . 1.86 110.045 177.484 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.85 -54.76 43.52 Favored 'General case' 0 C--O 1.234 0.247 0 O-C-N 122.174 -0.328 . . . . 2.0 110.471 172.055 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -48.55 -46.49 39.01 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 124.549 1.14 . . . . 1.73 111.272 -177.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -54.32 -43.44 71.17 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 124.6 1.16 . . . . 4.61 109.65 -179.475 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -77.99 -49.27 14.39 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 109.699 -0.482 . . . . 3.76 109.699 -176.096 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -59.69 -33.2 71.29 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 122.025 0.13 . . . . 3.2 110.904 -175.205 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 75.0 m -107.98 36.91 2.6 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 124.796 1.238 . . . . 2.15 110.493 177.359 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 53.7 ttt-85 -78.93 -30.86 44.91 Favored 'General case' 0 C--O 1.234 0.242 0 O-C-N 121.364 -0.835 . . . . 5.96 109.964 179.155 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 61.3 m-20 -74.27 144.87 82.18 Favored Pre-proline 0 CA--C 1.539 0.551 0 C-N-CA 123.789 0.836 . . . . 2.05 109.613 177.212 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -64.31 140.79 72.18 Favored 'Trans proline' 0 N--CA 1.456 -0.68 0 C-N-CA 123.505 2.803 . . . . 1.5 111.02 -176.087 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 62.73 10.83 4.45 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.084 1.353 . . . . 2.41 113.184 177.356 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 29.3 m -92.7 16.21 12.76 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.299 1.44 . . . . 1.93 110.957 -177.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 7.4 t80 -99.86 112.47 24.74 Favored 'General case' 0 N--CA 1.444 -0.764 0 N-CA-C 106.767 -1.568 . . . . 3.69 106.767 179.693 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -104.42 147.64 34.7 Favored Pre-proline 0 C--O 1.235 0.303 0 N-CA-C 108.257 -1.016 . . . . 4.86 108.257 167.598 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -62.05 -62.67 0.11 Allowed 'Trans proline' 0 N--CA 1.451 -1.015 0 C-N-CA 122.88 2.387 . . . . 0.67 111.176 -176.013 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 48.9 mt-30 -59.0 -40.63 85.5 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 123.177 0.591 . . . . 2.2 110.937 -173.684 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -50.45 -69.41 0.11 Allowed 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.54 1.136 . . . . 6.04 108.966 169.817 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 80.8 t80 -53.65 -43.39 68.77 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 123.583 0.753 . . . . 3.87 112.183 -175.216 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -50.59 -59.07 4.42 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 127.325 2.25 . . . . 6.05 109.983 177.093 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.73 -48.0 76.2 Favored 'General case' 0 N--CA 1.445 -0.693 0 N-CA-C 107.972 -1.121 . . . . 4.75 107.972 -177.072 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -63.35 -35.74 81.4 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 123.514 0.726 . . . . 1.61 112.914 -171.682 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 43.5 m -76.49 2.65 13.16 Favored 'General case' 0 N--CA 1.449 -0.518 0 O-C-N 123.705 0.628 . . . . 2.94 110.803 176.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 79.62 9.42 86.86 Favored Glycine 0 C--N 1.339 0.73 0 N-CA-C 110.951 -0.859 . . . . 0.9 110.951 169.258 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 50.0 mt -73.91 -24.06 59.63 Favored 'General case' 0 N--CA 1.441 -0.879 0 O-C-N 121.378 -1.072 . . . . 2.6 109.818 -172.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 26.3 p -66.29 -25.69 66.97 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.34 0.656 . . . . 3.41 111.063 168.853 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 13.1 tptt -86.27 -34.09 20.48 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 108.175 -1.046 . . . . 4.68 108.175 -177.726 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.4 ' O ' ' CB ' ' A' ' 40' ' ' SER . 36.2 mtt -47.67 -66.88 0.33 Allowed 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 114.702 1.371 . . . . 4.9 114.702 -177.064 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' SER . . . . . 0.4 ' CB ' ' O ' ' A' ' 39' ' ' MET . 42.1 t 113.99 139.93 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 128.714 2.806 . . . . 2.58 108.021 -172.788 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -37.22 -40.34 0.32 Allowed 'General case' 0 C--N 1.341 0.217 0 C-N-CA 125.206 1.402 . . . . 1.87 112.688 173.695 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 60.8 m-80 -56.9 -61.37 2.49 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-O 122.028 0.918 . . . . 2.71 109.703 -179.031 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 28.8 tt0 -70.43 -35.57 73.46 Favored 'General case' 0 N--CA 1.439 -1.002 0 CA-C-N 115.165 -0.925 . . . . 3.24 109.558 -176.244 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 51.8 t -59.26 -49.31 83.91 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.67 0 CA-C-N 119.063 0.847 . . . . 1.52 108.994 178.653 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -55.08 -46.78 75.49 Favored 'General case' 0 N--CA 1.455 -0.221 0 O-C-N 121.361 -0.837 . . . . 3.75 110.608 173.31 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 33.7 t0 -56.2 -55.36 34.08 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 118.076 0.398 . . . . 2.47 110.778 178.597 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 3.1 m -52.79 -44.4 47.75 Favored 'Isoleucine or valine' 0 C--N 1.342 0.27 0 CA-C-O 118.983 -0.532 . . . . 1.85 110.304 179.468 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 16.0 m-30 -49.98 -39.71 41.82 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 118.535 0.607 . . . . 7.12 112.067 177.109 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 69.0 mtp180 -58.89 -30.17 67.58 Favored 'General case' 0 CA--C 1.532 0.259 0 O-C-N 121.195 -0.941 . . . . 3.77 111.989 179.145 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 18.1 t80 -70.02 -25.14 63.44 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.503 0.721 . . . . 5.48 110.919 178.054 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 4.1 mp -125.69 99.61 6.08 Favored 'Isoleucine or valine' 0 C--N 1.342 0.266 0 C-N-CA 124.066 0.946 . . . . 3.69 111.206 -177.02 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 57.0 t0 -155.99 -49.04 0.08 Allowed 'General case' 0 C--O 1.223 -0.338 0 C-N-CA 125.979 1.712 . . . . 3.9 106.388 166.56 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 17.6 t-20 97.62 -52.88 0.01 OUTLIER 'General case' 0 C--N 1.34 0.195 0 C-N-CA 128.31 2.644 . . . . 4.87 107.825 -178.128 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 40.6 m-20 -56.88 -46.22 82.03 Favored 'General case' 0 CA--C 1.528 0.107 0 CA-C-O 121.455 0.645 . . . . 3.57 110.24 169.201 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 59.26 63.32 1.61 Allowed 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 114.468 -1.242 . . . . 4.79 109.491 -152.569 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 98.0 p -103.22 -43.69 5.39 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 127.185 2.194 . . . . 2.57 110.424 178.821 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 108.97 -11.73 34.5 Favored Glycine 0 CA--C 1.534 1.23 0 C-N-CA 124.591 1.091 . . . . 1.98 111.626 -166.447 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 76.6 m-85 -100.51 115.44 30.11 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 124.698 1.199 . . . . 4.74 109.187 175.412 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -87.43 81.51 7.8 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 125.889 1.676 . . . . 2.76 106.855 167.101 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -63.59 144.14 57.25 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 114.306 -1.316 . . . . 1.38 109.19 174.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -40.26 -51.35 2.73 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 125.247 1.419 . . . . 3.48 113.95 -171.056 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -71.57 -22.27 61.76 Favored 'General case' 0 N--CA 1.452 -0.325 0 O-C-N 121.274 -0.891 . . . . 3.54 112.14 -173.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 89.0 mt-10 -67.9 -38.42 82.96 Favored 'General case' 0 N--CA 1.456 -0.171 0 O-C-N 120.725 -1.235 . . . . 2.4 108.694 169.29 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -51.02 -47.35 61.67 Favored 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 109.231 -0.655 . . . . 3.58 109.231 171.714 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 29.3 ttpt -54.99 -13.57 1.17 Allowed 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 114.466 1.284 . . . . 3.09 114.466 176.234 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 78.8 m-85 -124.03 10.21 8.79 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 119.876 1.217 . . . . 6.57 112.289 173.61 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -49.76 -64.51 0.79 Allowed 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.89 1.276 . . . . 4.08 111.548 -169.321 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 70.2 mt -65.2 -12.86 55.7 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 113.443 0.905 . . . . 3.57 113.443 -176.79 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 11.1 mm-40 -61.31 -30.66 70.64 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 120.458 1.481 . . . . 2.22 110.505 -179.796 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.9 mptm? -59.74 -30.03 68.56 Favored 'General case' 0 CA--C 1.531 0.247 0 O-C-N 122.157 -0.339 . . . . 3.72 111.897 172.344 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 9.4 m-30 -86.75 -53.75 4.76 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 123.305 0.642 . . . . 4.31 109.659 -179.438 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -143.22 123.29 13.63 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.275 1.03 . . . . 3.7 108.493 -174.99 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 79.8 p -44.7 -37.12 3.5 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 126.423 1.889 . . . . 3.06 112.26 174.585 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -106.4 28.44 13.54 Favored Glycine 0 CA--C 1.525 0.669 0 C-N-CA 125.883 1.706 . . . . 2.06 111.946 -172.649 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -71.42 -165.85 0.16 Allowed 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 117.956 0.878 . . . . 1.82 111.681 174.546 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 6.0 tpt180 -113.48 -9.75 13.27 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 115.626 1.713 . . . . 3.88 115.626 -158.412 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 55.1 mm-40 -59.35 -6.9 1.11 Allowed 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 114.06 1.133 . . . . 4.57 114.06 -175.827 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -57.31 -39.97 76.92 Favored 'General case' 0 N--CA 1.446 -0.673 0 O-C-N 121.105 -0.997 . . . . 2.17 110.562 171.922 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 4.1 m -76.84 129.95 36.95 Favored 'General case' 0 C--N 1.345 0.385 0 C-N-CA 118.987 -1.085 . . . . 1.65 109.875 177.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -65.45 -43.81 89.22 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-N 115.285 -0.87 . . . . 3.25 110.677 177.497 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 73.7 m -50.11 -62.86 1.33 Allowed 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 119.41 1.005 . . . . 1.5 111.761 171.755 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -54.09 -42.51 69.45 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 118.207 0.458 . . . . 2.94 111.074 -177.532 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 5.8 m -57.7 -53.62 56.08 Favored 'General case' 0 C--N 1.34 0.179 0 CA-C-O 121.913 0.863 . . . . 2.17 109.785 173.824 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 8.5 tptt -58.67 -38.58 78.48 Favored 'General case' 0 N--CA 1.445 -0.722 0 C-N-CA 125.91 1.684 . . . . 4.53 110.591 -170.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 67.4 m -52.1 -46.99 65.49 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 118.988 0.813 . . . . 1.86 111.696 170.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -65.66 -56.38 12.44 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 108.298 -1.001 . . . . 3.02 108.298 177.542 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 3.5 ttp -45.3 -45.27 12.08 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.456 0.702 . . . . 4.24 111.991 178.628 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -58.84 -43.57 90.78 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 126.086 1.755 . . . . 1.92 112.21 -171.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -90.27 -31.66 16.88 Favored 'General case' 0 N--CA 1.461 0.098 0 C-N-CA 122.552 0.341 . . . . 1.46 111.45 -179.694 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -62.05 -48.56 79.69 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 123.025 0.53 . . . . 1.56 110.675 175.525 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -71.24 114.41 9.28 Favored 'General case' 0 N--CA 1.446 -0.626 0 N-CA-C 108.856 -0.794 . . . . 1.01 108.856 178.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 8.0 m-80 -110.22 37.14 2.8 Favored 'General case' 0 N--CA 1.463 0.202 0 N-CA-C 109.661 -0.496 . . . . 3.97 109.661 -179.135 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 32.9 m-20 -119.06 -47.53 2.48 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 125.093 1.357 . . . . 1.43 110.195 173.333 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 89.75 41.56 5.63 Favored Glycine 0 CA--C 1.53 0.989 0 N-CA-C 108.672 -1.771 . . . . 0.87 108.672 -155.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -121.94 -55.03 1.91 Allowed 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.363 1.065 . . . . 2.69 110.134 -179.861 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 121.44 -38.15 2.74 Favored Glycine 0 CA--C 1.527 0.828 0 C-N-CA 124.19 0.9 . . . . 0.7 111.253 176.78 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 77.9 mttt -69.58 121.87 17.95 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 107.384 -1.339 . . . . 5.19 107.384 176.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 9.0 mt -105.71 127.65 60.49 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.323 0 N-CA-C 108.603 -0.888 . . . . 1.83 108.603 -173.728 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -85.11 158.88 33.46 Favored Glycine 0 CA--C 1.528 0.905 0 N-CA-C 110.387 -1.085 . . . . 0.76 110.387 169.688 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -51.27 -34.82 34.52 Favored 'General case' 0 C--N 1.34 0.176 0 O-C-N 122.044 -0.68 . . . . 2.17 109.896 167.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 25.8 tt0 -61.67 -62.27 1.92 Allowed 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 123.57 0.748 . . . . 2.52 110.67 179.021 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -44.57 -48.61 10.31 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.164 0.985 . . . . 2.19 110.167 172.613 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -65.72 -42.05 91.53 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 115.956 -0.566 . . . . 3.92 111.522 -175.682 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 12.4 tt0 -61.19 -43.8 98.3 Favored 'General case' 0 C--O 1.222 -0.38 0 CA-C-O 118.166 -0.921 . . . . 3.81 108.962 173.697 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -54.15 -53.16 57.2 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 120.032 1.287 . . . . 3.12 110.916 176.57 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.97 -54.42 47.15 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 108.449 -0.945 . . . . 3.27 108.449 -179.026 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 92.5 t -74.9 -15.74 16.04 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 CA-C-N 115.308 -0.86 . . . . 1.94 112.866 -169.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 3.0 t60 -98.15 3.86 49.05 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 120.423 -1.423 . . . . 3.34 111.186 175.521 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 31.3 t . . . . . 0 C--O 1.254 1.297 0 CA-C-O 115.995 -1.955 . . . . 2.4 111.37 179.491 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.2 pp . . . . . 0 CA--C 1.539 0.538 0 CA-C-O 121.119 0.485 . . . . 2.53 110.275 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 2.8 t -82.44 52.37 2.04 Favored 'General case' 0 N--CA 1.438 -1.063 0 C-N-CA 125.979 1.712 . . . . 4.21 108.919 179.885 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -174.64 -50.89 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.126 0 C-N-CA 125.026 1.33 . . . . 3.11 108.394 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 24.2 t -51.08 -46.71 31.52 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 C-N-CA 124.144 0.978 . . . . 2.89 111.683 -177.734 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 11.7 tp -164.34 -58.47 0.03 OUTLIER 'General case' 0 CA--C 1.517 -0.305 0 N-CA-C 106.901 -1.518 . . . . 2.48 106.901 -177.229 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 2.3 m -49.26 -26.08 2.76 Favored 'General case' 0 C--O 1.215 -0.747 0 CA-C-O 117.785 -1.103 . . . . 1.86 112.948 -171.382 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -36.86 -48.46 0.75 Allowed 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 114.402 1.26 . . . . 2.57 114.402 168.741 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -70.17 -44.39 68.89 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-O 122.69 1.233 . . . . 2.09 109.375 -179.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -64.0 -41.57 97.44 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 124.612 1.165 . . . . 2.6 110.434 -173.365 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 45.8 pt -60.6 -39.74 82.38 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.811 0 O-C-N 121.289 -0.882 . . . . 2.81 110.299 175.153 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.16 -41.16 99.21 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 118.347 0.521 . . . . 1.87 109.788 178.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.48 -59.7 4.98 Favored 'General case' 0 CA--C 1.536 0.415 0 O-C-N 122.229 -0.294 . . . . 1.7 110.416 171.701 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -48.78 -47.52 41.9 Favored 'General case' 0 C--O 1.234 0.248 0 C-N-CA 125.842 1.657 . . . . 1.74 111.589 -176.525 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 18.9 tp -48.52 -43.86 35.63 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 126.199 1.799 . . . . 4.07 110.227 178.164 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -90.73 -42.98 10.4 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 110.052 -0.351 . . . . 3.87 110.052 -173.106 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -65.86 -34.46 78.2 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 122.379 0.271 . . . . 2.31 111.374 -173.657 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 58.2 m -123.18 62.93 1.01 Allowed 'General case' 0 C--O 1.234 0.263 0 C-N-CA 124.038 0.935 . . . . 2.13 108.495 171.777 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 36.4 ttt180 -82.5 -18.75 40.49 Favored 'General case' 0 CA--C 1.535 0.392 0 O-C-N 121.715 -0.616 . . . . 6.62 111.729 176.817 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -97.21 147.34 32.81 Favored Pre-proline 0 C--O 1.235 0.341 0 C-N-CA 124.986 1.315 . . . . 2.23 111.314 -166.429 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_endo -60.0 127.94 24.93 Favored 'Trans proline' 0 N--CA 1.452 -0.934 0 C-N-CA 123.049 2.499 . . . . 1.25 111.233 -173.658 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 41.7 m-20 76.29 18.44 1.87 Allowed 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 126.925 2.09 . . . . 2.92 111.944 169.36 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 7.2 m -90.15 -17.09 28.25 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.494 0.718 . . . . 1.74 111.989 -178.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -86.01 97.15 10.11 Favored 'General case' 0 CA--C 1.534 0.362 0 O-C-N 121.731 -0.606 . . . . 5.02 111.313 -157.857 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -80.44 155.47 74.02 Favored Pre-proline 0 CA--C 1.534 0.331 0 C-N-CA 123.918 0.887 . . . . 2.71 110.548 -178.938 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -70.81 -63.27 0.04 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.209 0 C-N-CA 122.534 2.156 . . . . 0.78 111.243 -177.636 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 38.2 mt-30 -61.12 -31.93 71.63 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 122.765 0.426 . . . . 2.46 110.867 -178.245 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.79 -64.43 0.96 Allowed 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 109.337 -0.616 . . . . 4.48 109.337 171.014 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 4.8 t80 -54.82 -48.38 72.88 Favored 'General case' 0 C--O 1.22 -0.469 0 C-N-CA 123.281 0.632 . . . . 3.55 110.676 -174.355 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -34.99 -64.09 0.29 Allowed 'General case' 0 C--O 1.234 0.267 0 C-N-CA 127.741 2.417 . . . . 6.34 111.837 171.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 -66.75 -48.61 68.58 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 108.747 -0.834 . . . . 3.32 108.747 -177.408 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -60.63 -25.57 66.39 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 123.582 0.753 . . . . 2.03 112.238 -174.627 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 30.7 t -89.82 -3.53 58.08 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 126.616 1.967 . . . . 2.39 111.086 -179.472 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 80.61 5.85 89.68 Favored Glycine 0 C--N 1.335 0.52 0 N-CA-C 111.326 -0.709 . . . . 0.88 111.326 172.359 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 80.7 mt -68.55 -26.57 65.48 Favored 'General case' 0 N--CA 1.445 -0.695 0 O-C-N 121.831 -0.805 . . . . 2.58 109.902 -177.153 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 24.2 t -64.02 -30.61 71.67 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.604 1.162 . . . . 2.59 111.387 169.117 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -86.6 -38.09 17.46 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 109.296 -0.631 . . . . 4.78 109.296 -176.353 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 28.6 mtt -56.18 128.13 34.1 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-O 120.968 0.413 . . . . 4.31 111.039 174.66 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 7.7 m -63.73 158.67 21.03 Favored 'General case' 0 N--CA 1.452 -0.335 0 O-C-N 121.74 -0.6 . . . . 2.86 110.057 173.428 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -43.01 -41.55 3.46 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 124.231 1.013 . . . . 2.02 111.983 177.005 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 7.8 m120 -55.0 -58.46 7.53 Favored 'General case' 0 N--CA 1.457 -0.093 0 C-N-CA 123.787 0.835 . . . . 3.94 110.075 177.648 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 13.4 mm-40 -60.49 -48.0 83.68 Favored 'General case' 0 C--O 1.219 -0.527 0 N-CA-C 109.555 -0.535 . . . . 2.85 109.555 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 77.1 t -54.55 -48.69 70.16 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 CA-C-N 118.975 0.807 . . . . 1.66 110.489 -179.645 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 63.9 tttt -74.9 -24.05 58.47 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 121.087 -1.008 . . . . 3.88 111.812 -178.784 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 61.3 t0 -66.66 -65.46 0.68 Allowed 'General case' 0 CA--C 1.529 0.151 0 N-CA-C 108.782 -0.821 . . . . 2.84 108.782 168.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 15.2 m -47.35 -50.88 7.2 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 C-N-CA 123.678 0.791 . . . . 1.76 110.805 179.406 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 20.9 m-85 -55.29 -43.77 75.07 Favored 'General case' 0 C--O 1.225 -0.225 0 CA-C-N 118.843 0.747 . . . . 8.19 111.975 177.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 84.0 mtm180 -68.37 -36.44 79.2 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 119.169 0.895 . . . . 7.13 112.261 176.524 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 49.4 t80 -63.96 -41.2 97.64 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 118.448 0.567 . . . . 4.07 109.509 -179.819 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.0 mp -78.02 -32.52 17.46 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 CA-C-O 118.607 -0.711 . . . . 3.44 111.975 177.003 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 52.4 t0 -66.98 75.57 0.12 Allowed 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 119.354 0.979 . . . . 1.86 108.983 170.501 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 25.3 t-20 -54.73 156.46 3.58 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 107.699 -1.223 . . . . 3.37 107.699 167.922 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 72.23 -44.77 0.6 Allowed 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 123.916 0.886 . . . . 3.48 113.118 -173.861 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 59.09 52.09 6.53 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 124.207 1.003 . . . . 4.51 111.312 -172.645 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 16.6 p -57.78 -6.98 0.6 Allowed 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.3 1.44 . . . . 2.02 113.093 166.419 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 73.78 14.07 80.18 Favored Glycine 0 CA--C 1.527 0.808 0 N-CA-C 110.0 -1.24 . . . . 1.61 110.0 -167.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 -148.06 141.93 25.78 Favored 'General case' 0 N--CA 1.441 -0.894 0 C-N-CA 124.929 1.292 . . . . 4.93 108.207 -179.235 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 4.9 mp -95.25 78.99 3.49 Favored 'General case' 0 N--CA 1.435 -1.212 0 N-CA-C 105.26 -2.126 . . . . 4.43 105.26 161.333 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -63.19 170.39 2.92 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-N 113.754 -1.566 . . . . 1.5 109.224 175.733 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -48.7 -57.33 6.45 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 120.059 1.299 . . . . 4.08 111.727 -171.255 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -45.32 -35.4 3.48 Favored 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 115.258 1.577 . . . . 3.51 115.258 172.082 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -57.86 -44.08 86.37 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 121.213 1.824 . . . . 3.46 109.379 174.498 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -77.89 16.81 0.65 Allowed 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 115.219 -0.901 . . . . 3.34 111.259 175.439 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 26.7 ttpt -106.22 5.78 30.19 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.825 1.25 . . . . 3.09 109.019 161.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 25.3 p90 -152.8 30.28 0.51 Allowed 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 118.606 0.639 . . . . 7.17 112.189 171.631 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 27.4 t80 -57.83 -61.75 2.3 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 119.116 0.871 . . . . 3.8 108.916 -179.277 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 1.3 mp -82.58 -13.91 55.75 Favored 'General case' 0 CA--C 1.535 0.374 0 O-C-N 120.951 -1.093 . . . . 3.47 113.238 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 48.9 mm-40 -69.5 14.06 0.11 Allowed 'General case' 0 CA--C 1.544 0.734 0 O-C-N 121.146 -0.971 . . . . 2.15 112.114 176.881 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.86 -25.85 12.46 Favored 'General case' 0 CA--C 1.533 0.293 0 O-C-N 120.21 -1.556 . . . . 4.77 110.326 165.28 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -81.14 -48.26 12.37 Favored 'General case' 0 N--CA 1.456 -0.159 0 N-CA-C 108.184 -1.043 . . . . 9.29 108.184 173.629 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -120.7 177.46 5.07 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 123.688 0.795 . . . . 4.03 110.672 -175.073 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 7.0 m -96.32 -28.16 14.62 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.704 1.202 . . . . 2.69 111.031 165.581 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -113.08 15.01 23.46 Favored Glycine 0 CA--C 1.527 0.802 0 C-N-CA 123.706 0.669 . . . . 1.66 112.081 -166.504 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -72.09 157.58 37.52 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 117.288 0.544 . . . . 2.07 111.059 -176.567 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.87 18.41 0.1 Allowed 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 115.597 1.702 . . . . 4.63 115.597 -159.228 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 73.1 mm-40 -58.96 -34.25 71.57 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 122.43 1.109 . . . . 3.96 111.718 -173.229 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -55.21 -35.4 64.83 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 114.764 -1.107 . . . . 1.6 111.912 175.759 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 52.6 m -76.6 106.03 8.01 Favored 'General case' 0 C--N 1.342 0.273 0 CA-C-N 119.117 0.871 . . . . 1.62 109.758 -179.045 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -56.17 -41.33 75.32 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 114.942 -1.027 . . . . 3.17 110.92 -176.605 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 69.8 m -62.38 -53.33 56.61 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.103 0.561 . . . . 2.51 111.864 -178.266 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -58.7 -46.63 86.84 Favored 'General case' 0 C--O 1.233 0.229 0 O-C-N 121.482 -0.761 . . . . 3.17 110.341 176.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -50.0 -51.17 43.87 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-O 121.545 0.688 . . . . 1.68 109.764 175.176 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 89.2 mttt -66.62 -28.25 68.34 Favored 'General case' 0 C--O 1.22 -0.481 0 C-N-CA 124.969 1.308 . . . . 5.81 111.61 -177.517 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 3.4 t -60.79 -47.19 87.46 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 119.561 1.073 . . . . 2.16 109.446 171.14 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -63.67 -51.3 65.72 Favored 'General case' 0 C--O 1.234 0.28 0 O-C-N 121.871 -0.518 . . . . 4.36 110.412 174.744 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 31.6 ttm -45.82 -50.97 13.6 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 123.263 0.352 . . . . 3.99 111.747 173.659 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -54.6 -46.27 73.76 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 125.831 1.652 . . . . 1.42 111.863 -169.177 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -86.54 -41.29 14.45 Favored 'General case' 0 C--O 1.226 -0.157 0 N-CA-C 111.635 0.235 . . . . 1.31 111.635 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -59.16 -39.3 82.03 Favored 'General case' 0 CA--C 1.521 -0.135 0 CA-C-N 118.092 0.406 . . . . 1.64 111.288 179.761 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 15.7 t0 -67.04 112.56 4.45 Favored 'General case' 0 N--CA 1.443 -0.811 0 N-CA-C 108.206 -1.035 . . . . 1.59 108.206 174.087 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 76.0 m-20 -93.14 4.97 53.09 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-O 118.747 -0.644 . . . . 2.9 110.908 -179.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 49.8 m-20 -99.71 -56.22 2.45 Favored 'General case' 0 C--N 1.345 0.404 0 CA-C-N 118.904 0.775 . . . . 1.21 110.975 -178.799 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 99.44 50.62 1.4 Allowed Glycine 0 CA--C 1.53 1.025 0 N-CA-C 108.69 -1.764 . . . . 0.8 108.69 -156.63 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 30.1 p-10 -134.74 -50.63 0.78 Allowed 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 126.191 1.796 . . . . 1.92 110.544 176.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 126.9 -46.87 1.05 Allowed Glycine 0 CA--C 1.521 0.428 0 C-N-CA 124.785 1.183 . . . . 0.83 110.716 170.473 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 6.3 ptpp? -57.21 136.29 56.46 Favored 'General case' 0 C--O 1.241 0.649 0 CA-C-N 117.282 0.541 . . . . 4.99 109.542 171.304 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 8.1 mt -125.41 114.6 40.45 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.197 0 C-N-CA 124.538 1.135 . . . . 1.56 108.646 -172.001 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -71.13 160.16 54.01 Favored Glycine 0 CA--C 1.531 1.032 0 N-CA-C 110.121 -1.192 . . . . 0.83 110.121 172.643 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -57.76 -36.91 72.75 Favored 'General case' 0 C--O 1.227 -0.12 0 O-C-N 121.848 -0.796 . . . . 2.49 109.354 171.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -47.51 -69.57 0.12 Allowed 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.98 0.912 . . . . 4.44 111.847 166.256 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -44.01 -46.46 8.36 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.428 1.091 . . . . 2.15 111.942 179.045 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -67.38 -50.16 60.88 Favored 'General case' 0 CA--C 1.541 0.629 0 O-C-N 121.997 -0.439 . . . . 4.96 111.869 -178.698 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 5.7 tm0? -62.22 -32.75 73.46 Favored 'General case' 0 C--O 1.223 -0.301 0 C-N-CA 124.083 0.953 . . . . 2.74 110.618 178.189 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -60.1 -60.11 4.35 Favored 'General case' 0 N--CA 1.456 -0.156 0 CA-C-N 119.123 0.874 . . . . 4.3 109.523 169.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 7.7 tpt -54.0 -44.32 70.77 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-O 121.072 0.463 . . . . 3.65 109.919 -174.019 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 46.0 t -72.44 -64.59 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.595 0 CA-C-N 115.872 -0.604 . . . . 1.95 111.403 178.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 22.5 t60 -58.17 -36.19 72.66 Favored 'General case' 0 C--N 1.331 -0.233 0 O-C-N 121.038 -1.039 . . . . 4.25 110.529 -169.529 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 80.6 p . . . . . 0 C--O 1.251 1.175 0 C-N-CA 125.938 1.695 . . . . 5.71 113.166 173.622 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 2.9 pt . . . . . 0 N--CA 1.463 0.181 0 CA-C-O 121.509 0.671 . . . . 3.16 112.237 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 11.9 t -54.51 -37.44 65.35 Favored 'General case' 0 N--CA 1.424 -1.763 0 C-N-CA 126.281 1.832 . . . . 3.08 112.355 -178.753 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 39.5 t0 -112.58 45.17 1.34 Allowed 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.769 0.828 . . . . 3.06 109.994 -175.635 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 66.1 t -120.05 -64.4 1.63 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.21 0 C-N-CA 124.23 1.012 . . . . 2.25 109.724 175.367 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -169.89 -54.45 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 106.704 -1.591 . . . . 2.15 106.704 -173.849 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 2.5 m -34.7 -29.61 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 129.507 3.123 . . . . 1.94 116.446 -172.185 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -49.08 -49.77 40.09 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 119.076 0.853 . . . . 1.74 111.939 172.781 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -63.03 -42.15 99.7 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-O 122.51 1.147 . . . . 2.09 109.484 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -68.29 -43.68 77.18 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-N 115.197 -0.911 . . . . 2.42 108.905 -171.647 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 10.0 pt -61.92 -37.49 78.37 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.943 0 O-C-N 121.21 -0.931 . . . . 2.78 111.526 174.029 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.44 -44.57 89.22 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 118.928 0.785 . . . . 1.69 110.305 175.331 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.21 -56.26 24.4 Favored 'General case' 0 CA--C 1.535 0.4 0 O-C-N 122.198 -0.314 . . . . 1.8 110.737 173.018 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -53.72 -44.19 69.67 Favored 'General case' 0 N--CA 1.457 -0.097 0 C-N-CA 124.691 1.196 . . . . 1.82 111.256 -175.579 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.9 tt -51.29 -38.72 54.4 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 125.302 1.441 . . . . 4.39 110.838 177.428 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 13.0 tt0 -89.18 -43.54 10.94 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 117.725 0.238 . . . . 2.91 110.807 -177.328 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -69.15 -34.74 75.46 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 117.865 0.302 . . . . 3.16 111.104 -175.528 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 19.6 t -108.29 52.62 0.71 Allowed 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 125.303 1.441 . . . . 3.19 109.462 175.416 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 5.8 ttt-85 -92.41 -46.92 7.43 Favored 'General case' 0 C--O 1.231 0.112 0 C-N-CA 123.426 0.69 . . . . 5.32 109.516 179.027 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -62.72 148.67 90.89 Favored Pre-proline 0 CA--C 1.537 0.471 0 C-N-CA 125.523 1.529 . . . . 2.81 109.483 178.665 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -67.83 138.58 45.12 Favored 'Trans proline' 0 N--CA 1.451 -1.022 0 C-N-CA 122.123 1.882 . . . . 1.54 111.386 -175.364 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 64.48 25.58 13.31 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 126.165 1.786 . . . . 2.36 111.695 170.78 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 8.6 m -91.53 -13.62 31.78 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 124.558 1.143 . . . . 2.54 111.574 -179.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 3.4 t80 -54.51 120.6 6.89 Favored 'General case' 0 CA--C 1.534 0.339 0 O-C-N 121.635 -0.666 . . . . 5.66 111.325 179.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -119.43 155.37 54.11 Favored Pre-proline 0 CA--C 1.537 0.477 0 C-N-CA 125.393 1.477 . . . . 2.42 109.665 169.674 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -67.19 -82.21 0.01 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.706 0 C-N-CA 123.736 2.958 . . . . 1.29 112.083 -176.085 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 47.1 mt-30 -49.31 -45.64 45.61 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 124.584 1.154 . . . . 2.76 111.189 -176.481 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -39.41 -68.2 0.18 Allowed 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 125.111 1.364 . . . . 3.3 110.004 166.963 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 25.2 t80 -65.05 -38.21 90.1 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 122.421 0.288 . . . . 4.56 111.291 -174.764 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 9.0 m-30 -57.41 -43.0 83.37 Favored 'General case' 0 CA--C 1.53 0.189 0 O-C-N 121.345 -0.847 . . . . 6.15 110.323 179.001 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -69.73 -52.45 25.31 Favored 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 109.481 -0.563 . . . . 2.74 109.481 174.643 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -63.64 -26.72 68.8 Favored 'General case' 0 N--CA 1.446 -0.63 0 C-N-CA 123.033 0.533 . . . . 1.6 111.559 -170.141 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 25.8 t -93.42 1.14 56.97 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 125.488 1.515 . . . . 2.41 111.787 178.623 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 88.79 -11.46 68.75 Favored Glycine 0 C--N 1.337 0.632 0 C-N-CA 124.276 0.941 . . . . 1.35 111.288 171.398 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 52.8 mt -65.15 -38.17 89.72 Favored 'General case' 0 N--CA 1.44 -0.936 0 C-N-CA 124.578 1.151 . . . . 2.26 111.367 -167.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 46.0 m -70.13 -20.6 63.16 Favored 'General case' 0 N--CA 1.461 0.106 0 CA-C-N 118.524 0.602 . . . . 3.43 111.954 174.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 13.2 tttt -86.65 -38.04 17.44 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 108.678 -0.86 . . . . 4.91 108.678 -178.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 31.1 mmt -58.87 131.47 51.08 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-O 121.588 0.709 . . . . 3.95 109.625 169.331 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -68.63 158.47 34.0 Favored 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 108.659 -0.867 . . . . 2.9 108.659 179.575 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -41.82 -42.58 2.71 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 124.407 1.083 . . . . 2.13 112.408 177.606 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -52.34 -55.11 23.71 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.523 0.729 . . . . 3.45 111.535 174.707 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 16.9 mm100 -69.0 -39.1 79.52 Favored 'General case' 0 N--CA 1.454 -0.234 0 O-C-N 122.04 -0.413 . . . . 2.89 110.426 -177.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 94.2 t -59.1 -41.14 82.65 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 O-C-N 121.568 -0.707 . . . . 1.71 109.408 175.736 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 83.2 tttt -64.47 -40.21 95.26 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.21 0.604 . . . . 3.17 111.023 175.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -57.5 -64.65 0.82 Allowed 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 118.759 0.709 . . . . 3.23 110.513 173.164 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 14.9 m -53.61 -45.27 59.64 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.306 0 N-CA-C 110.32 -0.252 . . . . 1.95 110.32 -175.71 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 14.6 t80 -40.96 -44.83 2.43 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 125.16 1.384 . . . . 6.19 112.72 172.67 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 47.4 mtp180 -58.63 -30.34 67.21 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 119.107 0.867 . . . . 3.49 112.071 -178.046 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -79.0 -38.07 37.6 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 123.291 0.636 . . . . 5.46 109.509 -178.559 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 4.1 mp -66.72 176.14 0.44 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.939 0 C-N-CA 124.319 1.048 . . . . 2.63 108.398 168.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 18.5 t70 73.67 -51.05 0.7 Allowed 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 127.199 2.2 . . . . 3.86 111.209 -174.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 7.1 t30 77.51 -42.09 0.38 Allowed 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 125.442 1.497 . . . . 1.85 112.581 175.456 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 86.1 m-20 -48.48 -52.32 22.94 Favored 'General case' 0 C--N 1.342 0.242 0 N-CA-C 108.237 -1.023 . . . . 3.14 108.237 165.302 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 91.88 -1.88 0.17 Allowed 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 128.817 2.847 . . . . 4.33 110.477 -164.565 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 95.5 p -46.75 -41.86 15.89 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 126.936 2.094 . . . . 2.25 111.309 168.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 87.3 -14.16 58.31 Favored Glycine 0 CA--C 1.528 0.892 0 C-N-CA 123.747 0.689 . . . . 2.66 113.073 -174.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 33.6 m-85 -76.86 100.75 5.63 Favored 'General case' 0 CA--C 1.511 -0.524 0 N-CA-C 107.064 -1.458 . . . . 3.61 107.064 165.113 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 8.6 mp -68.87 87.93 0.37 Allowed 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 106.137 -1.801 . . . . 3.86 106.137 163.012 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -67.28 152.18 46.18 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.133 1.373 . . . . 1.47 108.415 168.015 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -46.4 -53.83 10.27 Favored 'General case' 0 CA--C 1.535 0.374 0 O-C-N 121.229 -0.919 . . . . 3.76 112.973 -173.192 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -55.38 -27.7 49.2 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.256 0.622 . . . . 3.17 112.509 179.739 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 64.9 mt-10 -75.18 -29.29 60.34 Favored 'General case' 0 C--N 1.33 -0.268 0 O-C-N 120.083 -1.635 . . . . 2.44 111.074 177.376 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 17.4 mt -66.42 -20.65 66.11 Favored 'General case' 0 N--CA 1.449 -0.476 0 O-C-N 121.82 -0.55 . . . . 3.44 110.498 173.165 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 26.6 ttpt -63.52 -6.83 5.63 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.299 0.64 . . . . 2.99 111.843 168.054 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 20.6 p90 -135.33 31.37 3.18 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 120.061 1.3 . . . . 6.6 112.561 169.306 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -50.92 -70.45 0.08 Allowed 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 123.567 0.747 . . . . 3.45 112.304 -178.327 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 2.4 tp -77.94 -20.47 52.71 Favored 'General case' 0 CA--C 1.533 0.318 0 O-C-N 121.059 -1.026 . . . . 3.78 111.63 -179.8 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.07 -13.09 10.05 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.638 1.175 . . . . 2.71 111.111 175.684 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.56 -34.11 77.17 Favored 'General case' 0 N--CA 1.449 -0.479 0 O-C-N 120.996 -1.065 . . . . 3.71 111.991 170.413 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -90.62 -61.86 1.58 Allowed 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 108.06 -1.089 . . . . 8.68 108.06 178.09 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -104.1 -176.65 3.14 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 124.467 1.107 . . . . 3.58 108.418 -170.368 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 66.3 m -124.55 -15.57 6.55 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 119.639 1.109 . . . . 3.16 113.686 -177.801 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -131.72 39.34 1.78 Allowed Glycine 0 CA--C 1.525 0.681 0 C-N-CA 125.151 1.358 . . . . 1.75 111.007 -176.256 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -74.9 -134.51 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.183 0.993 . . . . 2.02 110.286 173.839 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . 0.414 ' HE ' ' CD ' ' A' ' 82' ' ' GLU . 5.4 tpt85 -124.47 -4.14 7.8 Favored 'General case' 0 CA--C 1.534 0.362 0 O-C-N 121.028 -1.045 . . . . 5.1 113.028 -168.057 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -57.18 -23.52 48.17 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.274 1.03 . . . . 3.12 112.956 -163.177 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.488 ' H ' ' CD2' ' A' ' 78' ' ' LEU . 0.0 OUTLIER -56.07 -42.19 76.27 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 125.104 1.362 . . . . 2.02 111.834 173.31 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 90.6 m -71.78 102.44 2.84 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 121.599 0.714 . . . . 2.03 110.258 -176.127 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -52.35 -42.1 63.62 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 114.663 -1.153 . . . . 3.09 111.754 -179.278 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 65.7 m -57.76 -40.64 80.25 Favored 'General case' 0 CA--C 1.531 0.23 0 O-C-N 121.342 -0.849 . . . . 1.42 112.308 177.331 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.414 ' CD ' ' HE ' ' A' ' 76' ' ' ARG . 46.6 mt-10 -79.39 -45.77 18.87 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 108.634 -0.876 . . . . 2.69 108.634 -172.705 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -47.79 -55.18 10.24 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-O 121.144 0.497 . . . . 1.71 110.136 167.658 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 27.4 pttt -71.54 -22.27 61.79 Favored 'General case' 0 C--O 1.217 -0.642 0 CA-C-O 118.535 -0.745 . . . . 6.45 111.132 -172.281 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 15.6 t -60.6 -49.83 75.96 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 119.965 1.257 . . . . 2.33 109.073 169.084 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.7 tt -58.16 -54.4 47.41 Favored 'General case' 0 C--N 1.342 0.256 0 N-CA-C 109.404 -0.591 . . . . 3.89 109.404 174.15 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 25.2 ttp -48.21 -52.54 20.54 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 121.046 0.451 . . . . 3.53 111.853 178.717 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -55.01 -40.62 70.36 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 126.293 1.837 . . . . 1.48 111.749 -169.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -92.41 -40.35 10.93 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 122.369 0.267 . . . . 1.34 111.701 -178.828 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -58.23 -40.39 81.58 Favored 'General case' 0 C--N 1.339 0.119 0 CA-C-N 118.123 0.42 . . . . 1.57 110.533 176.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -70.18 120.68 16.22 Favored 'General case' 0 N--CA 1.444 -0.768 0 N-CA-C 108.469 -0.938 . . . . 1.02 108.469 174.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 9.2 m-80 -106.53 12.78 29.14 Favored 'General case' 0 C--N 1.331 -0.21 0 C-N-CA 122.794 0.438 . . . . 3.16 111.152 -179.602 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 38.1 m-20 -99.1 -39.25 8.59 Favored 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 122.987 0.515 . . . . 1.38 109.901 178.09 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 86.09 38.98 8.18 Favored Glycine 0 CA--C 1.529 0.907 0 N-CA-C 108.753 -1.739 . . . . 0.82 108.753 -156.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -119.87 -58.77 1.86 Allowed 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 117.795 0.797 . . . . 2.47 111.089 -178.991 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 126.77 -38.93 2.07 Favored Glycine 0 CA--C 1.528 0.889 0 C-N-CA 124.171 0.891 . . . . 0.66 111.506 178.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 31.6 mmtp -60.81 117.25 5.17 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 108.141 -1.059 . . . . 4.75 108.141 173.798 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 6.8 mt -108.66 113.8 45.02 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.09 0 N-CA-C 109.317 -0.623 . . . . 1.54 109.317 -178.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -75.96 170.42 54.71 Favored Glycine 0 CA--C 1.53 1.015 0 N-CA-C 110.879 -0.888 . . . . 0.72 110.879 170.6 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -55.34 -42.39 73.77 Favored 'General case' 0 CA--C 1.515 -0.372 0 O-C-N 122.234 -0.568 . . . . 1.8 109.672 173.104 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.16 -63.54 1.26 Allowed 'General case' 0 N--CA 1.447 -0.576 0 O-C-N 124.264 0.977 . . . . 2.75 108.822 -177.057 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -42.25 -52.59 4.4 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.787 0.835 . . . . 1.35 111.769 173.139 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 42.3 t80 -59.76 -56.37 22.7 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-O 121.267 0.556 . . . . 4.79 110.603 -176.625 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -61.57 -37.91 85.6 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 124.764 1.226 . . . . 3.89 110.89 -176.264 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -54.61 -62.98 1.3 Allowed 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 119.411 1.005 . . . . 3.77 109.155 172.095 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 1.7 tpt -63.59 -37.59 87.89 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 120.622 -0.431 . . . . 4.52 111.417 -171.685 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 49.7 t -62.74 -48.21 89.24 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.22 0 C-N-CA 123.063 0.545 . . . . 1.84 110.886 174.024 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 83.9 t60 -67.83 -30.82 70.31 Favored 'General case' 0 N--CA 1.456 -0.141 0 C-N-CA 123.371 0.668 . . . . 3.01 110.55 -173.435 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 5.1 t . . . . . 0 C--O 1.251 1.159 0 C-N-CA 125.962 1.705 . . . . 2.95 112.141 177.694 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.5 pp . . . . . 0 CA--C 1.519 -0.224 0 CA-C-O 121.397 0.618 . . . . 1.98 111.139 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 62.8 p -58.12 -56.27 24.26 Favored 'General case' 0 N--CA 1.439 -1.004 0 C-N-CA 123.881 0.872 . . . . 4.5 108.81 -178.085 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 38.5 t0 -80.99 45.33 0.82 Allowed 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.929 2.091 . . . . 2.43 111.4 -169.73 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 73.9 t -143.46 -57.59 0.16 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.14 0 C-N-CA 126.832 2.053 . . . . 2.85 107.77 -178.085 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 4.2 tp -166.25 -56.11 0.03 OUTLIER 'General case' 0 C--N 1.334 -0.093 0 N-CA-C 106.302 -1.74 . . . . 2.16 106.302 -176.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -45.9 -23.57 0.3 Allowed 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 127.631 2.372 . . . . 2.55 115.496 -165.313 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -49.66 -47.57 49.95 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 119.558 1.072 . . . . 1.97 111.525 170.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -63.81 -39.81 95.13 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-O 122.449 1.119 . . . . 1.79 109.725 -179.414 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -72.76 -42.58 63.86 Favored 'General case' 0 N--CA 1.443 -0.792 0 C-N-CA 123.714 0.806 . . . . 2.44 109.987 -173.271 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 29.0 pt -61.92 -41.43 90.83 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.769 0 O-C-N 121.224 -0.923 . . . . 2.35 110.249 172.707 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.25 -46.53 76.07 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 118.947 0.794 . . . . 1.8 111.129 173.062 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -57.04 -59.14 5.5 Favored 'General case' 0 CA--C 1.536 0.41 0 O-C-N 121.617 -0.677 . . . . 1.61 110.837 174.046 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -46.11 -43.58 14.92 Favored 'General case' 0 CA--C 1.528 0.132 0 C-N-CA 125.633 1.573 . . . . 1.81 111.484 178.717 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 39.5 tp -60.26 -40.56 90.76 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 123.833 0.853 . . . . 3.65 110.508 -176.622 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 18.2 tt0 -87.91 -40.1 14.23 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 110.3 -0.259 . . . . 3.28 110.3 -173.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.4 pp20? -68.11 -49.19 62.7 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 109.232 -0.655 . . . . 3.4 109.232 -179.392 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -86.4 46.88 1.39 Allowed 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 124.543 1.137 . . . . 3.59 108.855 -179.608 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 61.1 ttt180 -87.29 -56.42 3.38 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 108.458 -0.941 . . . . 4.9 108.458 -176.351 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -55.13 131.35 68.62 Favored Pre-proline 0 N--CA 1.449 -0.508 0 CA-C-O 118.657 -0.687 . . . . 2.32 109.47 176.381 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -62.78 150.1 89.21 Favored 'Trans proline' 0 N--CA 1.453 -0.895 0 C-N-CA 122.443 2.095 . . . . 1.25 110.304 -173.813 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 66.99 3.78 3.27 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.902 1.681 . . . . 2.99 113.367 174.62 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 12.5 m -77.9 -7.74 57.14 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 120.783 -1.198 . . . . 1.76 111.981 -176.519 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 41.3 t80 -68.48 113.68 6.23 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 121.429 -0.794 . . . . 6.0 111.927 -173.114 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -102.87 155.61 36.35 Favored Pre-proline 0 CA--C 1.542 0.65 0 C-N-CA 125.396 1.478 . . . . 2.74 111.035 166.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.36 -71.8 0.02 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.531 0 C-N-CA 124.47 3.446 . . . . 0.96 112.575 -175.114 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 35.1 mt-30 -52.94 -46.35 68.08 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 123.734 0.814 . . . . 2.65 110.567 -178.428 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -44.56 -67.39 0.29 Allowed 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 124.931 1.292 . . . . 4.62 108.349 170.182 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 51.1 t80 -48.95 -52.96 21.83 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-O 118.635 -0.697 . . . . 4.14 111.768 178.47 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 16.9 m-85 -52.11 -45.46 64.9 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 119.486 1.039 . . . . 6.05 111.698 -176.441 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -72.87 -42.84 63.23 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 119.704 -0.798 . . . . 3.1 110.293 179.265 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -61.31 -36.28 79.69 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 123.357 0.663 . . . . 1.51 111.716 -178.517 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 57.7 p -83.03 -0.12 47.45 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 124.245 1.018 . . . . 2.87 111.206 178.848 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 82.19 -8.58 60.44 Favored Glycine 0 C--N 1.337 0.636 0 N-CA-C 110.773 -0.931 . . . . 1.04 110.773 176.363 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 75.0 mt -59.39 -38.03 79.5 Favored 'General case' 0 N--CA 1.442 -0.855 0 C-N-CA 124.456 1.102 . . . . 2.19 111.212 -174.381 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 21.3 m -71.45 -23.14 61.78 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 118.663 0.665 . . . . 3.26 112.057 176.352 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 6.8 ttpt -83.87 -36.36 23.47 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 109.124 -0.695 . . . . 5.24 109.124 179.008 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 14.2 mmt -59.95 135.72 57.79 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-O 121.631 0.729 . . . . 3.28 110.445 173.21 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 69.5 m -63.58 152.45 38.74 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 116.082 -0.508 . . . . 2.47 110.382 174.458 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -39.51 -40.76 0.9 Allowed 'General case' 0 C--O 1.224 -0.246 0 C-N-CA 125.674 1.59 . . . . 2.04 111.976 172.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 67.7 m-20 -52.33 -56.16 16.73 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.632 1.173 . . . . 2.12 111.45 176.103 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -72.65 -38.87 67.54 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 108.98 -0.748 . . . . 3.86 108.98 -174.922 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.422 ' CG1' ' CZ ' ' A' ' 48' ' ' PHE . 52.7 t -58.52 -47.77 87.39 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 CA-C-O 121.342 0.591 . . . . 1.64 109.557 175.565 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -55.58 -48.97 73.95 Favored 'General case' 0 N--CA 1.453 -0.291 0 O-C-N 121.228 -0.92 . . . . 3.65 109.952 173.84 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -57.31 -51.13 70.63 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 120.224 -0.59 . . . . 2.99 111.294 179.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 3.7 m -55.19 -42.14 64.17 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 O-C-N 121.785 -0.572 . . . . 1.82 110.484 178.186 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . 0.484 ' CZ ' ' HB3' ' A' ' 103' ' ' PHE . 17.3 m-30 -54.34 -34.42 61.03 Favored 'General case' 0 C--N 1.341 0.217 0 N-CA-C 113.027 0.751 . . . . 7.4 113.027 174.746 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 81.2 mtp180 -61.58 -40.53 95.09 Favored 'General case' 0 CA--C 1.529 0.154 0 CA-C-N 119.506 1.048 . . . . 5.15 109.975 174.882 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -64.5 -43.56 93.72 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 109.36 -0.607 . . . . 5.44 109.36 176.23 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 27.9 mm -58.09 -54.91 25.92 Favored 'Isoleucine or valine' 0 C--O 1.237 0.401 0 CA-C-O 118.799 -0.62 . . . . 2.82 110.874 177.64 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -75.89 64.19 1.81 Allowed 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 124.821 1.248 . . . . 1.92 109.326 -173.179 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 31.6 t30 -55.27 -32.83 62.68 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 125.869 1.668 . . . . 1.87 111.942 -174.139 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 16.6 p-10 -74.5 -29.05 61.26 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.947 1.699 . . . . 2.36 111.977 175.163 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 8.7 mt-30 57.31 60.64 2.83 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 125.285 1.434 . . . . 2.92 110.859 -173.152 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 79.1 p -89.34 -46.02 9.06 Favored 'General case' 0 C--N 1.337 0.048 0 C-N-CA 123.858 0.863 . . . . 1.9 111.134 174.193 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 113.47 -18.87 20.06 Favored Glycine 0 CA--C 1.531 1.066 0 C-N-CA 123.912 0.768 . . . . 1.49 111.42 -164.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 77.9 m-85 -118.48 142.8 47.22 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 124.073 0.949 . . . . 3.81 110.076 178.324 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -104.01 70.3 0.99 Allowed 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 124.648 1.179 . . . . 4.23 108.695 173.352 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -56.29 158.5 4.13 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.584 1.553 . . . . 2.04 111.472 176.931 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 54.9 mt-10 -43.67 -56.29 3.85 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 125.029 1.332 . . . . 3.41 113.633 -175.728 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 16.3 tt0 -62.88 -25.64 68.39 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 121.969 -0.457 . . . . 3.08 111.789 -178.633 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -71.02 -41.2 71.18 Favored 'General case' 0 N--CA 1.446 -0.652 0 O-C-N 121.109 -0.994 . . . . 2.81 109.272 175.205 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -53.78 -40.67 66.46 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 122.85 0.46 . . . . 4.05 110.416 172.629 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 21.3 ttpt -53.58 -16.55 1.6 Allowed 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.143 0.977 . . . . 2.84 112.814 174.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 59.5 m-85 -132.8 53.76 1.99 Allowed 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 118.923 0.783 . . . . 5.84 110.368 167.295 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 48.8 t80 -79.21 -75.84 0.23 Allowed 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.98 0.912 . . . . 3.62 109.97 173.787 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 1.7 tp -76.11 -8.91 58.07 Favored 'General case' 0 CA--C 1.542 0.636 0 O-C-N 120.438 -1.414 . . . . 3.39 112.341 -176.776 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 61.1 mm-40 -47.5 -49.43 25.91 Favored 'General case' 0 C--N 1.343 0.289 0 C-N-CA 124.264 1.025 . . . . 2.18 110.886 175.478 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.4 -11.25 14.62 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 112.919 0.711 . . . . 4.38 112.919 -177.958 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 13.4 m-30 -100.96 -60.13 1.58 Allowed 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 124.025 0.93 . . . . 4.92 110.067 178.688 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -101.21 -22.43 14.66 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 112.354 0.502 . . . . 3.51 112.354 -170.256 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 3.4 t 74.97 -50.7 0.67 Allowed 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 125.663 1.585 . . . . 2.99 110.654 -174.385 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -99.99 41.02 2.26 Favored Glycine 0 CA--C 1.526 0.777 0 O-C-N 121.239 -0.913 . . . . 1.68 111.065 179.096 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -80.98 -172.03 3.51 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 117.199 0.499 . . . . 2.05 111.287 179.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -87.84 -7.26 57.49 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 123.427 0.691 . . . . 3.77 112.536 -167.187 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -49.28 -35.55 18.2 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.453 1.501 . . . . 3.18 113.299 -163.426 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -52.08 -44.57 64.41 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.389 1.076 . . . . 1.74 112.025 173.58 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 32.1 m -65.1 107.71 1.62 Allowed 'General case' 0 C--O 1.236 0.366 0 CA-C-O 122.075 0.94 . . . . 1.87 110.294 179.025 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -58.29 -41.58 84.69 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 113.925 -1.489 . . . . 2.94 110.347 -178.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -48.1 -59.13 3.62 Favored 'General case' 0 C--O 1.225 -0.215 0 CA-C-N 118.863 0.756 . . . . 1.77 111.341 176.649 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 14.5 mt-10 -71.7 -42.68 67.08 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 123.795 0.838 . . . . 2.68 109.382 -168.049 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -49.08 -52.73 24.03 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 116.105 -0.498 . . . . 1.66 110.049 168.3 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 15.0 mmmt -69.17 -31.91 70.87 Favored 'General case' 0 C--O 1.22 -0.463 0 C-N-CA 123.402 0.681 . . . . 5.54 111.07 -174.323 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 70.9 m -58.26 -42.82 87.27 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 120.084 1.311 . . . . 1.7 110.644 170.2 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.33 -62.56 1.75 Allowed 'General case' 0 C--O 1.234 0.254 0 N-CA-C 108.397 -0.964 . . . . 3.79 108.397 172.062 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 9.7 ttm -49.27 -48.51 45.84 Favored 'General case' 0 CA--C 1.536 0.418 0 O-C-N 123.666 0.604 . . . . 5.35 112.435 -173.272 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -49.72 -46.04 49.84 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 126.627 1.971 . . . . 1.99 111.955 -178.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -83.63 -49.86 8.77 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 110.433 -0.21 . . . . 2.07 110.433 -177.689 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -54.46 -41.83 69.94 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 122.691 0.396 . . . . 1.71 111.681 -178.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -74.42 81.75 1.92 Allowed 'General case' 0 N--CA 1.446 -0.658 0 CA-C-O 121.352 0.596 . . . . 1.23 110.084 178.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 42.6 p-10 -77.46 49.88 0.76 Allowed 'General case' 0 CA--C 1.536 0.414 0 O-C-N 121.646 -0.659 . . . . 2.68 111.315 176.023 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 34.2 m-20 -137.53 -60.44 0.66 Allowed 'General case' 0 C--N 1.341 0.231 0 C-N-CA 126.356 1.862 . . . . 1.22 109.258 178.595 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 102.26 43.27 2.06 Favored Glycine 0 CA--C 1.533 1.199 0 C-N-CA 125.028 1.299 . . . . 1.08 110.247 -161.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -121.85 -61.53 1.49 Allowed 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.948 1.699 . . . . 1.94 109.552 173.427 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 119.55 -24.13 8.17 Favored Glycine 0 CA--C 1.53 0.975 0 C-N-CA 125.2 1.381 . . . . 0.79 111.28 -179.533 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 41.0 mttt -78.86 103.72 9.0 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 107.673 -1.232 . . . . 5.96 107.673 171.393 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 67.8 mt -94.43 118.92 41.57 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.577 0 N-CA-C 107.794 -1.188 . . . . 2.0 107.794 -176.121 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -72.51 166.87 53.83 Favored Glycine 0 CA--C 1.534 1.244 0 CA-C-O 121.69 0.606 . . . . 0.88 111.835 170.577 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -61.18 -37.15 81.92 Favored 'General case' 0 N--CA 1.456 -0.143 0 O-C-N 121.285 -1.127 . . . . 1.73 110.087 178.058 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 56.0 mt-10 -62.34 -55.81 24.45 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-O 118.686 -0.673 . . . . 2.75 110.552 176.173 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -43.7 -50.3 7.61 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-O 121.829 0.824 . . . . 1.44 110.008 173.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . 0.484 ' HB3' ' CZ ' ' A' ' 48' ' ' PHE . 0.8 OUTLIER -61.3 -54.2 47.0 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 112.868 0.692 . . . . 5.43 112.868 177.867 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 18.7 tt0 -53.66 -49.88 66.99 Favored 'General case' 0 C--O 1.223 -0.308 0 C-N-CA 124.55 1.14 . . . . 3.49 108.756 -178.714 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 65.4 mt-10 -48.99 -58.23 5.23 Favored 'General case' 0 C--O 1.232 0.165 0 C-N-CA 123.952 0.901 . . . . 3.46 110.064 176.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.3 -47.86 84.02 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 120.776 -0.37 . . . . 4.32 111.193 -175.518 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 37.4 t -58.67 -44.95 90.9 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.193 0 C-N-CA 122.974 0.509 . . . . 1.57 111.393 178.444 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 63.4 t60 -62.88 -30.08 71.24 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 125.65 1.58 . . . . 3.66 110.179 -173.268 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 2.9 t . . . . . 0 C--O 1.251 1.154 0 CA-C-O 116.848 -1.549 . . . . 2.77 111.701 -177.195 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.2 pp . . . . . 0 CA--C 1.529 0.157 0 CA-C-O 121.641 0.734 . . . . 2.5 110.035 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 9.9 t -74.12 7.78 2.51 Favored 'General case' 0 N--CA 1.436 -1.173 0 C-N-CA 126.574 1.95 . . . . 2.86 111.056 -174.486 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -168.38 45.84 0.04 OUTLIER 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 126.54 1.936 . . . . 3.62 105.804 -158.493 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -148.13 -50.83 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.529 0.152 0 CA-C-N 115.38 -0.827 . . . . 3.08 110.879 179.849 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 177.98 -56.1 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 105.945 -1.872 . . . . 2.19 105.945 -172.81 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 8.4 m -44.39 -32.92 1.49 Allowed 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 126.243 1.817 . . . . 1.63 115.393 -172.344 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -49.53 -43.9 46.02 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 119.489 1.041 . . . . 1.84 112.941 175.349 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 42.9 t0 -72.34 -39.24 68.28 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 122.725 1.25 . . . . 2.04 109.751 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 43.9 m-20 -62.16 -44.99 95.38 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 123.581 0.752 . . . . 2.51 110.276 -178.213 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 39.0 pt -62.83 -40.94 90.65 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.196 0 CA-C-O 118.231 -0.89 . . . . 1.99 110.13 177.479 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -52.36 -47.74 65.96 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 119.291 0.95 . . . . 1.83 111.043 174.538 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -54.17 -60.78 2.88 Favored 'General case' 0 CA--C 1.529 0.162 0 O-C-N 122.334 -0.229 . . . . 1.8 111.083 173.173 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -50.98 -48.63 61.15 Favored 'General case' 0 C--O 1.233 0.222 0 C-N-CA 123.269 0.628 . . . . 1.86 112.09 -177.77 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -48.73 -50.03 35.48 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 125.203 1.401 . . . . 5.02 110.053 178.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -79.23 -46.96 16.81 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 120.033 -0.667 . . . . 3.06 109.484 -174.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 43.9 tp10 -45.81 -50.4 14.16 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 124.507 1.123 . . . . 4.27 110.662 178.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 76.2 m -105.94 46.91 0.9 Allowed 'General case' 0 C--O 1.236 0.361 0 C-N-CA 123.053 0.541 . . . . 2.21 110.242 -178.078 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.24 -43.28 82.32 Favored 'General case' 0 C--N 1.343 0.322 0 CA-C-O 121.798 0.809 . . . . 7.99 109.078 -179.699 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -67.35 134.92 93.19 Favored Pre-proline 0 N--CA 1.442 -0.846 0 C-N-CA 125.885 1.674 . . . . 2.32 109.404 -173.223 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -63.76 148.31 92.09 Favored 'Trans proline' 0 N--CA 1.456 -0.705 0 C-N-CA 122.835 2.356 . . . . 1.29 112.01 -171.35 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 9.5 t70 69.27 -0.15 2.63 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 127.608 2.363 . . . . 3.68 113.639 179.172 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 14.9 m -77.55 -21.03 53.21 Favored 'General case' 0 C--N 1.341 0.215 0 N-CA-C 114.099 1.148 . . . . 2.22 114.099 -175.45 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -75.27 90.9 2.62 Favored 'General case' 0 CA--C 1.539 0.538 0 O-C-N 121.42 -0.8 . . . . 5.18 111.61 -165.063 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -77.48 155.11 81.61 Favored Pre-proline 0 CA--C 1.535 0.396 0 O-C-N 121.717 -0.614 . . . . 2.75 110.453 175.264 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -71.57 -67.23 0.03 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.108 0 C-N-CA 122.987 2.458 . . . . 0.92 111.804 -176.271 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 71.5 mt-30 -53.54 -44.6 69.34 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 118.565 0.62 . . . . 2.55 110.487 179.503 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 25.3 tptt -43.84 -62.29 1.16 Allowed 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.429 1.091 . . . . 3.72 110.062 169.105 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 16.0 t80 -53.6 -51.54 62.7 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.13 0.572 . . . . 4.23 111.406 179.025 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 7.4 m-30 -58.08 -34.69 70.42 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 121.593 -0.692 . . . . 6.34 111.576 -176.8 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 12.9 tt0 -73.58 -57.57 3.9 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 108.616 -0.883 . . . . 3.61 108.616 175.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -54.51 -38.03 66.03 Favored 'General case' 0 N--CA 1.444 -0.76 0 C-N-CA 124.829 1.252 . . . . 1.76 110.631 -172.605 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 69.2 m -88.6 1.78 54.34 Favored 'General case' 0 N--CA 1.445 -0.72 0 N-CA-C 112.926 0.713 . . . . 3.06 112.926 -177.165 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 76.83 -15.35 6.27 Favored Glycine 0 CA--C 1.532 1.147 0 O-C-N 119.951 -1.718 . . . . 1.48 112.836 172.295 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 94.2 mt -45.01 -35.24 2.82 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 127.445 2.298 . . . . 2.48 112.434 170.527 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 9.1 t -60.57 -37.99 83.11 Favored 'General case' 0 CA--C 1.529 0.157 0 O-C-N 121.683 -0.636 . . . . 2.59 110.57 176.281 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 29.1 tttp -89.45 -30.38 18.35 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-O 118.857 -0.592 . . . . 5.55 111.235 -174.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -31.73 -67.31 0.1 Allowed 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 125.852 1.661 . . . . 3.33 113.303 -174.545 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 26.1 m 135.34 143.97 0.0 OUTLIER 'General case' 0 C--O 1.234 0.242 0 C-N-CA 130.433 3.493 . . . . 2.44 106.719 -177.442 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -42.61 -41.9 3.23 Favored 'General case' 0 C--O 1.226 -0.179 0 C-N-CA 124.668 1.187 . . . . 1.66 111.393 175.485 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 50.2 m-20 -58.94 -57.74 11.73 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 123.616 0.766 . . . . 2.24 110.006 -176.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 3.4 mm-40 -62.42 -53.88 48.43 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 109.328 -0.619 . . . . 2.98 109.328 -178.353 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 70.0 t -49.62 -46.2 20.88 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.724 0 CA-C-O 121.664 0.745 . . . . 2.17 111.192 177.737 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -63.17 -46.22 88.14 Favored 'General case' 0 N--CA 1.452 -0.37 0 O-C-N 120.61 -1.306 . . . . 4.68 111.419 177.927 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -55.69 -52.03 65.27 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 118.191 0.451 . . . . 2.99 110.878 175.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 3.4 m -56.21 -42.94 74.98 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 C-N-CA 120.516 -0.474 . . . . 1.94 109.885 177.687 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 25.3 m-85 -60.49 -39.37 87.47 Favored 'General case' 0 C--N 1.342 0.253 0 CA-C-N 119.055 0.843 . . . . 8.07 112.35 176.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 43.5 mtp180 -58.49 -43.02 88.85 Favored 'General case' 0 C--N 1.339 0.111 0 CA-C-N 119.287 0.949 . . . . 4.21 110.918 171.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 27.3 t80 -58.98 -44.62 91.59 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 118.197 0.453 . . . . 5.47 110.249 177.619 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.6 mp -58.68 -49.34 82.98 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 CA-C-O 118.088 -0.958 . . . . 2.93 112.061 174.461 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 45.1 t0 -69.91 70.02 0.33 Allowed 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.275 1.03 . . . . 1.79 109.567 -175.259 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 20.3 t30 -61.81 -38.43 88.1 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 126.849 2.06 . . . . 1.8 111.958 -165.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -69.74 -25.48 63.85 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 125.471 1.509 . . . . 2.32 111.559 171.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 4.9 mt-30 65.2 36.08 7.37 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 125.693 1.597 . . . . 2.81 113.036 -179.703 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 70.9 p -57.8 -31.88 67.0 Favored 'General case' 0 CA--C 1.534 0.341 0 O-C-N 121.373 -0.829 . . . . 2.3 112.3 169.421 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 88.51 37.43 7.53 Favored Glycine 0 CA--C 1.526 0.772 0 N-CA-C 109.011 -1.636 . . . . 1.41 109.011 -164.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 11.8 m-85 -164.74 135.83 4.18 Favored 'General case' 0 CA--C 1.516 -0.356 0 C-N-CA 125.273 1.429 . . . . 4.01 108.796 -177.269 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -86.19 78.01 9.45 Favored 'General case' 0 N--CA 1.443 -0.786 0 N-CA-C 107.511 -1.292 . . . . 3.23 107.511 167.358 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -69.55 157.66 36.74 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 114.336 -1.302 . . . . 1.65 110.199 177.093 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -53.14 -51.51 61.71 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.422 1.089 . . . . 4.56 112.969 -168.281 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.9 tm-20 -59.92 -47.89 83.92 Favored 'General case' 0 CA--C 1.531 0.228 0 N-CA-C 109.719 -0.474 . . . . 4.04 109.719 -173.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -56.69 -36.26 69.41 Favored 'General case' 0 C--N 1.332 -0.18 0 C-N-CA 123.399 0.679 . . . . 2.38 111.219 177.611 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 7.0 tp -55.74 -34.68 65.4 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 122.496 0.318 . . . . 3.67 110.546 176.719 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 31.1 ttpt -62.73 -10.82 14.07 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.881 1.272 . . . . 2.86 112.761 174.252 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -124.85 18.99 8.56 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 126.089 1.756 . . . . 6.31 110.561 175.21 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 83.3 t80 -52.2 -70.99 0.07 Allowed 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.391 1.077 . . . . 3.44 111.689 -172.797 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.56 -19.24 62.18 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.495 0.718 . . . . 4.49 109.53 -176.597 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . 0.405 HE21 ' CD ' ' A' ' 77' ' ' GLU . 1.3 tt0 -71.31 1.52 6.06 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 126.608 1.963 . . . . 3.06 113.09 178.459 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.75 -32.06 59.83 Favored 'General case' 0 CA--C 1.529 0.156 0 O-C-N 121.308 -0.87 . . . . 4.1 110.496 159.817 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 4.4 m-30 -93.43 -58.74 2.2 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 124.289 1.036 . . . . 4.52 108.845 -174.228 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -96.01 -170.95 2.21 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 124.804 1.242 . . . . 2.92 107.898 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 23.8 m -136.35 48.68 2.13 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 123.603 0.761 . . . . 3.16 110.271 175.516 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 141.61 60.88 0.03 OUTLIER Glycine 0 C--N 1.336 0.554 0 N-CA-C 109.92 -1.272 . . . . 1.99 109.92 -178.594 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -89.17 -98.82 0.09 Allowed 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.038 0.535 . . . . 2.01 109.994 179.674 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -144.07 24.53 1.63 Allowed 'General case' 0 CA--C 1.528 0.12 0 CA-C-O 121.682 0.753 . . . . 4.58 111.51 -179.396 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.405 ' CD ' HE21 ' A' ' 69' ' ' GLN . 5.2 mp0 -72.29 -36.07 68.85 Favored 'General case' 0 N--CA 1.445 -0.717 0 C-N-CA 125.229 1.412 . . . . 4.69 108.7 -172.052 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -51.77 -56.48 13.6 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 126.305 1.842 . . . . 1.81 111.434 178.74 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 58.9 m -59.89 114.44 2.81 Favored 'General case' 0 C--N 1.341 0.231 0 N-CA-C 110.021 -0.363 . . . . 2.1 110.021 -173.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -64.97 -44.68 88.53 Favored 'General case' 0 N--CA 1.447 -0.609 0 N-CA-C 109.825 -0.435 . . . . 3.39 109.825 -176.149 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.5 m -50.9 -59.69 3.86 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 123.815 0.846 . . . . 1.74 110.374 177.058 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.93 -49.38 71.47 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 123.8 0.84 . . . . 2.8 110.737 178.98 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -58.83 -39.19 80.51 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 120.125 -0.63 . . . . 1.83 109.594 179.757 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 90.3 mttt -69.42 -27.61 65.42 Favored 'General case' 0 C--O 1.219 -0.51 0 C-N-CA 124.054 0.942 . . . . 5.5 111.388 177.81 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 14.6 m -58.36 -46.15 86.85 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 120.183 1.356 . . . . 1.67 109.907 169.806 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.3 mp -61.01 -59.79 4.82 Favored 'General case' 0 C--O 1.233 0.226 0 N-CA-C 109.829 -0.434 . . . . 4.19 109.829 170.077 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 29.8 ttp -46.09 -53.8 9.67 Favored 'General case' 0 C--O 1.221 -0.431 0 C-N-CA 123.06 0.544 . . . . 3.62 111.592 -175.209 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -47.41 -64.11 0.87 Allowed 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 127.456 2.302 . . . . 1.79 110.741 -174.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -65.07 -53.11 50.71 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 116.348 -0.387 . . . . 1.38 110.037 179.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -50.41 -39.29 46.78 Favored 'General case' 0 C--O 1.226 -0.143 0 N-CA-C 111.769 0.285 . . . . 1.72 111.769 -176.131 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -72.28 -58.33 3.49 Favored 'General case' 0 N--CA 1.445 -0.719 0 C-N-CA 124.124 0.97 . . . . 2.42 110.333 178.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 46.31 25.61 0.38 Allowed 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.344 1.458 . . . . 4.14 114.837 -175.039 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 69.2 m-20 -112.23 -45.16 3.31 Favored 'General case' 0 N--CA 1.463 0.192 0 C-N-CA 123.752 0.821 . . . . 1.85 109.452 177.178 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 97.68 39.81 3.79 Favored Glycine 0 CA--C 1.53 0.971 0 C-N-CA 125.681 1.61 . . . . 1.39 109.48 -161.792 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -127.39 -47.29 1.45 Allowed 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 118.386 1.093 . . . . 1.77 111.856 174.505 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 109.27 -27.89 11.87 Favored Glycine 0 CA--C 1.527 0.841 0 C-N-CA 124.175 0.893 . . . . 0.73 112.347 172.089 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 23.7 mttt -78.9 131.43 36.4 Favored 'General case' 0 C--O 1.241 0.642 0 N-CA-C 107.986 -1.116 . . . . 4.98 107.986 174.08 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 10.6 mt -123.8 106.14 16.62 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.457 0 C-N-CA 124.659 1.183 . . . . 1.96 108.426 -166.416 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -62.68 161.0 32.45 Favored Glycine 0 CA--C 1.53 0.981 0 N-CA-C 110.159 -1.176 . . . . 0.89 110.159 168.082 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -58.88 -37.08 75.75 Favored 'General case' 0 N--CA 1.453 -0.284 0 O-C-N 121.604 -0.939 . . . . 2.08 109.81 177.068 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 61.5 mt-10 -66.13 -47.89 72.6 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 122.947 0.499 . . . . 3.79 111.431 -179.594 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -47.88 -53.51 15.52 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 121.853 0.835 . . . . 1.95 109.632 170.495 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -66.92 -44.38 80.89 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 116.113 -0.494 . . . . 4.33 111.201 -173.285 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 10.1 tt0 -51.96 -54.38 30.28 Favored 'General case' 0 C--O 1.221 -0.439 0 C-N-CA 125.157 1.383 . . . . 3.2 109.515 172.356 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -48.36 -52.42 21.8 Favored 'General case' 0 C--O 1.231 0.097 0 CA-C-N 119.071 0.85 . . . . 4.0 110.212 177.231 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -61.88 -46.26 90.18 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 119.921 -0.712 . . . . 3.79 110.879 -176.937 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 44.0 t -59.97 -38.03 74.83 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.23 0 CA-C-O 119.196 -0.431 . . . . 1.98 111.828 175.181 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 2.0 t60 -64.66 -19.79 65.92 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 125.512 1.525 . . . . 3.31 109.997 -171.397 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 34.8 t . . . . . 0 C--O 1.254 1.296 0 CA-C-O 115.077 -2.392 . . . . 2.71 113.148 175.742 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.3 pp . . . . . 0 CA--C 1.534 0.336 0 CA-C-O 121.874 0.845 . . . . 2.15 110.784 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -68.21 -10.76 56.77 Favored 'General case' 0 N--CA 1.439 -0.989 0 C-N-CA 126.082 1.753 . . . . 2.88 112.014 179.013 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.0 t0 -135.83 32.5 2.97 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.096 1.359 . . . . 2.56 109.948 -174.238 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 11.2 m -125.34 -56.33 2.04 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 N-CA-C 112.576 0.584 . . . . 3.81 112.576 172.643 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 22.3 tp -171.55 -59.2 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.135 0 N-CA-C 106.131 -1.803 . . . . 2.55 106.131 -172.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 28.5 m -42.06 -35.78 0.98 Allowed 'General case' 0 C--O 1.217 -0.656 0 C-N-CA 125.501 1.52 . . . . 2.15 113.698 -175.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -40.68 -45.63 2.42 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 114.094 1.146 . . . . 2.11 114.094 172.245 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -70.9 -43.63 67.94 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 122.261 1.029 . . . . 1.78 109.597 179.352 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -62.83 -46.55 87.38 Favored 'General case' 0 N--CA 1.449 -0.518 0 C-N-CA 123.963 0.905 . . . . 2.55 109.966 -175.654 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 35.9 pt -58.94 -41.67 83.76 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.767 0 C-N-CA 123.752 0.821 . . . . 1.97 110.354 178.362 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.8 -46.76 84.19 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 110.267 -0.272 . . . . 2.25 110.267 176.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.49 -52.28 66.27 Favored 'General case' 0 CA--C 1.529 0.15 0 O-C-N 121.781 -0.574 . . . . 1.82 110.715 173.458 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -53.11 -43.82 67.15 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 124.769 1.227 . . . . 1.73 111.537 -176.259 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -55.36 -43.24 74.91 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 124.225 1.01 . . . . 4.55 109.017 176.455 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 21.7 mt-30 -77.23 -39.17 49.45 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-O 119.164 -0.446 . . . . 4.14 111.663 -176.513 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.34 -44.58 82.9 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 108.99 -0.744 . . . . 3.38 108.99 179.25 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 76.4 m -85.49 41.58 0.9 Allowed 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.219 1.008 . . . . 2.43 111.195 175.873 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 15.1 mtt180 -77.69 -55.58 5.23 Favored 'General case' 0 CA--C 1.518 -0.285 0 O-C-N 121.142 -0.974 . . . . 5.65 108.605 178.813 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -69.46 140.52 90.0 Favored Pre-proline 0 N--CA 1.448 -0.55 0 CA-C-N 115.83 -0.623 . . . . 2.72 109.509 -175.036 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -63.63 142.65 84.66 Favored 'Trans proline' 0 N--CA 1.449 -1.108 0 C-N-CA 122.208 1.939 . . . . 1.24 111.207 -175.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 17.8 t70 57.62 36.92 27.24 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 127.009 2.124 . . . . 3.62 112.179 178.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 24.4 m -102.31 -29.57 11.59 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.872 1.269 . . . . 1.8 111.281 177.085 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -53.87 125.44 18.64 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 125.688 1.595 . . . . 3.32 109.155 -177.488 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -119.64 152.06 52.79 Favored Pre-proline 0 C--O 1.232 0.134 0 C-N-CA 124.686 1.194 . . . . 2.18 108.294 172.537 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -64.94 -66.47 0.04 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.217 0 C-N-CA 122.707 2.271 . . . . 0.68 110.52 178.428 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 35.0 mt-30 -60.61 -36.53 78.82 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 122.978 0.511 . . . . 3.5 111.297 -175.103 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -58.5 -64.85 0.78 Allowed 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 109.316 -0.624 . . . . 5.96 109.316 173.108 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 55.9 t80 -56.6 -45.55 81.37 Favored 'General case' 0 C--O 1.221 -0.42 0 CA-C-O 121.427 0.632 . . . . 3.57 110.593 -174.717 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -41.29 -57.24 2.19 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 126.784 2.034 . . . . 5.92 111.047 176.422 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 12.0 mt-30 -70.96 -45.36 64.26 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 109.933 -0.395 . . . . 2.96 109.933 178.698 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -55.99 -29.06 59.74 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 123.11 0.564 . . . . 1.54 112.439 -179.001 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 14.7 t -88.5 -8.74 54.34 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 126.489 1.916 . . . . 2.33 110.429 -175.505 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 81.05 -1.99 82.7 Favored Glycine 0 C--N 1.34 0.795 0 O-C-N 121.322 -0.861 . . . . 0.86 111.04 174.047 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 85.0 mt -63.36 -28.85 70.27 Favored 'General case' 0 N--CA 1.441 -0.896 0 C-N-CA 124.737 1.215 . . . . 2.32 110.217 -176.246 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 60.4 p -63.02 -35.52 80.5 Favored 'General case' 0 C--N 1.338 0.102 0 C-N-CA 123.711 0.805 . . . . 3.46 111.62 171.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 7.5 tttt -82.79 -32.08 27.88 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 108.945 -0.761 . . . . 6.02 108.945 -176.158 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 21.5 mtt -57.62 124.66 19.84 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-O 121.088 0.471 . . . . 3.92 110.342 174.273 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 6.9 m -61.2 157.09 16.89 Favored 'General case' 0 N--CA 1.452 -0.368 0 O-C-N 121.525 -0.734 . . . . 2.18 110.15 172.171 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -43.33 -40.26 3.51 Favored 'General case' 0 C--O 1.225 -0.22 0 C-N-CA 124.031 0.932 . . . . 1.73 111.414 175.399 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 49.9 m-20 -47.02 -60.07 2.7 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 124.351 1.061 . . . . 2.44 110.381 174.559 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 30.6 mm100 -69.32 -43.56 73.47 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 115.778 -0.646 . . . . 3.25 109.547 -175.696 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 95.2 t -56.91 -45.89 83.6 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 CA-C-N 119.166 0.894 . . . . 1.65 110.087 -179.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 14.2 tttt -63.03 -43.15 99.49 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 109.598 -0.519 . . . . 4.43 109.598 176.206 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 27.0 t0 -61.75 -54.99 34.94 Favored 'General case' 0 CA--C 1.535 0.38 0 O-C-N 121.947 -0.471 . . . . 2.45 110.964 -179.098 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 15.0 m -55.19 -43.65 71.43 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.202 0 C-N-CA 123.045 0.538 . . . . 1.87 110.364 176.694 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -44.8 -48.25 10.95 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 118.679 0.672 . . . . 6.75 111.221 171.733 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 83.6 mtm180 -60.27 -30.91 69.75 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 118.807 0.731 . . . . 7.47 112.479 177.857 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 14.0 m-85 -70.46 -34.59 72.59 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 118.963 0.801 . . . . 5.22 111.105 172.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.421 ' CG2' ' H ' ' A' ' 52' ' ' ASP . 18.0 mm -77.83 -171.82 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.84 0 CA-C-N 118.994 0.816 . . . . 2.39 109.692 177.95 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . 0.421 ' H ' ' CG2' ' A' ' 51' ' ' ILE . 41.8 t0 75.55 -55.8 0.62 Allowed 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 127.331 2.253 . . . . 4.11 110.216 -178.472 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 11.3 t30 96.52 -54.41 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.187 0 C-N-CA 127.935 2.494 . . . . 2.13 108.437 -179.787 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -56.06 -35.23 66.72 Favored 'General case' 0 CA--C 1.529 0.14 0 C-N-CA 124.371 1.069 . . . . 2.37 111.642 170.937 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 75.8 mt-30 55.8 49.96 15.09 Favored 'General case' 0 CA--C 1.539 0.523 0 N-CA-C 109.19 -0.67 . . . . 5.47 109.19 -159.768 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 51.0 p -90.47 -44.25 9.73 Favored 'General case' 0 C--N 1.339 0.13 0 C-N-CA 123.422 0.689 . . . . 2.12 110.045 174.508 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 117.44 -37.88 3.16 Favored Glycine 0 C--N 1.336 0.573 0 N-CA-C 111.241 -0.743 . . . . 2.27 111.241 -177.411 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 11.2 m-85 -70.73 110.12 5.35 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 106.453 -1.684 . . . . 3.74 106.453 167.744 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -84.71 81.49 8.85 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 106.117 -1.808 . . . . 2.81 106.117 166.034 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -69.65 150.62 46.83 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 114.122 -1.399 . . . . 1.46 109.161 -179.628 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -47.76 -46.5 30.24 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.768 1.227 . . . . 3.9 112.112 -171.642 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -57.39 -39.99 77.28 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 123.143 0.577 . . . . 3.68 111.089 -178.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -71.54 -28.34 63.81 Favored 'General case' 0 CA--C 1.517 -0.289 0 O-C-N 120.959 -1.088 . . . . 2.53 110.399 -178.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.27 -30.36 59.96 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 119.285 -0.388 . . . . 3.33 110.375 170.137 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 31.5 ttpt -60.71 -9.92 4.63 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.093 0.957 . . . . 2.71 113.222 172.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 30.4 m-85 -132.39 23.12 4.41 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.299 1.039 . . . . 6.24 111.244 172.217 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 44.2 t80 -55.02 -65.54 0.56 Allowed 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 118.827 0.739 . . . . 3.84 110.742 -178.624 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 14.3 tp -84.35 -13.65 51.73 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.399 0.68 . . . . 3.6 111.598 -176.065 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 83.5 mm-40 -52.56 -57.02 11.31 Favored 'General case' 0 C--N 1.344 0.343 0 N-CA-C 109.006 -0.739 . . . . 2.13 109.006 173.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.78 42.31 0.37 Allowed 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 112.296 0.48 . . . . 3.14 112.296 -179.658 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -147.04 -56.87 0.26 Allowed 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 127.384 2.273 . . . . 4.45 106.404 -179.258 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -104.8 -46.34 4.34 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.516 1.126 . . . . 3.89 111.657 -178.295 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 19.9 m 81.4 109.13 0.07 Allowed 'General case' 0 C--N 1.34 0.182 0 C-N-CA 126.687 1.995 . . . . 3.9 110.358 -170.684 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 86.64 40.73 7.11 Favored Glycine 0 CA--C 1.525 0.711 0 N-CA-C 110.594 -1.002 . . . . 2.3 110.594 -179.597 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -85.88 -154.77 0.22 Allowed 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.041 0.937 . . . . 1.69 110.886 177.739 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 1.6 tpt85 -102.28 -9.26 20.55 Favored 'General case' 0 N--CA 1.463 0.182 0 C-N-CA 123.524 0.729 . . . . 5.37 112.684 -161.744 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -43.89 -39.75 4.12 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 129.253 3.021 . . . . 3.38 113.038 -167.004 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -50.55 -41.48 54.07 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 124.669 1.188 . . . . 2.23 111.991 176.128 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 63.7 m -65.33 109.47 2.28 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 108.63 -0.878 . . . . 1.65 108.63 171.722 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 16.5 pt-20 -54.95 -46.62 75.03 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-N 115.457 -0.792 . . . . 3.17 110.525 176.199 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.1 m -50.13 -58.08 6.31 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 119.457 1.026 . . . . 1.47 112.393 176.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -64.82 -40.52 95.34 Favored 'General case' 0 N--CA 1.453 -0.325 0 N-CA-C 109.836 -0.431 . . . . 2.7 109.836 -173.402 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -61.85 -44.92 95.86 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 122.515 1.15 . . . . 1.91 109.563 174.224 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -62.65 -31.62 72.52 Favored 'General case' 0 N--CA 1.444 -0.743 0 C-N-CA 124.898 1.279 . . . . 7.73 109.91 -176.406 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 50.6 m -53.82 -43.21 69.21 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 119.529 1.059 . . . . 1.91 111.284 171.087 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 8.0 mt -64.92 -56.61 12.27 Favored 'General case' 0 C--O 1.233 0.228 0 N-CA-C 109.184 -0.673 . . . . 3.08 109.184 170.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 7.7 ttm -43.59 -47.55 7.48 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 124.077 0.861 . . . . 3.93 112.056 -177.592 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -54.5 -46.86 73.55 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 127.661 2.384 . . . . 1.81 112.392 -173.47 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -87.08 -41.53 13.75 Favored 'General case' 0 CA--C 1.522 -0.111 0 CA-C-N 117.821 0.282 . . . . 2.19 110.783 179.18 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -54.83 -46.85 74.66 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 116.554 -0.294 . . . . 1.59 110.212 -179.252 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -73.7 77.97 1.54 Allowed 'General case' 0 N--CA 1.447 -0.589 0 CA-C-O 121.625 0.726 . . . . 0.98 109.7 178.669 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 51.4 p30 -77.07 41.58 0.29 Allowed 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.61 -0.681 . . . . 2.65 111.793 177.794 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 26.4 m-20 -128.14 -59.72 1.17 Allowed 'General case' 0 C--N 1.34 0.158 0 C-N-CA 126.614 1.966 . . . . 1.23 108.527 179.3 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 103.78 45.41 1.52 Allowed Glycine 0 CA--C 1.531 1.083 0 C-N-CA 125.19 1.376 . . . . 0.78 110.096 -164.129 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -125.1 -63.89 1.13 Allowed 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.58 1.552 . . . . 1.88 110.194 173.754 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 128.08 -30.8 3.82 Favored Glycine 0 CA--C 1.531 1.079 0 C-N-CA 124.885 1.231 . . . . 0.79 111.794 -179.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 37.9 mttp -73.17 108.4 6.03 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 108.153 -1.055 . . . . 5.48 108.153 169.439 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 18.1 mt -97.6 115.25 36.98 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.353 0 C-N-CA 123.952 0.901 . . . . 1.85 108.855 -174.393 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -69.93 164.9 51.34 Favored Glycine 0 CA--C 1.537 1.446 0 CA-C-N 118.73 0.696 . . . . 1.1 112.527 172.534 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -59.08 -39.56 82.5 Favored 'General case' 0 N--CA 1.456 -0.163 0 O-C-N 121.518 -0.989 . . . . 2.37 108.525 171.613 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -51.22 -57.94 7.48 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 124.344 1.057 . . . . 4.62 111.288 170.216 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -51.13 -48.1 61.86 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.133 0.973 . . . . 1.99 110.406 176.637 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -56.54 -60.3 3.74 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 112.349 0.5 . . . . 4.93 112.349 176.267 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -59.82 -35.69 75.23 Favored 'General case' 0 C--O 1.22 -0.467 0 CA-C-O 118.587 -0.721 . . . . 4.25 110.19 -178.286 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 17.8 mm-40 -57.5 -59.86 4.52 Favored 'General case' 0 N--CA 1.456 -0.128 0 CA-C-N 119.686 1.13 . . . . 3.21 109.654 174.068 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -56.14 -50.7 70.38 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-O 121.719 0.771 . . . . 4.8 109.119 -177.349 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 96.6 t -72.49 -30.6 34.96 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.761 0 CA-C-N 115.604 -0.726 . . . . 1.87 112.58 -172.528 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 15.2 t60 -95.16 15.36 19.31 Favored 'General case' 0 CA--C 1.532 0.286 0 O-C-N 120.117 -1.614 . . . . 4.18 110.952 178.367 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 5.8 t . . . . . 0 C--O 1.253 1.239 0 CA-C-O 116.868 -1.539 . . . . 3.56 109.142 179.661 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . 0.311 0.6 OUTLIER . . . . . 0 CA--C 1.548 0.882 0 N-CA-C 112.858 0.688 . . . . 2.62 112.858 . . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 5.7 t -38.77 -29.94 0.04 OUTLIER 'General case' 0 N--CA 1.442 -0.83 1 C-N-CA 133.036 4.535 . . . . 2.6 115.5 176.59 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 39.5 t0 -145.22 57.25 1.25 Allowed 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 121.822 0.82 . . . . 3.59 109.08 170.176 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 97.0 t -116.83 -59.47 3.1 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.17 0 CA-C-N 115.226 -0.897 . . . . 2.77 109.366 173.813 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 13.6 tp -169.67 -60.55 0.02 OUTLIER 'General case' 0 CA--C 1.519 -0.213 0 N-CA-C 106.075 -1.824 . . . . 2.7 106.075 -178.354 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -53.18 -20.42 3.94 Favored 'General case' 0 N--CA 1.446 -0.666 0 C-N-CA 125.507 1.523 . . . . 1.97 113.152 -172.012 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -50.13 -40.97 47.92 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 113.516 0.932 . . . . 1.93 113.516 169.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -70.87 -42.45 70.05 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 122.4 1.095 . . . . 1.85 109.264 176.013 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -65.29 -44.12 88.97 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 115.489 -0.778 . . . . 2.48 109.659 -172.538 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 36.3 pt -58.67 -39.15 75.37 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.671 0 O-C-N 120.855 -1.153 . . . . 1.94 111.066 175.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.63 -43.2 93.92 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 109.689 -0.486 . . . . 1.95 109.689 176.394 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.43 -56.66 19.24 Favored 'General case' 0 CA--C 1.535 0.397 0 O-C-N 122.115 -0.366 . . . . 1.6 110.419 172.699 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -50.34 -46.79 55.93 Favored 'General case' 0 C--O 1.231 0.116 0 C-N-CA 125.224 1.41 . . . . 1.5 111.448 -176.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.1 mt -50.01 -44.88 51.46 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.056 -0.975 . . . . 4.19 109.712 178.386 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.38 -46.5 17.48 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 109.763 -0.458 . . . . 5.88 109.763 -175.945 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.74 -28.26 66.65 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 121.207 -0.197 . . . . 2.74 111.416 -169.867 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 62.5 m -112.78 49.59 0.93 Allowed 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.887 1.275 . . . . 1.87 109.054 171.199 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -73.49 -33.65 64.91 Favored 'General case' 0 C--O 1.236 0.351 0 O-C-N 121.25 -0.906 . . . . 6.74 109.716 177.521 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -83.97 141.27 40.57 Favored Pre-proline 0 N--CA 1.449 -0.499 0 C-N-CA 125.456 1.502 . . . . 1.96 109.46 -171.205 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -59.96 148.94 86.85 Favored 'Trans proline' 0 N--CA 1.451 -0.98 0 C-N-CA 122.342 2.028 . . . . 1.21 110.441 -170.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 50.81 42.24 27.49 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 126.243 1.817 . . . . 2.65 111.333 173.525 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 10.4 m -109.65 -24.49 10.9 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 125.089 1.356 . . . . 1.88 112.869 179.451 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -53.38 112.51 0.91 Allowed 'General case' 0 N--CA 1.445 -0.718 0 C-N-CA 123.417 0.687 . . . . 4.22 112.141 -177.04 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -102.78 156.16 35.64 Favored Pre-proline 0 CA--C 1.539 0.531 0 C-N-CA 124.531 1.132 . . . . 2.63 109.836 173.663 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_endo -68.4 -78.42 0.01 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.883 0 C-N-CA 123.563 2.842 . . . . 1.31 112.187 -176.481 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 46.3 mt-30 -50.1 -43.91 51.78 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.991 0.916 . . . . 2.88 110.892 -178.562 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -44.59 -63.55 0.88 Allowed 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 124.266 1.026 . . . . 4.21 110.163 169.863 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 5.3 t80 -60.76 -42.47 97.52 Favored 'General case' 0 C--O 1.224 -0.266 0 CA-C-N 118.21 0.459 . . . . 3.46 110.915 -179.071 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 8.3 m-30 -56.08 -37.77 69.79 Favored 'General case' 0 CA--C 1.532 0.272 0 O-C-N 121.21 -0.931 . . . . 5.86 110.93 -179.242 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 12.6 tt0 -76.31 -53.27 8.44 Favored 'General case' 0 N--CA 1.456 -0.134 0 O-C-N 121.921 -0.487 . . . . 3.0 110.101 174.119 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -66.3 -17.39 64.73 Favored 'General case' 0 N--CA 1.447 -0.608 0 C-N-CA 123.557 0.743 . . . . 1.91 112.618 -171.931 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 2.6 t -96.41 -3.82 42.87 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 125.747 1.619 . . . . 2.27 111.154 176.236 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 80.43 -21.78 5.02 Favored Glycine 0 CA--C 1.532 1.144 0 O-C-N 120.662 -1.274 . . . . 0.94 112.308 178.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -40.75 -48.02 2.94 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 126.968 2.107 . . . . 3.97 114.018 178.32 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 43.6 p -68.47 -26.15 65.34 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 118.873 0.761 . . . . 3.24 112.016 -179.731 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 22.2 tttt -78.89 -38.0 38.66 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 107.903 -1.147 . . . . 5.12 107.903 178.345 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 9.8 mmt -62.64 139.47 58.64 Favored 'General case' 0 N--CA 1.44 -0.95 0 CA-C-O 121.575 0.703 . . . . 4.75 109.541 176.006 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 44.5 p -74.97 162.07 28.92 Favored 'General case' 0 N--CA 1.449 -0.48 0 O-C-N 121.759 -0.588 . . . . 2.73 109.889 -179.164 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -45.7 -35.99 4.61 Favored 'General case' 0 C--O 1.225 -0.223 0 C-N-CA 124.235 1.014 . . . . 1.85 112.239 176.738 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -49.9 -60.34 3.01 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 123.331 0.652 . . . . 2.77 110.681 172.334 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 5.8 mm100 -69.38 -42.38 75.23 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-O 119.134 -0.46 . . . . 2.77 109.948 -176.776 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 60.7 t -59.55 -38.41 75.22 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-N 119.148 0.885 . . . . 1.78 110.051 179.363 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 54.8 tttp -63.62 -48.92 75.35 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 118.719 0.69 . . . . 3.65 110.245 174.079 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -55.65 -57.55 11.51 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 120.626 0.251 . . . . 3.12 110.709 -179.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 5.5 m -57.91 -46.94 87.45 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.214 0 N-CA-C 109.579 -0.526 . . . . 1.87 109.579 177.776 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 13.8 t80 -46.15 -48.46 17.39 Favored 'General case' 0 C--O 1.224 -0.285 0 CA-C-O 118.454 -0.784 . . . . 5.36 110.663 177.243 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 76.2 mtp180 -54.74 -40.59 69.46 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-N 119.302 0.956 . . . . 4.58 111.493 177.169 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -63.78 -41.26 97.98 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 110.242 -0.281 . . . . 5.2 110.242 176.487 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.3 mp -65.42 -42.09 92.63 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.687 0 O-C-N 121.623 -0.673 . . . . 2.99 110.716 176.396 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 54.3 t0 -75.76 63.09 1.59 Allowed 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 124.933 1.293 . . . . 1.95 110.073 179.311 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -47.11 144.11 2.79 Favored 'General case' 0 C--O 1.232 0.175 0 N-CA-C 107.715 -1.217 . . . . 3.64 107.715 168.008 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 75.91 -33.82 0.23 Allowed 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 125.048 1.339 . . . . 3.4 112.209 -173.86 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 56.75 41.08 28.71 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 124.7 1.2 . . . . 4.59 111.532 -175.275 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 11.8 p -48.22 -32.15 6.75 Favored 'General case' 0 C--N 1.341 0.238 0 C-N-CA 126.36 1.864 . . . . 2.13 112.196 176.02 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 113.34 -17.79 21.22 Favored Glycine 0 CA--C 1.525 0.673 0 N-CA-C 109.365 -1.494 . . . . 2.34 109.365 -164.229 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 84.7 m-85 -135.39 159.44 41.57 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-O 123.041 1.4 . . . . 3.35 112.005 179.727 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -98.21 73.8 2.2 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 105.426 -2.064 . . . . 3.23 105.426 164.731 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -55.17 146.22 19.27 Favored 'General case' 0 CA--C 1.545 0.765 0 CA-C-N 113.807 -1.542 . . . . 1.61 108.815 172.376 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -50.15 -54.45 20.67 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 113.952 1.093 . . . . 3.34 113.952 -160.937 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 64.5 mt-10 -55.34 -31.69 61.92 Favored 'General case' 0 CA--C 1.535 0.368 0 O-C-N 121.589 -0.695 . . . . 3.59 111.982 177.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -71.14 -43.09 68.24 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 123.149 0.58 . . . . 2.38 109.614 176.767 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -51.6 -36.01 43.87 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.471 1.108 . . . . 3.75 110.398 173.225 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 10.8 ttmt -46.82 -60.84 2.16 Favored 'General case' 0 N--CA 1.464 0.272 0 O-C-N 121.879 -0.513 . . . . 3.31 110.309 169.752 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -73.38 60.48 0.62 Allowed 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.91 0.884 . . . . 6.01 109.981 177.62 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -89.03 -69.38 0.71 Allowed 'General case' 0 C--N 1.331 -0.223 0 O-C-N 120.533 -1.354 . . . . 4.16 108.193 175.592 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 5.8 mp -68.18 -26.24 65.64 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 122.718 0.407 . . . . 4.39 111.368 -173.424 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -72.95 0.61 10.74 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 123.999 0.92 . . . . 3.55 113.132 -176.25 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 7.1 mptt -70.83 -32.2 69.18 Favored 'General case' 0 N--CA 1.455 -0.215 0 O-C-N 121.405 -0.809 . . . . 5.01 109.823 161.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -92.4 -58.17 2.46 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 123.335 0.654 . . . . 4.51 109.322 -172.087 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -98.31 175.97 5.87 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 123.597 0.759 . . . . 3.04 109.095 -178.055 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 15.9 p -109.51 -9.68 14.9 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 124.01 0.924 . . . . 3.3 112.29 171.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -137.95 41.27 1.39 Allowed Glycine 0 CA--C 1.527 0.802 0 N-CA-C 111.079 -0.809 . . . . 1.75 111.079 179.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -83.67 -177.5 6.72 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-O 121.948 0.88 . . . . 2.08 111.422 176.544 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 2.2 tpt180 -89.04 24.2 2.18 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.121 1.369 . . . . 4.01 113.409 -162.596 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -53.52 -55.58 24.28 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-O 122.54 1.162 . . . . 6.74 111.344 -176.006 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -49.85 -35.53 23.56 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 126.87 2.068 . . . . 2.39 112.678 -177.857 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 19.3 m -70.68 102.4 2.28 Favored 'General case' 0 CA--C 1.514 -0.41 0 C-N-CA 118.558 -1.257 . . . . 1.68 109.172 176.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -62.24 -40.15 95.21 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 113.153 -1.839 . . . . 3.65 109.371 -177.559 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 18.4 m -49.73 -51.82 36.06 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 120.391 1.45 . . . . 1.4 112.585 171.671 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -69.93 -46.78 64.62 Favored 'General case' 0 C--O 1.234 0.261 0 N-CA-C 108.903 -0.777 . . . . 2.65 108.903 -172.216 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -54.1 -48.88 70.24 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-O 122.059 0.933 . . . . 1.62 109.362 174.852 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 8.0 tmtt? -74.3 -29.61 61.71 Favored 'General case' 0 N--CA 1.442 -0.829 0 C-N-CA 124.869 1.268 . . . . 6.49 110.245 -170.707 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 23.2 t -57.57 -51.12 70.78 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 119.232 0.924 . . . . 2.26 108.642 170.317 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -60.39 -51.66 68.53 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-O 119.296 -0.383 . . . . 4.65 110.125 176.25 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 37.1 ttp -50.19 -44.33 52.94 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 117.798 0.272 . . . . 3.36 111.675 175.712 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -55.3 -45.49 76.25 Favored 'General case' 0 C--O 1.226 -0.172 0 C-N-CA 125.117 1.367 . . . . 1.89 111.226 -171.577 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -88.46 -43.99 11.05 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 116.345 -0.389 . . . . 2.06 110.702 -178.331 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -54.95 -41.94 71.71 Favored 'General case' 0 C--N 1.339 0.142 0 CA-C-N 117.809 0.277 . . . . 1.72 110.694 178.722 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -74.39 104.34 5.09 Favored 'General case' 0 N--CA 1.442 -0.841 0 N-CA-C 108.264 -1.013 . . . . 1.21 108.264 175.145 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 24.1 p30 -99.1 5.87 46.76 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-O 119.525 -0.274 . . . . 2.87 111.599 -177.832 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 45.7 m-20 -79.88 -52.22 8.15 Favored 'General case' 0 C--N 1.341 0.198 0 N-CA-C 108.944 -0.761 . . . . 1.4 108.944 167.472 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 91.64 44.75 4.17 Favored Glycine 0 CA--C 1.529 0.929 0 N-CA-C 109.275 -1.53 . . . . 0.89 109.275 -157.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -126.26 -48.66 1.57 Allowed 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 124.641 1.176 . . . . 2.46 110.533 177.47 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 126.52 -46.1 1.11 Allowed Glycine 0 C--N 1.337 0.585 0 C-N-CA 124.606 1.098 . . . . 0.75 110.372 171.111 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -60.12 114.89 3.1 Favored 'General case' 0 C--O 1.237 0.446 0 N-CA-C 108.915 -0.772 . . . . 4.25 108.915 174.099 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 7.2 mt -97.94 153.71 3.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 C-N-CA 124.781 1.233 . . . . 2.07 108.693 177.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -126.62 178.85 16.6 Favored Glycine 0 CA--C 1.526 0.747 0 N-CA-C 109.062 -1.615 . . . . 1.51 109.062 174.398 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -61.41 -47.25 86.63 Favored 'General case' 0 CA--C 1.516 -0.335 0 O-C-N 122.437 -0.449 . . . . 2.27 109.822 -175.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -55.33 -68.27 0.21 Allowed 'General case' 0 N--CA 1.447 -0.588 0 O-C-N 124.573 1.171 . . . . 3.68 109.179 176.043 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -38.28 -49.72 1.41 Allowed 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.82 0.848 . . . . 1.66 112.153 176.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 63.0 t80 -61.69 -56.76 16.21 Favored 'General case' 0 CA--C 1.537 0.451 0 O-C-N 122.399 -0.188 . . . . 4.97 111.111 179.652 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 33.4 tp60 -57.55 -47.55 81.74 Favored 'General case' 0 C--O 1.218 -0.6 0 CA-C-O 117.281 -1.342 . . . . 5.9 110.727 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -44.95 -56.59 4.45 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 120.793 1.633 . . . . 3.79 110.528 176.286 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -64.57 -47.55 78.28 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 120.18 -0.608 . . . . 4.34 110.465 -177.301 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 42.8 t -56.22 -35.42 42.41 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.462 0 C-N-CA 123.058 0.543 . . . . 2.02 112.379 176.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 52.3 t60 -73.38 -22.08 60.35 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 125.958 1.703 . . . . 3.62 110.934 -174.395 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 23.2 t . . . . . 0 C--O 1.253 1.285 0 CA-C-O 115.066 -2.397 . . . . 2.63 112.866 -176.181 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.2 pp . . . . . 0 CA--C 1.533 0.318 0 CA-C-O 121.306 0.574 . . . . 2.07 111.349 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -60.76 -29.4 69.39 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 123.731 0.813 . . . . 2.69 111.684 -175.189 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 48.0 t0 -122.18 55.84 1.12 Allowed 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 107.937 -1.134 . . . . 2.55 107.937 -176.531 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -135.72 -52.67 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.222 0 CA-C-N 115.739 -0.664 . . . . 3.37 111.498 176.345 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 179.85 -60.8 0.01 OUTLIER 'General case' 0 N--CA 1.456 -0.135 0 N-CA-C 106.368 -1.716 . . . . 2.06 106.368 -173.386 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 25.5 m -49.94 -17.5 0.39 Allowed 'General case' 0 C--O 1.219 -0.53 0 N-CA-C 115.659 1.726 . . . . 2.94 115.659 -169.36 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -49.33 -46.13 46.4 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 121.157 1.799 . . . . 2.07 112.151 168.381 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -66.17 -42.47 88.91 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 122.534 1.159 . . . . 2.08 109.845 179.0 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -69.1 -41.08 77.93 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 115.341 -0.845 . . . . 2.71 109.247 -172.454 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 29.0 pt -63.52 -39.76 86.51 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.748 0 O-C-N 120.477 -1.39 . . . . 1.61 110.78 173.37 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.57 -45.38 77.35 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 118.784 0.72 . . . . 1.62 110.19 174.289 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -55.91 -57.34 12.5 Favored 'General case' 0 CA--C 1.531 0.241 0 O-C-N 122.18 -0.325 . . . . 1.9 110.975 171.131 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -48.45 -48.22 37.73 Favored 'General case' 0 C--O 1.231 0.098 0 C-N-CA 124.101 0.96 . . . . 1.64 111.394 -177.421 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -52.23 -41.85 63.11 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 125.219 1.408 . . . . 3.81 109.741 -177.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 38.4 tt0 -87.61 -49.36 7.22 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 117.747 0.248 . . . . 4.73 110.835 -176.466 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 24.7 tp10 -47.49 -49.75 24.94 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 125.203 1.401 . . . . 3.7 110.301 178.214 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 79.3 m -111.02 55.81 0.65 Allowed 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 108.007 -1.108 . . . . 2.34 108.007 178.169 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 71.2 ttt180 -77.95 -55.0 5.66 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 119.73 1.15 . . . . 4.77 108.695 178.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -52.12 140.21 32.89 Favored Pre-proline 0 N--CA 1.446 -0.652 0 C-N-CA 124.795 1.238 . . . . 2.29 110.922 -178.163 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -57.8 151.53 55.68 Favored 'Trans proline' 0 N--CA 1.453 -0.873 0 C-N-CA 123.377 2.718 . . . . 1.21 110.441 -176.075 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 13.2 t70 69.52 -22.66 0.15 Allowed 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 127.472 2.309 . . . . 3.53 114.941 -179.801 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 2.0 m -73.88 24.37 0.08 Allowed 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.837 1.655 . . . . 2.15 113.439 -164.497 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -105.29 80.59 1.61 Allowed 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 119.374 0.988 . . . . 4.88 111.037 -163.385 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -71.0 145.04 91.04 Favored Pre-proline 0 C--O 1.234 0.26 0 C-N-CA 123.174 0.59 . . . . 2.99 110.451 -177.597 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -66.01 -65.69 0.04 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.347 0 C-N-CA 122.193 1.928 . . . . 0.85 111.151 179.768 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.73 -42.14 67.79 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 123.829 0.851 . . . . 3.07 110.822 -176.533 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 6.4 ttpt -58.74 -59.87 4.72 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 119.228 -0.415 . . . . 4.51 109.955 174.678 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 11.3 t80 -53.76 -49.71 67.6 Favored 'General case' 0 C--O 1.224 -0.241 0 CA-C-N 118.261 0.482 . . . . 3.27 110.289 -176.632 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -41.32 -56.25 2.5 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 126.764 2.026 . . . . 6.03 111.889 174.599 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 22.5 tt0 -68.58 -50.54 50.95 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 109.04 -0.726 . . . . 2.9 109.04 -179.655 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -64.75 -20.63 66.46 Favored 'General case' 0 N--CA 1.441 -0.898 0 C-N-CA 124.207 1.003 . . . . 1.64 112.265 -171.366 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 67.6 p -89.08 -9.19 52.07 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.482 1.513 . . . . 3.12 112.004 177.007 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 83.17 6.19 88.29 Favored Glycine 0 C--N 1.337 0.591 0 N-CA-C 111.558 -0.617 . . . . 0.86 111.558 172.803 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 83.0 mt -66.94 -28.96 68.72 Favored 'General case' 0 N--CA 1.443 -0.802 0 O-C-N 122.182 -0.599 . . . . 2.26 109.998 179.173 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 19.5 p -58.5 -38.11 76.96 Favored 'General case' 0 N--CA 1.464 0.243 0 C-N-CA 123.395 0.678 . . . . 3.5 111.912 165.85 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -83.66 -26.72 29.62 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 125.321 1.448 . . . . 7.19 108.991 -166.93 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 18.2 mtt -54.26 -65.03 0.64 Allowed 'General case' 0 N--CA 1.447 -0.624 0 N-CA-C 113.85 1.056 . . . . 4.71 113.85 -177.306 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 30.8 t 117.27 147.22 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 129.031 2.933 . . . . 2.42 108.352 -168.397 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -42.47 -37.79 1.72 Allowed 'General case' 0 C--N 1.34 0.155 0 C-N-CA 123.826 0.85 . . . . 1.91 111.644 169.825 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 73.8 m-20 -59.5 -63.12 1.42 Allowed 'General case' 0 CA--C 1.529 0.16 0 CA-C-O 121.683 0.754 . . . . 2.34 109.502 -178.796 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 20.8 mm100 -60.7 -40.3 91.72 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 115.755 -0.657 . . . . 3.02 110.479 -179.241 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 97.1 t -62.77 -42.54 96.63 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 CA-C-N 118.548 0.613 . . . . 1.88 109.879 -179.762 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 21.7 ttmm -59.74 -41.47 90.99 Favored 'General case' 0 CA--C 1.533 0.299 0 O-C-N 121.426 -0.796 . . . . 4.13 110.064 174.063 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -59.49 -58.89 6.61 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 117.729 0.24 . . . . 3.06 111.135 174.989 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 4.1 m -56.6 -40.78 71.09 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 O-C-N 121.631 -0.668 . . . . 1.6 110.955 -177.631 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 5.9 t80 -44.11 -44.8 7.83 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.942 0.897 . . . . 6.28 111.884 172.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.54 -38.49 77.9 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 118.816 0.735 . . . . 5.42 110.868 178.253 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -72.41 -34.54 67.94 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.027 0.531 . . . . 4.82 110.173 178.221 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 5.1 mm -65.61 -54.45 27.97 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.166 0 C-N-CA 122.742 0.417 . . . . 2.65 110.325 177.753 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -75.85 67.45 2.25 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 108.478 -0.934 . . . . 2.0 108.478 -178.594 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 5.4 t30 -50.64 -40.36 52.95 Favored 'General case' 0 C--N 1.333 -0.14 0 C-N-CA 126.6 1.96 . . . . 1.92 111.99 -172.821 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -78.79 -22.65 46.02 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 126.781 2.032 . . . . 2.33 112.348 178.394 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 7.5 mt-30 62.4 31.53 17.19 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 126.183 1.793 . . . . 3.06 113.473 -177.783 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 97.0 p -60.29 -35.85 76.51 Favored 'General case' 0 C--N 1.339 0.135 0 O-C-N 120.907 -1.121 . . . . 1.94 111.236 167.555 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 88.61 -4.3 85.1 Favored Glycine 0 CA--C 1.531 1.085 0 CA-C-O 119.128 -0.818 . . . . 1.32 111.787 -167.6 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 46.1 m-85 -109.77 140.94 43.09 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 124.012 0.925 . . . . 4.0 109.084 168.764 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.3 mt -118.23 76.61 1.09 Allowed 'General case' 0 N--CA 1.44 -0.934 0 C-N-CA 127.649 2.38 . . . . 3.93 106.949 177.091 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -66.06 157.35 31.26 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 126.272 1.829 . . . . 2.7 111.203 170.549 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -52.15 -44.02 64.35 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 123.524 0.73 . . . . 3.76 112.813 -176.297 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -59.59 -37.01 77.4 Favored 'General case' 0 CA--C 1.535 0.386 0 O-C-N 121.537 -0.727 . . . . 3.47 111.971 176.753 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 64.6 mt-10 -66.09 -42.87 88.74 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 118.922 0.783 . . . . 2.74 109.901 172.022 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 8.9 mp -57.01 -31.64 65.32 Favored 'General case' 0 CA--C 1.533 0.305 0 O-C-N 121.523 -0.736 . . . . 3.85 111.207 173.816 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 14.4 ttpt -73.62 0.73 11.86 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 113.046 0.758 . . . . 3.88 113.046 175.808 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 66.7 t80 -150.91 68.88 0.95 Allowed 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 107.97 -1.122 . . . . 6.62 107.97 167.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -117.01 -61.33 1.73 Allowed 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 128.529 2.732 . . . . 3.38 108.463 -177.806 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -65.95 -21.4 66.42 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 123.858 0.863 . . . . 4.64 111.488 -178.182 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 77.8 mm-40 -62.58 -10.3 11.68 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 119.615 1.098 . . . . 2.24 111.688 177.775 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.6 mptp? -67.98 -46.57 70.97 Favored 'General case' 0 C--N 1.342 0.247 0 O-C-N 120.51 -1.369 . . . . 3.69 110.395 165.218 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 8.3 m-30 -74.37 -42.64 58.98 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 123.503 0.721 . . . . 4.31 110.535 -169.239 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -142.73 -178.17 5.67 Favored 'General case' 0 C--O 1.226 -0.177 0 C-N-CA 124.561 1.145 . . . . 4.75 108.601 -176.704 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 10.2 m -116.92 22.7 12.42 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 123.079 0.552 . . . . 3.04 111.957 -178.111 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -168.19 45.3 0.23 Allowed Glycine 0 C--N 1.336 0.536 0 N-CA-C 111.157 -0.777 . . . . 1.56 111.157 -177.579 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -76.67 -150.27 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 121.292 0.568 . . . . 2.09 111.073 -179.463 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -115.74 -6.77 12.13 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 123.997 0.919 . . . . 4.25 112.801 -174.729 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -49.18 -33.92 13.4 Favored 'General case' 0 C--O 1.226 -0.181 0 N-CA-C 113.348 0.869 . . . . 4.06 113.348 -175.407 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -39.26 -53.02 1.96 Allowed 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 125.307 1.443 . . . . 2.04 111.168 169.503 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 6.0 m -77.95 120.61 23.04 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-O 122.706 1.241 . . . . 2.48 110.752 -176.375 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 56.4 mp0 -66.85 -33.42 75.57 Favored 'General case' 0 N--CA 1.441 -0.899 0 CA-C-N 114.025 -1.443 . . . . 3.92 111.25 -174.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 5.9 t -57.75 -59.08 5.76 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 119.644 1.111 . . . . 2.19 110.891 178.761 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 15.5 mp0 -56.28 -45.59 80.1 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 123.621 0.768 . . . . 3.45 111.217 177.273 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -55.36 -48.67 73.91 Favored 'General case' 0 N--CA 1.457 -0.096 0 N-CA-C 109.298 -0.63 . . . . 1.72 109.298 176.861 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 7.8 tmtt? -67.8 -32.79 73.6 Favored 'General case' 0 N--CA 1.443 -0.803 0 C-N-CA 123.661 0.785 . . . . 6.37 110.611 -174.71 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 20.3 m -58.08 -44.83 87.8 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 124.025 0.93 . . . . 2.42 110.183 171.223 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -63.32 -54.99 28.33 Favored 'General case' 0 C--O 1.236 0.374 0 O-C-N 122.065 -0.397 . . . . 4.47 110.646 172.43 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 3.7 ttp -45.62 -45.14 13.66 Favored 'General case' 0 C--O 1.223 -0.332 0 C-N-CA 123.361 0.664 . . . . 4.31 111.486 177.458 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -55.58 -44.77 77.23 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 125.646 1.578 . . . . 1.66 112.058 -173.405 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -84.8 -43.03 14.58 Favored 'General case' 0 N--CA 1.461 0.088 0 CA-C-O 120.626 0.25 . . . . 1.54 110.822 179.405 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -58.3 -42.33 86.41 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 123.027 0.531 . . . . 1.49 111.07 -178.404 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -74.34 87.0 2.0 Allowed 'General case' 0 N--CA 1.445 -0.714 0 N-CA-C 109.131 -0.692 . . . . 0.84 109.131 178.497 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 9.3 m-80 -82.2 39.8 0.6 Allowed 'General case' 0 CA--C 1.535 0.379 0 O-C-N 121.18 -0.95 . . . . 3.61 109.99 -177.233 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 45.8 m-20 -127.98 -58.23 1.22 Allowed 'General case' 0 C--N 1.339 0.119 0 C-N-CA 124.829 1.252 . . . . 1.37 109.039 -178.146 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 100.78 44.98 2.0 Allowed Glycine 0 CA--C 1.53 1.028 0 N-CA-C 109.61 -1.396 . . . . 0.95 109.61 -162.197 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -127.54 -51.9 1.37 Allowed 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.669 1.188 . . . . 1.94 110.041 174.872 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 124.17 -36.73 2.86 Favored Glycine 0 CA--C 1.525 0.699 0 C-N-CA 124.527 1.06 . . . . 0.69 111.543 175.224 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 51.7 mttm -70.29 116.28 10.46 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 107.806 -1.183 . . . . 5.6 107.806 175.608 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 4.0 mt -89.18 166.4 1.86 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.334 0 N-CA-C 107.459 -1.312 . . . . 1.71 107.459 173.71 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -144.58 178.79 22.24 Favored Glycine 0 N--CA 1.446 -0.663 0 N-CA-C 107.177 -2.369 . . . . 1.45 107.177 172.08 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -55.01 -46.04 75.17 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 109.62 -0.511 . . . . 1.91 109.62 -176.575 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 22.9 tt0 -58.86 -63.25 1.37 Allowed 'General case' 0 N--CA 1.444 -0.766 0 O-C-N 124.24 0.962 . . . . 2.58 109.538 -176.613 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -46.21 -47.54 17.82 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 123.455 0.702 . . . . 1.27 112.205 174.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -61.61 -53.76 51.91 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-O 121.405 0.621 . . . . 4.25 109.858 -176.771 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -62.28 -32.64 73.38 Favored 'General case' 0 C--O 1.218 -0.594 0 C-N-CA 124.066 0.947 . . . . 2.55 110.717 178.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 30.5 mm-40 -64.22 -54.02 39.97 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-N 120.07 1.304 . . . . 3.48 109.931 175.646 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.05 -52.6 62.68 Favored 'General case' 0 CA--C 1.531 0.237 0 N-CA-C 108.029 -1.101 . . . . 3.82 108.029 -179.938 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 71.7 t -70.0 -34.07 58.12 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.607 0 CA-C-N 115.594 -0.73 . . . . 1.61 112.821 -174.19 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 6.7 t-80 -86.66 8.12 23.71 Favored 'General case' 0 CA--C 1.534 0.356 0 O-C-N 119.734 -1.853 . . . . 4.61 111.269 -178.037 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 32.2 t . . . . . 0 C--O 1.254 1.311 0 CA-C-O 115.518 -2.182 . . . . 2.39 111.386 178.55 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.536 0.404 0 N-CA-C 112.899 0.704 . . . . 3.14 112.899 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -44.06 -50.27 8.49 Favored 'General case' 0 N--CA 1.442 -0.84 0 C-N-CA 125.697 1.599 . . . . 2.89 110.106 170.982 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -86.02 46.41 1.32 Allowed 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.462 1.105 . . . . 3.38 110.418 -173.273 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 25.3 t -142.01 -58.96 0.21 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.1 0 C-N-CA 123.905 0.882 . . . . 2.59 108.936 177.248 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 9.8 tp -171.41 -51.82 0.02 OUTLIER 'General case' 0 C--O 1.232 0.159 0 N-CA-C 106.943 -1.502 . . . . 2.33 106.943 -174.201 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 18.7 m -48.67 -21.14 0.55 Allowed 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 116.052 1.871 . . . . 2.0 116.052 -166.527 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -50.47 -49.09 56.15 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 120.286 1.403 . . . . 1.67 111.46 171.461 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -65.45 -42.94 91.81 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-O 122.086 0.946 . . . . 1.84 109.596 -177.694 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 27.7 m-20 -62.06 -51.1 69.34 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 115.187 -0.915 . . . . 2.53 109.046 -176.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 16.9 pt -63.27 -39.58 85.79 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.916 0 O-C-N 121.683 -0.636 . . . . 1.83 111.601 178.661 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -54.66 -44.94 73.73 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 118.356 0.525 . . . . 1.43 110.774 173.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.41 -56.61 16.57 Favored 'General case' 0 CA--C 1.535 0.378 0 O-C-N 122.014 -0.429 . . . . 1.76 110.855 173.485 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -47.59 -48.35 28.18 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 125.89 1.676 . . . . 1.7 111.369 -177.052 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 14.3 tp -50.21 -42.29 51.31 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 126.166 1.786 . . . . 3.19 110.532 177.868 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 4.9 tm0? -86.44 -45.52 11.07 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 123.884 0.874 . . . . 4.63 109.163 -171.176 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -61.79 -44.44 96.87 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 120.737 0.303 . . . . 3.45 110.421 -178.804 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 69.5 m -104.83 67.16 0.79 Allowed 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 107.153 -1.425 . . . . 2.2 107.153 175.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 19.2 ttt-85 -102.89 -2.8 27.19 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 119.473 1.033 . . . . 6.16 113.27 178.545 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -103.11 155.18 36.97 Favored Pre-proline 0 CA--C 1.533 0.322 0 C-N-CA 124.277 1.031 . . . . 2.28 110.626 -173.577 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -66.07 126.88 16.56 Favored 'Trans proline' 0 N--CA 1.453 -0.876 0 C-N-CA 122.423 2.082 . . . . 1.41 111.121 -176.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 42.6 m-20 63.19 53.28 2.29 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 127.907 2.483 . . . . 2.51 110.107 175.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.5 m -118.73 -18.44 8.96 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 124.326 1.05 . . . . 2.07 112.828 179.738 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 19.4 t80 -60.74 106.05 0.52 Allowed 'General case' 0 N--CA 1.446 -0.655 0 C-N-CA 124.326 1.05 . . . . 4.26 109.856 -174.686 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -86.99 142.78 34.22 Favored Pre-proline 0 CA--C 1.534 0.354 0 N-CA-C 108.572 -0.899 . . . . 2.69 108.572 165.637 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -65.34 -67.97 0.04 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.107 0 C-N-CA 123.169 2.579 . . . . 0.71 110.476 -179.337 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 40.5 mt-30 -55.39 -41.86 73.22 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.302 0.641 . . . . 2.27 110.73 -176.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 12.4 tptp -51.87 -69.71 0.11 Allowed 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 109.629 -0.508 . . . . 4.0 109.629 172.716 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 40.2 t80 -55.72 -37.09 67.95 Favored 'General case' 0 C--O 1.221 -0.44 0 C-N-CA 123.329 0.652 . . . . 4.18 111.043 -173.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.434 ' CE1' ' HA ' ' A' ' 107' ' ' VAL . 0.7 OUTLIER -55.82 -59.14 5.3 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 126.138 1.775 . . . . 5.94 110.297 177.459 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 42.1 mt-30 -61.1 -44.24 97.65 Favored 'General case' 0 CA--C 1.517 -0.312 0 N-CA-C 108.697 -0.853 . . . . 3.03 108.697 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -65.21 -30.56 71.46 Favored 'General case' 0 N--CA 1.434 -1.274 0 N-CA-C 113.094 0.776 . . . . 1.68 113.094 -175.228 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 34.9 t -74.54 -0.73 18.61 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 123.712 0.805 . . . . 2.66 109.773 174.559 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 75.32 5.45 77.19 Favored Glycine 0 C--N 1.339 0.743 0 N-CA-C 111.039 -0.824 . . . . 0.86 111.039 178.381 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 5.0 mt -70.45 -25.12 63.04 Favored 'General case' 0 N--CA 1.447 -0.618 0 O-C-N 121.387 -1.067 . . . . 3.38 110.822 -170.7 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' SER . . . . . 0.414 ' HB3' ' CZ ' ' A' ' 31' ' ' PHE . 25.4 p -65.72 -27.96 68.71 Favored 'General case' 0 CA--C 1.529 0.139 0 C-N-CA 123.644 0.778 . . . . 3.63 110.775 171.413 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 12.5 tptt -86.86 -33.64 19.73 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 108.428 -0.952 . . . . 4.51 108.428 -178.582 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 30.0 mtt -58.54 131.39 50.62 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 118.789 -1.164 . . . . 3.94 111.044 172.63 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 82.2 p -70.6 158.15 36.68 Favored 'General case' 0 CA--C 1.533 0.298 0 O-C-N 121.675 -0.64 . . . . 3.68 110.11 178.29 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -43.59 -36.84 2.26 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.78 1.232 . . . . 2.08 113.082 177.337 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 9.3 m-80 -56.56 -61.8 2.17 Favored 'General case' 0 CA--C 1.527 0.091 0 C-N-CA 124.128 0.971 . . . . 2.12 109.21 175.045 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 23.5 mm100 -59.54 -45.61 91.29 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 115.804 -0.634 . . . . 2.88 110.076 -179.506 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 73.1 t -57.13 -46.15 84.51 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 CA-C-N 118.975 0.807 . . . . 1.9 110.0 -177.452 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 3.2 ttpm? -72.59 -29.64 63.69 Favored 'General case' 0 N--CA 1.448 -0.554 0 O-C-N 121.798 -0.564 . . . . 4.71 111.519 179.896 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -62.74 -58.51 7.22 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 118.939 0.791 . . . . 2.84 110.67 170.365 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 12.0 m -53.02 -44.67 51.13 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.174 0 O-C-N 121.8 -0.563 . . . . 1.71 110.224 -179.209 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 13.5 t80 -42.3 -50.83 4.97 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 123.262 0.625 . . . . 5.81 111.827 171.111 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 65.4 mtp85 -65.8 -34.39 78.06 Favored 'General case' 0 CA--C 1.529 0.173 0 C-N-CA 122.895 0.478 . . . . 4.19 110.926 179.183 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -61.89 -40.55 95.8 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 109.802 -0.444 . . . . 5.2 109.802 175.445 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 25.5 mm -84.06 -47.49 17.65 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 CA-C-O 118.088 -0.958 . . . . 2.56 113.233 -173.648 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -72.46 71.47 0.94 Allowed 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 106.536 -1.653 . . . . 1.94 106.536 170.876 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -57.2 -36.74 71.21 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 126.842 2.057 . . . . 2.2 111.521 -173.476 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 12.0 p-10 -58.18 -27.24 63.67 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 126.748 2.019 . . . . 3.03 112.23 170.224 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 22.7 mt-30 49.95 57.89 6.06 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 126.047 1.739 . . . . 3.26 110.145 -172.795 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 78.3 p -80.1 -42.8 22.89 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 114.137 -1.392 . . . . 2.31 109.769 171.67 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 117.38 -26.98 7.89 Favored Glycine 0 CA--C 1.53 1.005 0 CA-C-O 119.343 -0.698 . . . . 1.55 111.718 -169.622 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 37.3 m-85 -118.96 138.76 52.57 Favored 'General case' 0 C--N 1.34 0.171 0 C-N-CA 123.898 0.879 . . . . 4.28 110.344 -178.24 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -84.7 76.07 10.25 Favored 'General case' 0 N--CA 1.456 -0.146 0 N-CA-C 107.036 -1.468 . . . . 2.87 107.036 167.725 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -54.83 155.77 4.13 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.718 1.207 . . . . 1.53 109.727 171.461 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -44.48 -54.35 6.06 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 123.647 0.779 . . . . 3.3 111.874 -177.73 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -56.09 -35.46 67.05 Favored 'General case' 0 CA--C 1.534 0.327 0 N-CA-C 114.132 1.16 . . . . 3.63 114.132 176.802 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -65.39 -37.47 87.07 Favored 'General case' 0 N--CA 1.462 0.127 0 CA-C-N 120.543 1.519 . . . . 3.25 109.622 174.608 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 60.1 mt -73.2 14.27 0.33 Allowed 'General case' 0 C--O 1.222 -0.393 0 CA-C-O 118.523 -0.751 . . . . 3.3 112.408 170.193 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 27.2 ttpt -97.31 0.04 47.35 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 120.084 1.311 . . . . 2.61 109.716 162.163 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 92.1 m-85 -149.11 32.77 0.74 Allowed 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.567 0.747 . . . . 5.77 111.795 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 46.0 t80 -64.77 -72.22 0.16 Allowed 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 119.625 1.102 . . . . 3.69 109.82 -179.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 15.7 mt -65.98 -16.92 64.31 Favored 'General case' 0 CA--C 1.534 0.33 0 O-C-N 120.494 -1.379 . . . . 3.41 113.205 177.48 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 74.1 mm-40 -57.25 -33.18 67.31 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 121.032 -1.042 . . . . 1.98 111.347 176.395 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 1.6 mptp? -83.47 -13.56 54.43 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 118.792 0.723 . . . . 4.71 112.227 174.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 24.5 m-85 -75.29 -56.48 4.68 Favored 'General case' 0 C--N 1.338 0.104 0 N-CA-C 108.702 -0.851 . . . . 4.4 108.702 171.309 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 28.2 tp10 -118.06 -63.76 1.38 Allowed 'General case' 0 CA--C 1.531 0.248 0 O-C-N 124.148 0.905 . . . . 3.82 110.416 -169.824 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 8.7 t 104.3 117.68 0.01 OUTLIER 'General case' 0 C--N 1.341 0.236 0 C-N-CA 127.68 2.392 . . . . 3.36 107.546 -170.014 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 90.36 24.9 27.54 Favored Glycine 0 CA--C 1.529 0.958 0 C-N-CA 124.59 1.09 . . . . 2.8 111.943 -176.853 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -87.19 173.42 9.24 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.742 0.817 . . . . 1.88 110.744 176.673 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.76 -13.84 1.96 Allowed 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 126.913 2.085 . . . . 4.86 115.765 -167.048 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 73.8 mm-40 -37.71 -41.66 0.51 Allowed 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 126.494 1.917 . . . . 3.61 114.424 -173.251 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -48.86 -41.65 33.92 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 123.584 0.753 . . . . 2.08 112.522 177.368 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 31.5 m -71.59 110.09 5.94 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 121.836 0.827 . . . . 1.56 110.585 178.602 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 24.6 mp0 -59.55 -42.99 93.64 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 114.786 -1.097 . . . . 3.6 110.09 -178.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 2.6 m -52.32 -55.18 23.2 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.836 0.854 . . . . 1.76 112.278 177.168 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -67.39 -41.65 84.63 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 108.505 -0.924 . . . . 2.78 108.505 -173.089 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -53.01 -52.16 59.34 Favored 'General case' 0 CA--C 1.517 -0.307 0 C-N-CA 123.496 0.718 . . . . 1.66 109.151 171.718 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 12.5 tttt -73.56 -23.14 59.93 Favored 'General case' 0 N--CA 1.438 -1.039 0 CA-C-N 116.05 -0.523 . . . . 5.48 110.465 -171.209 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 21.9 m -63.49 -43.64 96.68 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.599 0.76 . . . . 2.57 110.22 167.232 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.6 tt -59.33 -61.77 2.38 Favored 'General case' 0 CA--C 1.533 0.3 0 N-CA-C 108.6 -0.889 . . . . 3.34 108.6 169.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 35.3 ttp -47.18 -49.27 22.99 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 112.412 0.523 . . . . 3.42 112.412 -177.616 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -52.42 -40.7 62.49 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 125.851 1.66 . . . . 1.82 112.274 -173.604 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -90.83 -36.98 13.9 Favored 'General case' 0 C--O 1.226 -0.155 0 C-N-CA 122.355 0.262 . . . . 1.28 111.351 179.52 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -57.7 -44.44 85.88 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 122.319 0.248 . . . . 1.71 111.044 177.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 8.8 t0 -66.45 120.6 13.64 Favored 'General case' 0 N--CA 1.442 -0.845 0 N-CA-C 108.292 -1.003 . . . . 1.75 108.292 174.461 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 49.1 p30 -104.35 11.13 35.05 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 112.63 0.604 . . . . 3.34 112.63 176.022 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -95.01 -52.89 4.03 Favored 'General case' 0 C--N 1.342 0.279 0 CA-C-N 118.731 0.696 . . . . 1.39 110.414 173.626 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 97.38 47.94 2.1 Favored Glycine 0 CA--C 1.53 1.025 0 N-CA-C 108.676 -1.77 . . . . 0.9 108.676 -156.383 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 36.2 p30 -128.29 -64.78 0.93 Allowed 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 126.355 1.862 . . . . 1.94 110.055 175.036 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 140.13 -49.39 0.8 Allowed Glycine 0 CA--C 1.522 0.516 0 C-N-CA 125.31 1.433 . . . . 0.86 109.52 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 23.2 pttm -53.22 128.39 27.84 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 109.473 -0.565 . . . . 6.12 109.473 174.455 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 5.6 mt -118.6 107.94 22.94 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.325 0 C-N-CA 125.518 1.527 . . . . 1.78 108.233 -175.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -66.97 163.8 44.3 Favored Glycine 0 CA--C 1.532 1.102 0 N-CA-C 110.993 -0.843 . . . . 0.87 110.993 172.477 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -51.93 -38.78 57.65 Favored 'General case' 0 C--N 1.339 0.13 0 O-C-N 122.104 -0.645 . . . . 1.77 109.631 168.215 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -59.59 -55.63 32.03 Favored 'General case' 0 N--CA 1.444 -0.758 0 CA-C-N 115.142 -0.935 . . . . 2.51 109.91 178.788 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -52.66 -46.37 67.16 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.616 0.766 . . . . 2.23 110.679 175.357 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 85.4 t80 -56.51 -57.64 11.46 Favored 'General case' 0 CA--C 1.536 0.406 0 O-C-N 121.816 -0.553 . . . . 5.66 111.349 177.548 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 30.8 tt0 -55.97 -37.81 69.56 Favored 'General case' 0 CA--C 1.533 0.299 0 O-C-N 121.748 -0.595 . . . . 2.55 110.294 177.183 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -56.8 -60.8 3.04 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 123.42 0.688 . . . . 4.58 109.872 178.531 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 12.0 ptm -57.47 -43.41 84.02 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 119.822 -0.751 . . . . 6.49 109.65 178.543 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' VAL . . . . . 0.434 ' HA ' ' CE1' ' A' ' 31' ' ' PHE . 57.1 t -69.65 -16.88 20.88 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 N-CA-C 112.126 0.417 . . . . 1.98 112.126 -175.297 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -76.01 -23.52 55.22 Favored 'General case' 0 CA--C 1.538 0.483 0 O-C-N 120.123 -1.61 . . . . 3.49 110.903 175.981 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 15.5 t . . . . . 0 C--O 1.252 1.216 0 CA-C-O 116.36 -1.781 . . . . 2.46 114.017 -164.456 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 2.3 pp . . . . . 0 CA--C 1.535 0.37 0 CA-C-O 121.451 0.643 . . . . 1.88 111.392 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 2.3 t -51.88 -44.03 63.56 Favored 'General case' 0 N--CA 1.436 -1.142 0 C-N-CA 125.401 1.48 . . . . 2.51 111.14 174.319 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 23.3 t0 -98.18 42.25 1.1 Allowed 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 126.538 1.935 . . . . 3.41 109.423 -173.132 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 97.4 t -136.73 -59.95 0.44 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.101 0 C-N-CA 124.997 1.319 . . . . 2.62 108.611 177.646 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -170.87 -47.24 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.116 0 N-CA-C 107.395 -1.335 . . . . 2.45 107.395 -177.432 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 20.3 m -49.08 -22.84 1.01 Allowed 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 116.639 2.088 . . . . 2.05 116.639 -166.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -49.35 -42.16 40.99 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 119.823 1.192 . . . . 1.88 112.291 169.107 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -68.42 -40.05 81.35 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 121.829 0.823 . . . . 2.07 110.41 176.593 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -61.28 -47.19 87.15 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 115.797 -0.638 . . . . 4.96 109.834 -177.788 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 34.6 pt -65.57 -38.22 81.87 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.11 0 CA-C-O 119.163 -0.446 . . . . 2.48 109.797 -177.711 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.93 -46.46 78.46 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 118.341 0.519 . . . . 1.55 111.274 173.378 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.95 -61.04 2.93 Favored 'General case' 0 C--O 1.234 0.262 0 O-C-N 121.961 -0.462 . . . . 1.82 111.012 174.273 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -51.27 -44.79 61.89 Favored 'General case' 0 CA--C 1.528 0.099 0 C-N-CA 123.56 0.744 . . . . 1.56 111.167 -176.892 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -48.72 -44.41 38.23 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 125.54 1.536 . . . . 4.28 111.903 177.907 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.9 mm100 -86.67 -49.39 7.53 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 119.222 0.919 . . . . 3.44 110.946 178.616 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 55.3 tp10 -50.63 -47.45 58.37 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.978 0.911 . . . . 3.9 110.803 -177.682 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 74.6 m -112.52 58.86 0.64 Allowed 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 124.757 1.223 . . . . 2.25 108.031 177.262 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 56.8 ttt180 -82.82 -54.17 5.31 Favored 'General case' 0 CA--C 1.52 -0.176 0 O-C-N 121.522 -0.736 . . . . 4.63 109.701 178.257 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 36.6 m-20 -58.73 143.41 82.37 Favored Pre-proline 0 N--CA 1.449 -0.476 0 CA-C-N 115.171 -0.922 . . . . 2.14 110.285 -173.5 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -64.57 134.89 43.11 Favored 'Trans proline' 0 N--CA 1.449 -1.137 0 C-N-CA 122.406 2.07 . . . . 1.2 110.402 -173.817 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 69.5 m-20 63.15 36.87 11.8 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 127.643 2.377 . . . . 2.67 111.699 178.457 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 6.1 m -102.64 0.35 33.08 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 123.907 0.883 . . . . 1.64 110.88 173.51 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -70.89 138.12 49.89 Favored 'General case' 0 N--CA 1.449 -0.487 0 O-C-N 121.35 -0.844 . . . . 3.26 110.582 -174.482 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -131.84 148.49 70.11 Favored Pre-proline 0 N--CA 1.452 -0.328 0 C-N-CA 123.965 0.906 . . . . 2.51 109.395 170.731 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_endo -65.67 -71.64 0.02 OUTLIER 'Trans proline' 0 N--CA 1.451 -0.973 0 C-N-CA 123.741 2.961 . . . . 0.72 111.007 -178.856 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 53.7 mt-30 -51.8 -46.22 64.15 Favored 'General case' 0 C--O 1.233 0.205 0 C-N-CA 123.879 0.872 . . . . 2.19 110.982 -178.725 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 16.9 tptt -47.75 -60.33 2.65 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 123.418 0.687 . . . . 3.47 110.007 171.689 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 82.3 t80 -56.34 -47.06 79.57 Favored 'General case' 0 C--O 1.222 -0.362 0 C-N-CA 122.805 0.442 . . . . 3.45 110.846 -179.425 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 9.0 m-30 -54.34 -40.54 68.13 Favored 'General case' 0 CA--C 1.531 0.233 0 O-C-N 121.166 -0.959 . . . . 6.15 111.411 -178.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 33.4 mt-30 -73.1 -54.75 7.73 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 110.331 -0.248 . . . . 3.16 110.331 176.263 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -57.85 -39.07 76.87 Favored 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 123.15 0.58 . . . . 1.6 110.332 -172.213 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 10.9 m -86.1 6.72 27.81 Favored 'General case' 0 N--CA 1.444 -0.744 0 C-N-CA 124.815 1.246 . . . . 2.72 111.558 -177.748 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 75.23 -16.53 3.58 Favored Glycine 0 CA--C 1.531 1.063 0 O-C-N 119.366 -2.084 . . . . 0.86 113.093 169.186 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 12.7 mt -56.15 -29.55 60.92 Favored 'General case' 0 N--CA 1.441 -0.89 0 C-N-CA 126.425 1.89 . . . . 2.68 112.995 178.615 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 8.1 t -70.34 -32.96 70.91 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 123.521 0.728 . . . . 2.4 111.41 170.523 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 2.4 tptt -74.79 -36.7 62.5 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 108.397 -0.964 . . . . 6.23 108.397 178.76 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 41.2 mtt -66.5 119.86 12.39 Favored 'General case' 0 N--CA 1.443 -0.788 0 N-CA-C 109.223 -0.658 . . . . 3.21 109.223 173.512 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 16.4 t -63.46 161.97 13.44 Favored 'General case' 0 N--CA 1.453 -0.293 0 O-C-N 121.804 -0.56 . . . . 3.64 109.651 174.454 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -37.7 -44.14 0.69 Allowed 'General case' 0 CA--C 1.527 0.091 0 C-N-CA 126.095 1.758 . . . . 1.93 112.055 178.427 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 39.5 m-20 -39.92 -56.87 1.72 Allowed 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 125.937 1.695 . . . . 2.35 111.565 174.761 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 9.1 mm100 -75.98 -36.68 59.15 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 122.991 0.516 . . . . 2.52 110.177 -176.589 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 4.2 t -61.17 -35.31 64.91 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.584 0 N-CA-C 108.721 -0.844 . . . . 1.99 108.721 179.029 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 80.4 tttt -56.56 -50.03 73.11 Favored 'General case' 0 CA--C 1.531 0.235 0 O-C-N 121.157 -0.964 . . . . 4.57 111.589 172.843 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -55.08 -52.51 62.98 Favored 'General case' 0 C--O 1.233 0.206 0 N-CA-C 110.072 -0.344 . . . . 2.62 110.072 176.92 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 2.4 m -59.53 -45.3 94.05 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 C-N-CA 119.151 -1.019 . . . . 2.01 110.803 179.688 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 10.9 m-85 -47.43 -48.96 26.22 Favored 'General case' 0 C--N 1.34 0.165 0 C-N-CA 124.072 0.949 . . . . 5.77 111.912 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 4.4 mtt180 -61.01 -28.41 69.02 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 120.199 -0.601 . . . . 3.96 111.877 179.638 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 7.6 t80 -72.18 -40.81 67.64 Favored 'General case' 0 N--CA 1.452 -0.343 0 O-C-N 121.955 -0.465 . . . . 5.42 110.067 170.568 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 5.0 mm -66.82 -51.55 54.35 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-O 118.356 -0.831 . . . . 2.46 111.654 -176.047 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -66.4 76.36 0.1 Allowed 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 107.361 -1.348 . . . . 2.26 107.361 171.312 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -66.95 -30.25 70.33 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 123.665 0.786 . . . . 2.15 109.621 178.819 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 38.5 p-10 -65.63 -44.01 87.78 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 123.545 0.738 . . . . 2.5 110.689 169.69 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . 0.297 0.0 OUTLIER 101.54 10.76 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 130.031 3.332 . . . . 4.88 112.809 173.74 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 7.7 p -71.7 -39.77 69.97 Favored 'General case' 0 CA--C 1.528 0.133 0 N-CA-C 112.488 0.551 . . . . 1.91 112.488 -170.68 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 113.37 -26.39 10.34 Favored Glycine 0 CA--C 1.527 0.81 0 N-CA-C 111.61 -0.596 . . . . 1.81 111.61 -179.444 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 86.5 m-85 -79.58 134.81 36.48 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 107.734 -1.209 . . . . 4.6 107.734 166.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -92.62 71.94 5.01 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 105.526 -2.027 . . . . 3.86 105.526 172.367 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.42 157.23 11.52 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-N 113.981 -1.463 . . . . 1.61 108.979 179.544 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -45.0 -51.18 10.14 Favored 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 123.642 0.777 . . . . 4.24 111.578 -172.976 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 20.2 mp0 -59.06 -30.6 68.18 Favored 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 114.427 1.269 . . . . 4.32 114.427 178.708 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -59.35 -41.66 89.72 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 121.354 1.888 . . . . 3.53 109.013 169.865 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -74.45 12.12 0.84 Allowed 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 123.632 0.773 . . . . 3.3 112.44 174.905 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 32.2 ttpt -104.08 2.7 32.37 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 125.298 1.439 . . . . 3.57 109.644 166.344 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 34.4 p90 -151.17 27.78 0.68 Allowed 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 119.126 0.875 . . . . 6.94 113.342 171.881 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -56.54 -64.24 0.93 Allowed 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 119.209 0.913 . . . . 3.9 109.962 -179.585 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 7.1 mp -81.3 -17.02 50.74 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 112.873 0.694 . . . . 3.22 112.873 -179.657 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 68.3 mm-40 -54.62 -33.17 60.08 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 119.653 1.115 . . . . 2.18 110.31 174.856 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.2 mtpt -62.85 -23.43 67.3 Favored 'General case' 0 CA--C 1.535 0.383 0 O-C-N 121.962 -0.461 . . . . 4.35 112.239 176.317 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 2.1 m-30 -98.31 -49.31 4.74 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 125.144 1.378 . . . . 4.43 110.162 -174.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -137.47 135.71 37.07 Favored 'General case' 0 C--N 1.341 0.202 0 C-N-CA 125.12 1.368 . . . . 4.23 108.769 -169.76 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 2.1 p -61.86 -32.95 73.34 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 124.805 1.242 . . . . 4.23 113.978 -165.849 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -119.88 27.15 6.9 Favored Glycine 0 CA--C 1.524 0.599 0 C-N-CA 125.114 1.34 . . . . 1.99 110.761 -173.392 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.37 153.53 38.23 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 117.408 0.604 . . . . 2.0 110.77 179.182 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.48 17.14 0.07 Allowed 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 115.823 1.786 . . . . 4.5 115.823 -161.349 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 68.5 mm-40 -55.47 -35.38 65.44 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-O 122.271 1.034 . . . . 3.71 111.623 -176.603 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.75 -37.56 71.21 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 115.11 -0.95 . . . . 1.8 111.507 177.242 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 54.2 m -74.57 107.63 6.82 Favored 'General case' 0 C--N 1.344 0.338 0 CA-C-N 118.994 0.815 . . . . 1.57 109.295 -178.804 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 15.9 pt-20 -56.68 -41.48 77.37 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 114.513 -1.222 . . . . 2.87 110.834 -178.221 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 66.1 m -59.39 -54.36 47.55 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 122.976 0.51 . . . . 2.36 112.096 177.404 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 -59.48 -45.51 91.46 Favored 'General case' 0 C--O 1.232 0.171 0 O-C-N 121.423 -0.798 . . . . 3.03 110.631 178.509 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -53.94 -47.86 70.84 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 121.696 0.76 . . . . 1.69 109.71 174.529 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 14.8 mmtp -65.4 -29.71 70.45 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 123.892 0.877 . . . . 5.84 111.357 -177.078 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.2 t -56.47 -46.61 80.32 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 119.285 0.948 . . . . 2.4 110.314 170.449 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 28.3 mt -64.2 -57.41 9.59 Favored 'General case' 0 C--O 1.235 0.319 0 O-C-N 121.761 -0.587 . . . . 3.68 109.914 174.798 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 2.0 tpt -40.82 -52.89 2.97 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 123.675 0.79 . . . . 4.2 111.39 176.811 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -53.6 -48.4 69.3 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 126.792 2.037 . . . . 1.7 111.875 -170.634 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -80.25 -47.44 14.59 Favored 'General case' 0 N--CA 1.457 -0.108 0 C-N-CA 121.186 -0.206 . . . . 1.89 110.752 178.206 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -54.66 -38.38 66.87 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 120.664 0.269 . . . . 1.61 110.996 -176.1 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -78.27 103.79 8.44 Favored 'General case' 0 N--CA 1.442 -0.842 0 CA-C-N 116.436 -0.347 . . . . 1.09 110.197 178.191 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 9.4 m-80 -95.71 27.66 3.38 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 123.558 0.743 . . . . 3.11 110.339 -177.664 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 45.2 m-20 -119.49 -51.07 2.3 Favored 'General case' 0 N--CA 1.46 0.041 0 C-N-CA 124.558 1.143 . . . . 1.44 109.332 178.095 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 91.84 42.28 4.78 Favored Glycine 0 CA--C 1.527 0.829 0 N-CA-C 108.771 -1.732 . . . . 0.97 108.771 -158.343 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 33.5 p30 -121.36 -63.21 1.35 Allowed 'General case' 0 C--N 1.342 0.253 0 C-N-CA 124.035 0.934 . . . . 2.26 110.586 172.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 126.79 -31.91 3.8 Favored Glycine 0 CA--C 1.521 0.46 0 N-CA-C 111.261 -0.735 . . . . 1.0 111.261 177.745 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 25.7 pttm -58.29 101.11 0.07 Allowed 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 107.92 -1.141 . . . . 5.94 107.92 162.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 26.7 mt -94.57 147.99 5.3 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 N-CA-C 107.106 -1.442 . . . . 1.87 107.106 176.102 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -117.01 170.33 13.38 Favored Glycine 0 CA--C 1.523 0.572 0 N-CA-C 109.683 -1.367 . . . . 0.84 109.683 175.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -59.59 -48.93 79.73 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 108.691 -0.855 . . . . 1.79 108.691 178.783 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -54.22 -54.73 36.01 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 111.86 0.319 . . . . 3.6 111.86 177.201 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -47.65 -53.99 13.27 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.525 1.13 . . . . 1.68 110.439 175.931 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -70.67 -38.83 73.82 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 119.37 -0.932 . . . . 5.09 111.305 -177.548 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -57.53 -49.79 75.2 Favored 'General case' 0 C--O 1.221 -0.404 0 C-N-CA 124.133 0.973 . . . . 3.46 108.652 -179.154 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -50.53 -54.19 24.36 Favored 'General case' 0 CA--C 1.528 0.129 0 CA-C-N 118.819 0.736 . . . . 3.89 110.367 176.887 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.12 -56.89 16.12 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 116.529 -0.305 . . . . 4.38 111.013 -178.018 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 42.5 t -50.23 -45.71 24.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 C-N-CA 124.299 1.04 . . . . 1.92 111.359 177.878 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 10.9 t-160 -72.44 -11.12 60.55 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 125.053 1.341 . . . . 4.56 111.016 -172.295 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 30.0 t . . . . . 0 C--O 1.252 1.188 0 C-N-CA 122.986 0.514 . . . . 3.33 112.035 178.394 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 2.6 pp . . . . . 0 CA--C 1.535 0.384 0 CA-C-O 121.419 0.628 . . . . 3.51 111.947 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -81.22 57.69 3.28 Favored 'General case' 0 N--CA 1.439 -1.015 0 C-N-CA 126.322 1.849 . . . . 2.82 107.099 178.227 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 174.42 -48.92 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 126.324 1.85 . . . . 3.82 108.952 176.161 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -46.13 -41.89 4.37 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.307 0 C-N-CA 125.766 1.626 . . . . 2.75 112.224 -170.642 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -175.71 -60.11 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 105.867 -1.901 . . . . 2.99 105.867 -171.556 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 2.6 m -50.83 -29.18 11.07 Favored 'General case' 0 N--CA 1.445 -0.694 0 C-N-CA 124.736 1.214 . . . . 1.75 113.617 -170.12 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -49.73 -46.44 50.35 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 119.547 1.067 . . . . 1.95 113.14 171.415 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 42.5 t0 -66.18 -43.39 87.0 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-O 122.707 1.241 . . . . 1.87 108.911 179.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -64.38 -50.21 68.57 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 115.399 -0.819 . . . . 2.28 109.581 -175.486 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 9.5 pt -60.18 -41.17 85.79 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.677 0 O-C-N 121.249 -0.907 . . . . 2.22 111.341 176.477 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -54.74 -42.27 71.4 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 118.999 0.818 . . . . 2.52 111.014 174.181 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.84 -54.08 44.41 Favored 'General case' 0 CA--C 1.533 0.299 0 O-C-N 121.61 -0.681 . . . . 2.19 111.064 171.373 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -51.9 -44.64 63.86 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 124.89 1.276 . . . . 2.07 111.379 -174.855 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.9 tp -48.12 -48.37 34.04 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 125.483 1.513 . . . . 3.59 109.958 174.557 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 23.7 mt-30 -82.46 -28.01 31.51 Favored 'General case' 0 CA--C 1.528 0.125 0 N-CA-C 113.381 0.882 . . . . 3.89 113.381 -178.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . 0.275 0.2 OUTLIER -71.82 -37.65 70.29 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 119.942 1.246 . . . . 3.69 109.386 176.865 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 44.4 m -92.36 38.22 1.01 Allowed 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.184 1.394 . . . . 2.5 112.407 174.153 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.93 -37.39 67.2 Favored 'General case' 0 N--CA 1.47 0.534 0 O-C-N 120.444 -1.41 . . . . 9.4 109.78 172.41 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -83.92 142.05 41.48 Favored Pre-proline 0 N--CA 1.447 -0.592 0 C-N-CA 124.092 0.957 . . . . 2.03 108.889 -176.27 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -69.46 150.73 70.41 Favored 'Trans proline' 0 N--CA 1.46 -0.498 0 C-N-CA 123.489 2.792 . . . . 1.54 112.008 -176.747 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 55.68 19.35 3.31 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.923 1.689 . . . . 2.29 112.945 178.57 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 55.5 m -91.82 -25.67 18.88 Favored 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 124.639 1.176 . . . . 2.07 111.087 -173.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 3.8 t80 -49.29 122.81 6.49 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 123.769 0.828 . . . . 4.51 109.731 178.002 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -114.79 152.52 46.46 Favored Pre-proline 0 CA--C 1.536 0.422 0 C-N-CA 124.354 1.062 . . . . 2.73 108.984 168.692 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_endo -66.42 -70.61 0.02 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.819 0 C-N-CA 123.434 2.756 . . . . 1.3 111.545 -175.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 -54.07 -45.72 71.81 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 123.574 0.75 . . . . 2.82 110.492 -179.196 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 22.3 tptt -45.77 -64.46 0.73 Allowed 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 123.666 0.786 . . . . 3.59 109.15 172.455 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 75.4 t80 -59.32 -44.32 92.61 Favored 'General case' 0 N--CA 1.447 -0.616 0 C-N-CA 122.485 0.314 . . . . 3.48 111.455 -175.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 34.3 m-85 -57.17 -38.81 74.15 Favored 'General case' 0 N--CA 1.453 -0.29 0 O-C-N 121.394 -0.816 . . . . 6.18 111.054 -178.741 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 4.3 mt-30 -71.37 -51.55 23.56 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 118.643 0.656 . . . . 2.7 110.607 170.64 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -58.67 -31.43 68.19 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 123.94 0.896 . . . . 2.07 111.804 -172.069 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.6 t -91.29 1.65 56.95 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 126.485 1.914 . . . . 2.92 110.497 -176.876 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 90.37 -36.78 3.48 Favored Glycine 0 C--N 1.335 0.523 0 O-C-N 120.682 -1.262 . . . . 1.75 110.192 170.477 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 3.3 mp -33.57 -52.57 0.4 Allowed 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 126.537 1.935 . . . . 3.93 114.865 179.158 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 10.3 t -69.39 -27.31 65.19 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 119.523 1.056 . . . . 3.1 111.49 -176.3 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 5.6 tmtp? -79.7 -39.27 31.61 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 108.994 -0.743 . . . . 3.89 108.994 176.419 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 9.6 mtt -57.67 143.31 42.02 Favored 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 123.532 0.733 . . . . 3.76 110.629 176.684 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 3.8 m -62.09 149.32 41.56 Favored 'General case' 0 N--CA 1.446 -0.627 0 O-C-N 121.873 -0.517 . . . . 2.19 109.878 172.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -37.89 -43.51 0.7 Allowed 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 125.054 1.342 . . . . 1.63 111.913 171.076 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -53.29 -60.99 2.59 Favored 'General case' 0 C--O 1.227 -0.087 0 C-N-CA 124.249 1.02 . . . . 3.36 110.061 178.038 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 28.7 mm100 -60.81 -39.08 87.63 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 123.092 0.557 . . . . 3.14 109.893 -178.313 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 60.1 t -60.85 -44.63 98.09 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.29 0 CA-C-N 118.823 0.738 . . . . 1.79 109.855 177.668 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 62.0 tttt -68.84 -39.64 79.85 Favored 'General case' 0 N--CA 1.451 -0.4 0 O-C-N 121.642 -0.661 . . . . 3.87 110.692 -178.061 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -59.71 -58.2 9.6 Favored 'General case' 0 C--O 1.232 0.153 0 C-N-CA 122.749 0.419 . . . . 3.22 110.2 173.211 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 14.0 m -55.63 -44.92 78.5 Favored 'Isoleucine or valine' 0 C--N 1.34 0.195 0 N-CA-C 109.59 -0.522 . . . . 1.73 109.59 -179.189 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . 0.401 ' CZ ' HD22 ' A' ' 59' ' ' LEU . 43.3 t80 -46.43 -64.23 0.81 Allowed 'General case' 0 C--N 1.341 0.229 0 N-CA-C 109.449 -0.574 . . . . 5.14 109.449 171.723 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 63.8 mtt180 -54.67 -37.04 65.28 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 114.005 1.113 . . . . 5.36 114.005 -178.711 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 27.1 m-85 -64.08 -52.97 56.72 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 119.282 0.946 . . . . 6.36 109.981 175.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 35.8 mm -76.2 -20.63 15.29 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.691 0 O-C-N 121.816 -0.552 . . . . 3.83 111.773 -171.409 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 43.7 t0 -48.53 -28.64 3.51 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 128.759 2.824 . . . . 2.6 113.015 173.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 11.2 t-20 79.14 -56.09 0.43 Allowed 'General case' 0 C--N 1.339 0.144 0 C-N-CA 126.318 1.847 . . . . 3.55 112.65 162.624 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 29.4 p30 -69.57 -39.14 77.54 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.966 0.907 . . . . 3.02 110.08 168.086 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . 0.278 1.2 pt20 83.95 24.09 0.12 Allowed 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 129.641 3.176 . . . . 3.84 111.021 -171.922 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 89.0 p -77.14 -27.2 53.8 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 113.607 0.966 . . . . 2.46 113.607 -174.069 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 98.44 24.47 11.15 Favored Glycine 0 CA--C 1.534 1.247 0 C-N-CA 125.28 1.419 . . . . 2.3 112.397 -173.175 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 44.7 m-85 -143.22 128.05 18.3 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 118.338 1.069 . . . . 4.33 111.112 -177.543 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.401 HD22 ' CZ ' ' A' ' 48' ' ' PHE . 1.6 mm? -109.19 70.19 0.73 Allowed 'General case' 0 C--N 1.339 0.125 0 C-N-CA 127.148 2.179 . . . . 2.98 108.588 -179.685 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -54.28 159.05 2.08 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.563 1.545 . . . . 1.61 111.076 173.268 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -36.55 -54.53 0.87 Allowed 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 125.852 1.661 . . . . 4.32 112.082 176.19 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 -63.81 -45.48 89.47 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 115.957 -0.565 . . . . 3.21 110.337 -173.345 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 81.7 mt-10 -62.89 -40.23 96.9 Favored 'General case' 0 N--CA 1.449 -0.517 0 O-C-N 121.506 -0.746 . . . . 2.57 110.513 178.547 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 6.2 mt -57.18 -50.57 72.43 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 120.921 0.391 . . . . 3.22 110.294 171.122 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 14.7 ttpt -60.76 -16.06 36.21 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 126.04 1.736 . . . . 5.07 112.441 178.694 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 69.6 m-85 -130.97 49.28 2.34 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.009 0.924 . . . . 7.63 110.354 170.089 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 68.3 t80 -85.77 -76.88 0.32 Allowed 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 124.419 1.088 . . . . 4.82 110.716 -178.214 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 90.9 mt -61.15 -9.09 4.14 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 113.171 0.804 . . . . 3.69 113.171 -176.643 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 80.8 mm-40 -47.96 -61.97 1.7 Allowed 'General case' 0 N--CA 1.452 -0.353 0 O-C-N 121.492 -0.755 . . . . 2.07 110.346 168.617 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -83.79 48.01 1.38 Allowed 'General case' 0 CA--C 1.537 0.448 0 O-C-N 121.22 -0.925 . . . . 4.87 110.252 -177.267 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -153.12 -58.21 0.13 Allowed 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.165 0.986 . . . . 4.42 108.352 -167.712 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -108.55 -37.24 5.99 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 126.176 1.79 . . . . 3.76 109.904 175.291 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 1.4 p 78.81 107.8 0.07 Allowed 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 125.154 1.381 . . . . 3.27 108.734 -172.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 72.81 48.83 19.97 Favored Glycine 0 CA--C 1.527 0.8 0 N-CA-C 110.323 -1.111 . . . . 2.32 110.323 -176.118 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -79.11 -146.9 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.758 0.823 . . . . 1.65 109.795 173.68 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 7.2 tpt180 -102.7 -30.91 10.61 Favored 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 113.317 0.858 . . . . 4.21 113.317 -171.249 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -31.02 -33.19 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 129.717 3.207 . . . . 3.75 115.907 -175.302 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -39.94 -46.05 1.98 Allowed 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.727 1.211 . . . . 2.54 110.856 171.636 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 7.3 m -72.17 125.64 27.81 Favored 'General case' 0 C--N 1.343 0.311 0 C-N-CA 119.541 -0.864 . . . . 1.64 110.936 176.136 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -69.33 -38.52 78.23 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-O 118.086 -0.959 . . . . 2.9 111.738 177.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 19.1 m -48.47 -69.73 0.11 Allowed 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 119.768 1.167 . . . . 1.47 111.365 168.458 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -48.84 -45.46 40.69 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 123.757 0.823 . . . . 3.29 110.524 -176.514 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 1.2 m -60.31 -49.88 75.86 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 121.693 0.759 . . . . 2.45 110.276 177.043 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 24.2 ttpp -64.76 -29.8 70.78 Favored 'General case' 0 N--CA 1.439 -0.997 0 CA-C-N 115.966 -0.561 . . . . 5.62 110.696 -173.432 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 9.5 m -56.7 -33.75 66.77 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 119.476 1.034 . . . . 1.91 112.083 169.615 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.2 tt -71.68 -61.76 1.66 Allowed 'General case' 0 C--O 1.236 0.356 0 N-CA-C 108.25 -1.018 . . . . 3.38 108.25 169.832 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 2.1 ttm -46.11 -53.71 9.85 Favored 'General case' 0 C--O 1.221 -0.414 0 C-N-CA 123.335 0.654 . . . . 3.81 111.105 -174.003 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -42.96 -37.85 2.02 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 127.579 2.351 . . . . 1.45 113.34 179.92 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -97.62 -44.78 6.64 Favored 'General case' 0 C--O 1.227 -0.103 0 CA-C-O 120.897 0.38 . . . . 1.47 110.676 -175.746 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -53.9 -43.09 69.41 Favored 'General case' 0 N--CA 1.456 -0.15 0 C-N-CA 123.863 0.865 . . . . 1.5 110.926 176.792 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -73.72 72.84 1.51 Allowed 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 124.772 1.229 . . . . 1.18 109.541 -178.749 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 48.8 p-10 -77.17 51.83 0.86 Allowed 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.752 1.221 . . . . 2.87 112.313 -172.68 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 31.9 p30 -163.29 -46.26 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 126.281 1.833 . . . . 3.7 109.847 -175.017 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 99.98 55.05 1.01 Allowed Glycine 0 CA--C 1.525 0.699 0 N-CA-C 110.183 -1.167 . . . . 0.83 110.183 173.739 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -123.84 -46.97 1.95 Allowed 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 126.33 1.852 . . . . 2.35 109.918 175.01 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 123.5 -36.64 2.97 Favored Glycine 0 CA--C 1.529 0.953 0 C-N-CA 125.436 1.493 . . . . 0.66 111.342 178.042 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 39.9 mmtt -71.8 128.86 37.11 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 108.501 -0.926 . . . . 7.04 108.501 177.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 23.0 mt -119.39 116.31 50.4 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.253 0 C-N-CA 124.256 1.022 . . . . 1.87 108.644 -173.916 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -81.28 167.45 49.19 Favored Glycine 0 CA--C 1.528 0.878 0 N-CA-C 110.863 -0.895 . . . . 0.71 110.863 174.072 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -57.99 -37.81 74.94 Favored 'General case' 0 C--O 1.224 -0.28 0 N-CA-C 109.572 -0.529 . . . . 1.76 109.572 172.737 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 60.2 mt-10 -56.65 -67.08 0.34 Allowed 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 124.064 0.946 . . . . 2.94 109.49 175.013 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -40.04 -50.07 2.56 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.142 0.977 . . . . 1.38 111.393 175.551 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -66.89 -55.45 14.66 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 112.01 0.374 . . . . 4.23 112.01 -176.371 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 10.8 tt0 -53.58 -44.43 69.33 Favored 'General case' 0 C--O 1.221 -0.41 0 C-N-CA 124.212 1.005 . . . . 2.45 109.28 178.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -50.86 -62.46 1.59 Allowed 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 119.266 0.939 . . . . 3.98 110.426 173.721 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.03 -42.6 94.72 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 120.726 -0.389 . . . . 3.95 110.9 -173.67 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 57.2 t -58.85 -48.63 85.68 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.327 0 C-N-CA 124.103 0.961 . . . . 1.94 111.3 176.171 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 50.5 t-80 -72.81 -18.19 61.49 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 125.445 1.498 . . . . 3.77 110.834 -170.761 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 22.9 t . . . . . 0 C--O 1.254 1.332 0 CA-C-O 114.989 -2.434 . . . . 2.58 113.41 -179.856 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.5 pp . . . . . 0 CA--C 1.532 0.278 0 CA-C-O 121.803 0.811 . . . . 2.53 111.514 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 10.2 t -69.03 -7.03 31.8 Favored 'General case' 0 N--CA 1.426 -1.653 0 C-N-CA 126.284 1.834 . . . . 2.54 111.662 -175.242 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 52.1 t0 -148.08 60.63 1.11 Allowed 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 108.026 -1.102 . . . . 2.64 108.026 -179.474 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 3.1 p -145.38 -48.71 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.192 0 C-N-CA 123.842 0.857 . . . . 3.08 110.477 174.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -178.78 -48.83 0.01 OUTLIER 'General case' 0 CA--C 1.528 0.12 0 C-N-CA 126.121 1.768 . . . . 2.48 106.536 -175.267 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 2.3 m -50.94 -24.02 3.31 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 115.67 1.729 . . . . 1.57 115.67 -170.858 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -53.98 -41.51 67.96 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 119.543 1.065 . . . . 1.63 112.273 172.124 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -74.4 -36.89 63.52 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 121.391 0.615 . . . . 1.97 109.931 178.546 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -56.26 -52.84 63.0 Favored 'General case' 0 C--O 1.234 0.263 0 C-N-CA 124.253 1.021 . . . . 2.84 108.277 179.18 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 34.0 pt -63.14 -39.99 87.35 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.401 0 CA-C-N 115.087 -0.96 . . . . 1.77 110.153 -177.278 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -52.43 -45.8 66.14 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 118.999 0.818 . . . . 1.83 110.971 175.645 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.58 -59.6 5.19 Favored 'General case' 0 CA--C 1.533 0.322 0 O-C-N 122.144 -0.347 . . . . 1.76 110.949 174.06 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -47.83 -44.3 28.77 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 124.055 0.942 . . . . 1.58 111.933 -179.488 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -55.23 -37.04 66.66 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 125.058 1.343 . . . . 4.46 110.831 -179.146 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.55 -42.73 12.54 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 122.478 0.311 . . . . 6.31 110.368 -178.869 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -68.36 -36.99 80.03 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 118.073 0.397 . . . . 2.5 110.878 -174.189 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 39.5 m -116.83 69.05 0.75 Allowed 'General case' 0 C--N 1.339 0.119 0 C-N-CA 124.573 1.149 . . . . 1.93 108.445 172.634 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 48.8 ttt180 -88.71 -55.19 3.81 Favored 'General case' 0 N--CA 1.456 -0.151 0 N-CA-C 109.352 -0.611 . . . . 6.1 109.352 -179.247 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -60.53 138.03 92.59 Favored Pre-proline 0 C--O 1.224 -0.253 0 C-N-CA 124.43 1.092 . . . . 3.25 110.167 175.935 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -71.81 148.44 52.19 Favored 'Trans proline' 0 N--CA 1.458 -0.608 0 C-N-CA 123.462 2.775 . . . . 2.73 111.294 -176.683 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.4 t70 82.83 4.14 1.01 Allowed 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 127.396 2.278 . . . . 2.45 111.27 179.176 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 18.2 m -87.13 -7.28 58.17 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.621 1.168 . . . . 1.73 112.935 -177.89 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -86.09 82.97 7.88 Favored 'General case' 0 CA--C 1.534 0.356 0 O-C-N 120.041 -1.662 . . . . 4.24 113.196 -155.594 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.402 ' OE1' ' NZ ' ' A' ' 29' ' ' LYS . 6.6 mt-10 -65.31 139.93 97.62 Favored Pre-proline 0 CA--C 1.534 0.364 0 O-C-N 121.64 -0.662 . . . . 2.19 110.364 175.0 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -68.06 -63.18 0.05 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.17 0 C-N-CA 122.605 2.204 . . . . 1.0 111.53 -176.263 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -53.94 -42.63 69.04 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 124.21 1.004 . . . . 2.7 110.88 179.446 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.402 ' NZ ' ' OE1' ' A' ' 26' ' ' GLU . 0.3 OUTLIER -54.32 -61.56 2.23 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 123.052 0.541 . . . . 5.33 109.714 174.858 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 8.4 t80 -53.72 -53.88 45.85 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-O 122.252 1.025 . . . . 3.54 110.839 -177.238 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.462 ' CE1' ' HA ' ' A' ' 107' ' ' VAL . 2.7 t80 -40.0 -56.32 1.87 Allowed 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.275 1.43 . . . . 5.99 111.81 175.2 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -70.55 -41.51 72.37 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 123.55 0.74 . . . . 3.26 110.27 -179.457 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.2 t -63.86 -38.38 90.88 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 118.403 0.547 . . . . 1.55 110.926 -170.512 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 38.5 m -60.33 -57.09 14.26 Favored 'General case' 0 N--CA 1.443 -0.789 0 N-CA-C 107.656 -1.239 . . . . 3.33 107.656 170.777 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 116.92 21.13 4.67 Favored Glycine 0 CA--C 1.525 0.708 0 N-CA-C 110.266 -1.134 . . . . 2.02 110.266 -172.896 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 1.8 mt -65.72 -24.6 67.02 Favored 'General case' 0 N--CA 1.451 -0.4 0 O-C-N 121.199 -1.177 . . . . 3.14 109.587 176.203 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 21.5 t -63.49 -18.6 63.97 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.196 0.598 . . . . 2.84 110.4 173.07 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.24 -27.41 16.17 Favored 'General case' 0 N--CA 1.447 -0.585 0 O-C-N 121.665 -0.647 . . . . 6.41 110.0 176.814 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 27.4 mmt -69.11 134.23 49.06 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 121.425 0.631 . . . . 4.69 111.231 176.189 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 73.8 m -65.6 151.28 46.84 Favored 'General case' 0 N--CA 1.452 -0.326 0 O-C-N 121.876 -0.515 . . . . 1.99 110.715 175.892 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -39.25 -41.2 0.85 Allowed 'General case' 0 C--O 1.224 -0.241 0 C-N-CA 125.595 1.558 . . . . 1.68 111.998 172.488 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 65.6 m-20 -50.13 -59.83 3.54 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 124.049 0.94 . . . . 2.01 110.744 175.864 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -72.11 -35.03 69.06 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 109.181 -0.674 . . . . 3.51 109.181 -173.357 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 79.0 t -59.64 -43.04 90.3 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 O-C-N 121.584 -0.698 . . . . 1.61 109.869 174.084 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 60.6 tttt -69.5 -42.02 75.29 Favored 'General case' 0 CA--C 1.536 0.417 0 O-C-N 120.809 -1.182 . . . . 3.48 110.573 178.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -50.82 -61.41 2.23 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.33 0.652 . . . . 3.22 110.349 171.475 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 18.0 m -54.85 -46.99 75.67 Favored 'Isoleucine or valine' 0 C--N 1.34 0.178 0 CA-C-O 118.214 -0.898 . . . . 1.61 110.821 178.499 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 25.6 t80 -43.99 -52.72 6.81 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 119.127 0.876 . . . . 5.7 111.175 174.704 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 78.2 mtp180 -60.55 -37.38 81.04 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 120.499 -0.481 . . . . 3.93 111.451 179.569 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 11.5 t80 -64.64 -34.19 77.71 Favored 'General case' 0 CA--C 1.534 0.348 0 O-C-N 122.274 -0.266 . . . . 5.4 110.479 175.837 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 6.4 mm -68.58 -53.4 27.87 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 N-CA-C 109.909 -0.404 . . . . 2.32 109.909 175.503 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -78.06 60.6 2.43 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.754 0.822 . . . . 2.15 111.507 -172.026 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -52.05 -32.32 33.95 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 126.916 2.086 . . . . 1.97 113.334 -172.466 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 11.3 p-10 -72.25 -33.46 67.51 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.813 1.245 . . . . 2.57 111.728 178.278 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . 0.279 0.8 OUTLIER 75.33 22.18 1.73 Allowed 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 127.166 2.187 . . . . 5.54 114.698 -179.616 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 99.3 p -50.2 -29.13 8.7 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 120.039 1.291 . . . . 2.32 112.467 173.851 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 107.59 -24.99 22.66 Favored Glycine 0 C--N 1.338 0.681 0 N-CA-C 109.335 -1.506 . . . . 1.5 109.335 -172.595 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 96.8 m-85 -115.35 135.04 54.55 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 124.274 1.03 . . . . 3.61 108.813 -179.63 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 6.6 mt -71.72 75.7 0.84 Allowed 'General case' 0 N--CA 1.448 -0.552 0 N-CA-C 106.896 -1.52 . . . . 3.72 106.896 160.318 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -66.02 160.77 23.0 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 108.635 -0.876 . . . . 2.86 108.635 172.63 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -52.38 -39.01 60.28 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.91 0.884 . . . . 3.8 113.269 -170.199 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -66.2 -49.8 66.06 Favored 'General case' 0 N--CA 1.453 -0.31 0 O-C-N 121.714 -0.616 . . . . 3.49 110.293 -175.517 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -61.25 -31.76 71.56 Favored 'General case' 0 C--N 1.329 -0.317 0 O-C-N 121.25 -0.907 . . . . 3.02 110.816 174.08 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -53.78 -36.58 62.57 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 117.867 0.303 . . . . 3.62 111.558 168.996 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 33.0 ttpt -61.53 -9.18 5.28 Favored 'General case' 0 CA--C 1.54 0.564 0 O-C-N 121.292 -0.88 . . . . 3.11 112.487 173.612 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 76.8 m-85 -128.56 28.63 5.39 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 124.301 1.04 . . . . 5.65 111.424 171.43 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -59.08 -62.85 1.58 Allowed 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 118.652 0.66 . . . . 4.79 109.856 -177.031 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 47.1 mt -92.44 -9.42 41.64 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.442 0.697 . . . . 4.24 112.14 -178.249 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 43.9 mm-40 -54.19 -33.42 58.12 Favored 'General case' 0 N--CA 1.463 0.193 0 O-C-N 121.514 -0.741 . . . . 2.49 110.989 171.423 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.45 -28.69 63.56 Favored 'General case' 0 CA--C 1.533 0.311 0 O-C-N 122.155 -0.341 . . . . 4.02 111.294 176.376 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 4.4 m-30 -85.82 -58.59 2.59 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 108.501 -0.925 . . . . 4.27 108.501 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -140.73 127.85 20.87 Favored 'General case' 0 C--N 1.34 0.174 0 N-CA-C 109.141 -0.688 . . . . 3.34 109.141 -171.302 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 5.9 p -55.33 -27.1 44.84 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 123.973 0.909 . . . . 4.11 112.269 -179.096 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -106.1 22.84 30.47 Favored Glycine 0 CA--C 1.526 0.722 0 CA-C-O 118.54 -1.144 . . . . 2.05 112.04 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -54.48 -68.29 0.2 Allowed 'General case' 0 C--N 1.343 0.289 0 CA-C-N 118.805 1.303 . . . . 3.44 111.819 -174.12 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 1.2 tpt180 -173.52 -47.73 0.01 OUTLIER 'General case' 0 C--N 1.339 0.136 0 N-CA-C 112.735 0.643 . . . . 3.94 112.735 178.7 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -39.71 -31.31 0.1 Allowed 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 129.191 2.996 . . . . 3.7 114.598 -163.135 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -31.03 -51.95 0.17 Allowed 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 126.353 1.861 . . . . 2.51 112.158 165.322 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -82.89 121.78 27.4 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 122.91 0.484 . . . . 3.63 110.304 178.576 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -55.62 -31.03 61.93 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 116.215 -0.448 . . . . 3.17 111.617 176.414 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 7.9 t -58.58 -60.58 3.59 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 108.711 -0.848 . . . . 2.04 108.711 -176.659 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -65.42 -41.88 93.11 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 122.799 0.44 . . . . 2.92 110.216 -174.315 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 1.2 m -49.01 -52.1 27.04 Favored 'General case' 0 C--N 1.344 0.333 0 N-CA-C 109.709 -0.478 . . . . 2.06 109.709 169.816 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 51.5 mtmt -70.37 -29.1 65.67 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-O 118.311 -0.852 . . . . 5.52 112.729 -178.779 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 10.8 m -57.6 -46.41 84.1 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 120.783 1.628 . . . . 2.55 110.085 168.691 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -60.48 -57.39 12.96 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 109.202 -0.666 . . . . 3.26 109.202 175.271 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 17.0 ttp -47.78 -52.51 18.47 Favored 'General case' 0 C--O 1.225 -0.224 0 C-N-CA 124.026 0.93 . . . . 3.98 111.477 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -51.89 -44.27 63.67 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 126.407 1.883 . . . . 2.07 111.524 -172.01 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -80.58 -52.49 7.54 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-O 119.619 -0.229 . . . . 2.12 110.595 175.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -48.54 -44.6 36.55 Favored 'General case' 0 C--N 1.339 0.122 0 C-N-CA 123.876 0.87 . . . . 1.81 111.858 -175.682 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -72.72 80.39 1.12 Allowed 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 109.286 -0.635 . . . . 0.93 109.286 177.624 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 45.3 p-10 -76.97 50.4 0.72 Allowed 'General case' 0 CA--C 1.537 0.457 0 O-C-N 121.399 -0.813 . . . . 2.73 110.972 176.095 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 37.5 m-20 -137.01 -61.63 0.66 Allowed 'General case' 0 C--N 1.341 0.214 0 C-N-CA 126.381 1.872 . . . . 1.46 109.412 178.398 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 105.04 45.8 1.33 Allowed Glycine 0 CA--C 1.534 1.247 0 C-N-CA 125.263 1.411 . . . . 1.01 110.339 -161.618 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -127.18 -57.69 1.3 Allowed 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 125.359 1.464 . . . . 2.16 110.554 172.696 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 123.5 -25.19 6.32 Favored Glycine 0 CA--C 1.531 1.056 0 C-N-CA 124.83 1.205 . . . . 0.66 111.734 176.505 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 19.1 mtpp -78.98 112.83 16.57 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 106.459 -1.682 . . . . 5.01 106.459 175.824 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 5.9 mt -100.15 140.76 18.52 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.292 0 N-CA-C 107.95 -1.13 . . . . 1.72 107.95 -175.723 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -114.45 177.41 17.56 Favored Glycine 0 C--N 1.334 0.418 0 N-CA-C 110.82 -0.912 . . . . 0.97 110.82 176.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -61.17 -39.07 88.76 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 109.511 -0.551 . . . . 1.66 109.511 176.564 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -55.91 -63.71 1.09 Allowed 'General case' 0 N--CA 1.449 -0.509 0 O-C-N 123.536 0.523 . . . . 2.3 109.987 173.432 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -49.1 -47.77 44.94 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.012 0.925 . . . . 2.2 110.837 -179.718 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 58.2 t80 -62.16 -55.86 24.55 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 123.114 0.565 . . . . 5.8 111.162 -179.088 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 14.2 tt0 -52.58 -42.42 64.48 Favored 'General case' 0 C--O 1.219 -0.544 0 C-N-CA 123.558 0.743 . . . . 3.4 109.379 175.542 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -53.02 -57.32 10.76 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 124.16 0.984 . . . . 3.96 110.093 178.438 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -55.19 -51.59 66.05 Favored 'General case' 0 C--O 1.23 0.071 0 CA-C-O 121.493 0.663 . . . . 4.14 109.499 175.564 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' VAL . . . . . 0.462 ' HA ' ' CE1' ' A' ' 31' ' ' PHE . 92.2 t -73.03 -5.97 7.34 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 CA-C-N 115.533 -0.758 . . . . 1.83 112.978 -172.369 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 78.8 t60 -91.41 -8.63 47.35 Favored 'General case' 0 CA--C 1.536 0.436 0 O-C-N 120.721 -1.237 . . . . 4.02 110.421 174.096 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 21.1 t . . . . . 0 C--O 1.252 1.208 0 CA-C-O 114.39 -2.719 . . . . 2.37 113.91 -168.89 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.6 pp . . . . . 0 CA--C 1.537 0.459 0 CA-C-O 121.247 0.546 . . . . 3.13 110.469 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 1.5 t -86.41 53.43 2.8 Favored 'General case' 0 N--CA 1.44 -0.942 0 C-N-CA 126.202 1.801 . . . . 4.04 108.094 -168.77 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -174.65 -56.51 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.144 0 N-CA-C 107.494 -1.298 . . . . 4.55 107.494 -170.595 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 13.9 t -46.97 -40.67 5.15 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.236 0 C-N-CA 126.081 1.752 . . . . 2.66 110.942 -175.914 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 4.5 tp -164.62 -55.1 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 105.823 -1.917 . . . . 2.7 105.823 175.381 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -52.09 -15.96 0.68 Allowed 'General case' 0 N--CA 1.445 -0.69 0 N-CA-C 115.482 1.66 . . . . 2.08 115.482 -168.118 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -50.72 -49.39 57.79 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 120.63 1.559 . . . . 1.89 111.36 168.179 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -64.55 -40.33 95.39 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-O 122.462 1.125 . . . . 2.22 109.753 -178.739 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -67.5 -49.57 62.87 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-N 115.395 -0.82 . . . . 2.67 109.247 -175.705 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 19.1 pt -60.1 -40.78 84.33 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.802 0 O-C-N 121.634 -0.666 . . . . 1.92 110.764 174.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -54.28 -47.8 71.94 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 119.179 0.899 . . . . 1.73 111.019 174.302 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.45 -58.49 8.37 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 121.861 -0.524 . . . . 1.81 110.739 174.583 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -46.91 -47.06 21.62 Favored 'General case' 0 C--O 1.232 0.165 0 C-N-CA 126.81 2.044 . . . . 1.95 111.736 -178.322 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -55.75 -41.7 74.33 Favored 'General case' 0 N--CA 1.445 -0.709 0 C-N-CA 125.751 1.621 . . . . 3.97 108.883 -179.121 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 17.1 tt0 -83.06 -50.95 7.98 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 108.991 -0.744 . . . . 3.05 108.991 -175.093 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.9 pp20? -61.88 -34.55 76.22 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 115.835 -0.62 . . . . 2.3 110.937 -170.849 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 96.6 m -121.39 67.04 0.88 Allowed 'General case' 0 C--O 1.235 0.305 0 C-N-CA 123.802 0.841 . . . . 2.31 109.189 168.238 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 16.6 ttp180 -84.23 -3.07 57.95 Favored 'General case' 0 N--CA 1.469 0.491 0 O-C-N 121.102 -0.999 . . . . 5.08 112.908 174.809 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -113.28 152.17 44.94 Favored Pre-proline 0 CA--C 1.537 0.464 0 C-N-CA 123.798 0.839 . . . . 2.69 112.064 -162.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -63.67 123.83 12.66 Favored 'Trans proline' 0 N--CA 1.453 -0.894 0 C-N-CA 122.891 2.394 . . . . 1.28 111.21 -169.549 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.9 t0 67.78 19.0 9.71 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 125.328 1.451 . . . . 3.26 112.336 173.654 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 26.6 m -83.14 -16.62 46.03 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.318 1.047 . . . . 2.15 111.784 176.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -94.53 98.36 10.78 Favored 'General case' 0 CA--C 1.539 0.538 0 O-C-N 121.922 -0.486 . . . . 5.13 111.116 -155.87 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -78.8 155.61 77.94 Favored Pre-proline 0 CA--C 1.535 0.381 0 O-C-N 121.725 -0.61 . . . . 2.81 110.667 -179.073 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -71.28 -61.2 0.05 OUTLIER 'Trans proline' 0 N--CA 1.45 -1.072 0 C-N-CA 122.595 2.197 . . . . 0.95 111.666 -176.632 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 -59.39 -38.06 79.55 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 118.317 0.508 . . . . 2.46 110.646 -179.212 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 1.1 tptp -55.09 -62.55 1.59 Allowed 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 109.635 -0.506 . . . . 4.81 109.635 170.7 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -53.74 -55.25 27.97 Favored 'General case' 0 C--O 1.218 -0.555 0 C-N-CA 124.335 1.054 . . . . 3.76 109.947 -174.845 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 3.4 t80 -33.03 -66.71 0.13 Allowed 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 128.774 2.83 . . . . 5.99 112.4 176.47 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 24.6 mt-30 -61.22 -46.31 90.96 Favored 'General case' 0 C--O 1.226 -0.16 0 N-CA-C 109.574 -0.528 . . . . 3.06 109.574 179.668 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -59.08 -30.5 68.12 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 113.239 0.829 . . . . 1.61 113.239 -178.411 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 23.6 t -84.06 -2.67 57.13 Favored 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 125.082 1.353 . . . . 2.39 109.961 179.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 79.68 2.59 88.33 Favored Glycine 0 C--N 1.337 0.633 0 N-CA-C 110.728 -0.949 . . . . 0.88 110.728 174.726 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 96.0 mt -68.06 -22.08 64.96 Favored 'General case' 0 N--CA 1.442 -0.833 0 O-C-N 121.507 -0.996 . . . . 2.52 110.941 -172.338 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 13.9 t -71.49 -28.03 63.63 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 123.716 0.806 . . . . 2.6 109.871 172.697 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 12.9 tttt -84.56 -36.49 22.09 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 124.012 0.925 . . . . 5.08 108.899 -179.642 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.69 128.51 35.13 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 121.228 0.537 . . . . 3.45 110.139 176.02 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 28.8 t -64.11 154.69 33.78 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 109.152 -0.684 . . . . 2.61 109.152 176.457 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -40.21 -43.45 1.68 Allowed 'General case' 0 C--N 1.34 0.174 0 C-N-CA 124.654 1.182 . . . . 2.31 111.368 173.396 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 50.6 m-80 -45.92 -64.11 0.82 Allowed 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.617 1.167 . . . . 2.35 110.764 172.874 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -64.71 -39.35 93.5 Favored 'General case' 0 C--O 1.219 -0.504 0 C-N-CA 124.028 0.931 . . . . 3.85 110.555 -176.803 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 75.6 t -61.73 -46.45 96.5 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 CA-C-N 119.592 1.087 . . . . 1.7 110.007 179.613 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 12.3 tttt -63.26 -36.48 83.81 Favored 'General case' 0 CA--C 1.535 0.382 0 O-C-N 121.834 -0.541 . . . . 3.96 109.983 177.312 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -62.03 -52.44 63.95 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 122.555 0.342 . . . . 3.12 111.081 174.003 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 1.5 m -57.41 -47.37 84.91 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.306 0 O-C-N 121.563 -0.711 . . . . 2.55 109.275 -179.526 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 40.6 t80 -43.41 -58.86 2.38 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.285 1.034 . . . . 5.61 111.159 171.116 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 67.7 mtp180 -63.99 -36.31 83.57 Favored 'General case' 0 N--CA 1.465 0.312 0 O-C-N 121.558 -0.714 . . . . 3.91 112.867 178.626 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -55.49 -44.8 76.87 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 118.822 0.737 . . . . 4.99 109.556 175.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.1 mp -70.53 -48.07 61.35 Favored 'Isoleucine or valine' 0 C--O 1.236 0.357 0 CA-C-O 117.914 -1.041 . . . . 3.37 112.01 176.791 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 26.4 t0 -70.29 68.4 0.34 Allowed 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 123.537 0.735 . . . . 1.9 110.453 -178.04 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 20.1 t30 -56.53 -41.17 76.33 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 126.794 2.038 . . . . 2.16 110.976 -177.341 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -67.61 -14.65 63.13 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.273 1.029 . . . . 2.29 112.116 175.433 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 8.9 mt-30 49.36 57.44 6.48 Favored 'General case' 0 C--N 1.341 0.205 0 C-N-CA 125.223 1.409 . . . . 2.84 110.342 -179.195 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 95.9 p -89.86 -18.74 25.62 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 115.434 -0.803 . . . . 2.37 110.314 176.242 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 80.96 19.9 66.46 Favored Glycine 0 CA--C 1.529 0.941 0 N-CA-C 110.652 -0.979 . . . . 1.35 110.652 -169.532 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 77.0 m-85 -145.49 131.5 19.26 Favored 'General case' 0 CA--C 1.515 -0.389 0 C-N-CA 123.982 0.913 . . . . 3.36 109.336 179.26 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -77.89 81.04 4.32 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 104.618 -2.364 . . . . 2.75 104.618 160.672 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -67.8 166.86 14.54 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 114.098 -1.41 . . . . 2.63 108.176 168.596 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -53.22 -48.1 68.44 Favored 'General case' 0 N--CA 1.452 -0.338 0 O-C-N 121.286 -0.884 . . . . 3.89 112.332 -172.394 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.58 -39.34 80.07 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 111.646 0.239 . . . . 4.77 111.646 -172.09 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -53.03 -36.96 61.11 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 118.692 0.678 . . . . 2.66 112.386 173.333 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 25.4 mt -67.46 -29.23 68.63 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 118.187 0.449 . . . . 3.49 110.204 176.816 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 27.5 ttpt -69.31 -2.39 10.63 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 118.515 -0.755 . . . . 3.49 111.306 170.172 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 17.1 p90 -148.26 44.01 1.04 Allowed 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 119.96 1.255 . . . . 6.49 113.97 166.59 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 50.8 t80 -71.99 -68.54 0.45 Allowed 'General case' 0 CA--C 1.538 0.499 0 O-C-N 120.894 -1.129 . . . . 3.56 110.393 -172.154 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 3.0 mp -73.38 -9.99 59.27 Favored 'General case' 0 C--O 1.234 0.242 0 C-N-CA 124.437 1.095 . . . . 3.03 112.33 173.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.66 -26.27 61.41 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 119.007 0.821 . . . . 2.84 111.326 178.622 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -92.47 -17.03 25.07 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.473 1.109 . . . . 3.42 111.061 178.631 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 9.9 m-30 -82.05 -69.43 0.62 Allowed 'General case' 0 C--O 1.224 -0.275 0 N-CA-C 107.496 -1.298 . . . . 4.24 107.496 175.256 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 25.9 tp10 -97.79 -49.44 4.82 Favored 'General case' 0 C--O 1.227 -0.094 0 C-N-CA 123.451 0.7 . . . . 3.42 109.148 -173.486 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 82.62 109.12 0.06 Allowed 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 124.751 1.22 . . . . 4.27 110.161 -172.417 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 93.58 32.53 7.62 Favored Glycine 0 CA--C 1.53 0.984 0 C-N-CA 124.541 1.067 . . . . 2.46 111.123 -174.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -85.92 -156.39 0.28 Allowed 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 123.922 0.889 . . . . 1.93 109.34 171.088 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.25 1.07 55.32 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 113.685 0.995 . . . . 4.71 113.685 -164.232 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -42.5 -37.41 1.62 Allowed 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 126.711 2.004 . . . . 2.86 113.443 -168.07 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.439 ' H ' ' CD2' ' A' ' 78' ' ' LEU . 0.2 OUTLIER -57.97 -45.47 86.67 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.24 1.416 . . . . 2.09 112.017 177.094 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 88.2 m -64.0 108.32 1.48 Allowed 'General case' 0 C--O 1.235 0.319 0 C-N-CA 124.064 0.946 . . . . 1.98 110.679 -179.434 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 8.5 mp0 -69.24 -38.83 78.67 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-N 114.644 -1.162 . . . . 3.49 110.572 -173.516 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 16.0 m -51.2 -52.61 42.71 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 119.455 1.025 . . . . 1.44 111.172 176.692 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 18.4 tt0 -67.3 -48.81 66.54 Favored 'General case' 0 N--CA 1.446 -0.643 0 C-N-CA 124.084 0.954 . . . . 4.33 109.709 -176.064 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -52.87 -46.22 67.78 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 122.164 0.983 . . . . 1.99 108.938 178.089 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 17.1 tttt -69.73 -33.6 72.69 Favored 'General case' 0 N--CA 1.444 -0.766 0 C-N-CA 125.55 1.54 . . . . 4.8 111.316 -179.545 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.6 t -58.73 -48.11 82.29 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 119.71 1.141 . . . . 2.42 109.145 172.464 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -57.16 -55.43 34.9 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 108.905 -0.776 . . . . 3.44 108.905 173.984 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 5.9 ttt -47.39 -47.0 26.48 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 112.341 0.497 . . . . 4.9 112.341 177.151 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -60.19 -46.12 90.82 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 125.592 1.557 . . . . 1.84 111.193 -169.912 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -84.84 -33.56 22.86 Favored 'General case' 0 C--O 1.227 -0.11 0 N-CA-C 111.776 0.287 . . . . 1.33 111.776 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -63.63 -39.19 93.72 Favored 'General case' 0 N--CA 1.456 -0.15 0 CA-C-N 117.982 0.356 . . . . 1.58 111.114 176.362 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 24.0 t0 -67.26 117.46 9.29 Favored 'General case' 0 N--CA 1.446 -0.651 0 N-CA-C 108.808 -0.812 . . . . 1.69 108.808 176.806 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 9.7 m-20 -100.1 10.76 40.76 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 118.649 -0.691 . . . . 2.94 111.369 178.51 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 25.9 m-20 -103.62 -56.25 2.24 Favored 'General case' 0 C--N 1.343 0.301 0 CA-C-N 119.017 0.826 . . . . 1.38 111.004 175.089 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 99.57 48.47 1.66 Allowed Glycine 0 CA--C 1.53 1.023 0 N-CA-C 108.751 -1.74 . . . . 0.94 108.751 -156.604 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 58.6 p-10 -128.97 -48.65 1.22 Allowed 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 127.119 2.168 . . . . 2.01 109.815 177.705 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 127.55 -66.01 0.57 Allowed Glycine 0 CA--C 1.523 0.585 0 C-N-CA 126.862 2.172 . . . . 1.27 108.129 -177.791 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 60.6 pttt -48.35 135.24 14.01 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.368 1.067 . . . . 5.34 111.233 -178.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 4.1 mt -117.76 108.28 24.19 Favored 'Isoleucine or valine' 0 C--O 1.232 0.176 0 C-N-CA 124.54 1.136 . . . . 1.87 109.41 -173.351 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -68.7 168.24 43.68 Favored Glycine 0 CA--C 1.534 1.25 0 N-CA-C 111.572 -0.611 . . . . 0.95 111.572 171.025 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -62.39 -38.34 89.25 Favored 'General case' 0 C--N 1.34 0.192 0 O-C-N 121.569 -0.959 . . . . 2.05 109.893 175.375 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -53.48 -54.88 30.77 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 123.25 0.62 . . . . 2.47 110.208 172.751 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -55.46 -50.92 68.6 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.254 0.621 . . . . 1.3 111.011 178.743 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 77.5 t80 -57.12 -57.13 13.91 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.389 -0.369 . . . . 5.39 110.902 -179.704 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -54.78 -44.33 73.62 Favored 'General case' 0 C--O 1.219 -0.504 0 C-N-CA 124.17 0.988 . . . . 2.59 110.122 177.765 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -52.44 -59.32 4.58 Favored 'General case' 0 CA--C 1.523 -0.068 0 CA-C-N 119.761 1.164 . . . . 3.1 110.464 176.733 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.76 -50.66 69.81 Favored 'General case' 0 CA--C 1.531 0.236 0 N-CA-C 108.39 -0.967 . . . . 3.61 108.39 -179.215 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 85.4 t -69.53 -13.09 16.83 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.794 0 N-CA-C 113.001 0.741 . . . . 1.74 113.001 -175.784 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 41.6 t-80 -88.09 -5.12 58.63 Favored 'General case' 0 CA--C 1.539 0.555 0 O-C-N 120.43 -1.419 . . . . 3.87 110.542 175.329 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 23.0 t . . . . . 0 C--O 1.253 1.262 0 CA-C-O 115.307 -2.283 . . . . 2.45 113.275 -175.039 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.6 pp . . . . . 0 N--CA 1.453 -0.285 0 CA-C-O 121.649 0.738 . . . . 2.2 111.068 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 16.6 p -73.67 -2.68 24.14 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 112.53 0.567 . . . . 4.71 112.53 -173.51 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -104.23 -35.03 8.15 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 118.668 0.667 . . . . 3.72 111.417 177.702 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 17.1 m -71.57 -44.73 70.01 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.246 0 N-CA-C 112.453 0.538 . . . . 3.75 112.453 -169.476 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -175.66 -58.14 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.161 0 N-CA-C 106.16 -1.793 . . . . 2.08 106.16 -172.94 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 4.9 m -44.63 -22.81 0.09 Allowed 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 127.072 2.149 . . . . 2.04 115.84 -168.625 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -47.67 -51.15 22.69 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 120.298 1.408 . . . . 1.66 112.523 168.047 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -64.6 -39.31 93.49 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-O 122.545 1.164 . . . . 1.95 109.514 -177.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -67.97 -45.36 74.4 Favored 'General case' 0 N--CA 1.442 -0.849 0 C-N-CA 124.463 1.105 . . . . 2.26 109.196 -174.291 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 37.7 pt -63.37 -38.06 81.17 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.803 0 O-C-N 121.458 -0.776 . . . . 1.81 110.591 174.845 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.8 -46.32 81.65 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 118.994 0.816 . . . . 1.94 110.487 173.247 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.12 -57.51 12.51 Favored 'General case' 0 CA--C 1.533 0.314 0 O-C-N 122.032 -0.417 . . . . 1.67 110.843 173.785 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -47.48 -49.07 26.53 Favored 'General case' 0 C--O 1.232 0.15 0 C-N-CA 125.577 1.551 . . . . 1.79 110.71 -178.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -53.22 -45.09 68.54 Favored 'General case' 0 N--CA 1.444 -0.762 0 C-N-CA 125.185 1.394 . . . . 3.68 109.731 179.638 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -79.3 -46.84 16.93 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 109.903 -0.406 . . . . 3.67 109.903 -174.187 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -63.56 -38.08 89.76 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 110.435 -0.209 . . . . 3.56 110.435 -175.542 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 85.5 m -101.81 46.54 0.93 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.717 0.807 . . . . 2.32 110.331 175.806 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 19.1 mtp85 -69.83 -52.74 22.37 Favored 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 108.499 -0.926 . . . . 5.22 108.499 173.803 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -61.95 138.26 95.62 Favored Pre-proline 0 N--CA 1.441 -0.899 0 CA-C-N 114.174 -1.375 . . . . 2.08 110.398 -175.88 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -60.46 150.99 78.14 Favored 'Trans proline' 0 N--CA 1.452 -0.955 0 C-N-CA 122.623 2.215 . . . . 1.25 110.498 -176.672 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 16.9 t70 56.85 15.93 2.5 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.502 1.521 . . . . 3.37 114.033 176.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 21.0 m -87.52 -12.52 45.63 Favored 'General case' 0 CA--C 1.534 0.364 0 O-C-N 121.004 -1.06 . . . . 2.19 110.789 177.842 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -73.78 117.41 15.53 Favored 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 123.791 0.836 . . . . 3.47 110.449 -171.758 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -115.21 147.1 37.77 Favored Pre-proline 0 CA--C 1.538 0.507 0 C-N-CA 125.222 1.409 . . . . 3.34 110.943 178.037 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_endo -62.71 -76.97 0.02 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.478 0 C-N-CA 124.669 3.579 . . . . 0.82 112.557 -175.645 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.4 tt0 -50.64 -45.2 57.69 Favored 'General case' 0 N--CA 1.445 -0.703 0 C-N-CA 124.886 1.274 . . . . 3.19 111.092 -175.505 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 40.4 tptt -47.32 -68.51 0.18 Allowed 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 124.023 0.929 . . . . 3.63 108.631 170.381 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -50.41 -41.76 52.78 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.358 1.063 . . . . 3.44 112.501 -177.668 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 14.8 m-30 -54.38 -52.29 62.14 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 118.48 0.582 . . . . 6.22 110.317 179.718 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -74.27 -37.96 63.56 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 120.338 -0.545 . . . . 3.43 110.622 -179.278 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -62.58 -34.63 77.38 Favored 'General case' 0 N--CA 1.442 -0.847 0 C-N-CA 124.052 0.941 . . . . 1.71 112.457 -178.686 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 14.9 m -82.65 -0.99 49.8 Favored 'General case' 0 N--CA 1.451 -0.412 0 O-C-N 123.468 0.48 . . . . 2.62 111.382 174.024 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 76.45 -2.5 57.62 Favored Glycine 0 CA--C 1.527 0.831 0 N-CA-C 111.511 -0.636 . . . . 0.91 111.511 -177.277 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -65.29 -31.46 72.61 Favored 'General case' 0 N--CA 1.445 -0.68 0 O-C-N 121.306 -1.114 . . . . 3.48 111.819 -172.709 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 83.0 p -77.3 -15.19 59.55 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 119.392 0.996 . . . . 2.63 112.368 172.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.93 -35.67 21.94 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 108.804 -0.813 . . . . 6.13 108.804 175.194 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 31.8 mmt -55.94 131.51 47.36 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-O 121.834 0.826 . . . . 4.35 110.646 171.564 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 2.0 m -70.56 159.84 33.59 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 115.398 -0.819 . . . . 2.32 109.676 178.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -41.33 -43.82 2.58 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.363 1.065 . . . . 1.72 112.138 177.543 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 66.8 m-20 -48.52 -61.57 1.95 Allowed 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 123.959 0.904 . . . . 2.1 110.304 175.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 22.5 mm-40 -62.15 -44.52 96.44 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 115.568 -0.742 . . . . 2.69 109.382 -179.169 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 57.8 t -59.55 -35.35 58.66 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.63 0 CA-C-N 119.079 0.854 . . . . 1.69 110.116 -178.237 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 3.8 tttp -67.42 -44.56 78.46 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.646 0.778 . . . . 3.55 111.201 174.196 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 73.5 m-20 -60.61 -54.87 40.17 Favored 'General case' 0 C--O 1.233 0.219 0 O-C-N 121.986 -0.446 . . . . 2.97 110.216 177.902 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 3.9 m -58.15 -46.52 88.39 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.241 0 CA-C-O 118.575 -0.726 . . . . 1.83 109.567 179.237 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 4.2 t80 -41.87 -55.15 3.18 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 123.95 0.9 . . . . 6.43 110.99 170.505 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 35.9 mtt85 -59.29 -37.99 79.09 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 118.177 0.444 . . . . 4.65 111.834 177.822 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 14.5 t80 -63.94 -30.2 71.3 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 122.143 -0.348 . . . . 5.08 110.544 177.292 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.3 mm -79.7 -50.01 18.56 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 CA-C-O 118.43 -0.795 . . . . 2.29 111.212 179.519 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -69.26 72.61 0.3 Allowed 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 123.862 0.865 . . . . 2.27 108.853 -176.212 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -61.4 -31.85 71.78 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 125.684 1.594 . . . . 2.01 111.407 -168.464 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 13.5 p-10 -69.64 -32.52 71.25 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 125.395 1.478 . . . . 2.49 111.815 171.237 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 59.23 80.04 0.21 Allowed 'General case' 0 N--CA 1.445 -0.677 0 CA-C-O 122.228 1.013 . . . . 3.52 109.084 -177.577 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 4.9 p -118.08 -70.25 0.8 Allowed 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 107.844 -1.169 . . . . 2.38 107.844 175.176 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 147.68 35.04 0.05 OUTLIER Glycine 0 CA--C 1.53 1.004 0 C-N-CA 126.781 2.134 . . . . 1.78 111.589 -179.831 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 33.0 m-85 -159.71 129.38 5.38 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 105.451 -2.055 . . . . 3.32 105.451 -178.803 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -86.42 75.58 9.76 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 105.202 -2.148 . . . . 2.9 105.202 166.302 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -55.77 133.3 50.91 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 113.874 -1.512 . . . . 1.62 107.724 175.797 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -48.51 -46.07 38.0 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 119.073 0.851 . . . . 5.59 113.151 -164.411 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -56.12 -31.42 63.3 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 122.705 0.402 . . . . 3.05 111.487 -176.923 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 92.4 mt-10 -66.82 -34.34 77.59 Favored 'General case' 0 N--CA 1.453 -0.3 0 O-C-N 120.964 -1.085 . . . . 2.57 110.954 176.66 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 86.9 mt -62.78 -29.21 70.53 Favored 'General case' 0 N--CA 1.456 -0.17 0 O-C-N 122.05 -0.406 . . . . 3.89 110.459 176.343 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 65.9 tttt -60.9 -7.37 2.35 Favored 'General case' 0 CA--C 1.543 0.675 0 O-C-N 121.75 -0.594 . . . . 5.13 112.426 171.438 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 11.8 t80 -137.96 37.42 2.36 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.145 0.978 . . . . 7.19 110.596 168.214 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -75.84 -79.12 0.1 Allowed 'General case' 0 N--CA 1.464 0.231 0 O-C-N 121.434 -0.791 . . . . 4.22 110.074 178.257 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 3.7 tt -62.75 -20.03 64.55 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.258 1.023 . . . . 3.36 110.427 -169.349 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 93.7 mm-40 -46.71 -37.62 8.69 Favored 'General case' 0 CA--C 1.541 0.632 0 O-C-N 121.051 -1.03 . . . . 2.45 112.013 166.154 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.68 -38.22 69.34 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 118.977 0.808 . . . . 3.54 111.204 173.47 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 9.0 m-30 -79.4 -52.25 8.32 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 123.999 0.92 . . . . 4.35 109.698 -177.386 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -150.79 134.79 16.75 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 123.491 0.716 . . . . 3.33 109.942 -175.325 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 15.5 t -58.86 -30.33 67.65 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.584 1.154 . . . . 4.68 111.607 -179.551 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -87.72 16.29 51.06 Favored Glycine 0 CA--C 1.525 0.678 0 C-N-CA 125.515 1.531 . . . . 3.35 111.446 -174.95 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -59.17 171.32 0.75 Allowed 'General case' 0 N--CA 1.444 -0.767 0 C-N-CA 123.544 0.738 . . . . 2.12 112.178 171.462 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 20.5 mmm180 -89.02 -27.32 20.93 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-O 118.396 -0.811 . . . . 4.87 112.795 -176.554 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -28.15 -43.49 0.02 OUTLIER 'General case' 0 N--CA 1.461 0.088 0 C-N-CA 128.694 2.797 . . . . 3.39 115.799 -166.822 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -40.37 -55.75 2.16 Favored 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 126.491 1.916 . . . . 2.65 110.199 174.513 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.68 133.18 42.12 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-O 122.7 1.238 . . . . 2.93 109.432 176.058 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 48.5 mp0 -74.14 -32.39 63.12 Favored 'General case' 0 N--CA 1.436 -1.131 0 CA-C-N 113.623 -1.626 . . . . 3.49 110.513 -179.021 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 19.8 m -54.27 -66.12 0.45 Allowed 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 119.751 1.16 . . . . 1.84 111.009 176.36 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -49.53 -53.15 25.09 Favored 'General case' 0 N--CA 1.452 -0.342 0 O-C-N 122.151 -0.343 . . . . 3.41 111.375 177.07 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -61.9 -43.5 98.72 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-O 121.813 0.816 . . . . 2.28 110.455 -173.743 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 46.9 mmtt -64.59 -28.03 69.35 Favored 'General case' 0 C--O 1.218 -0.599 0 CA-C-O 118.6 -0.714 . . . . 6.15 110.076 179.329 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -53.72 -44.86 70.22 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 119.467 1.031 . . . . 2.28 110.151 170.411 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.5 tt -64.29 -60.0 3.71 Favored 'General case' 0 C--N 1.342 0.249 0 O-C-N 121.85 -0.531 . . . . 4.13 109.718 172.848 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 8.5 tmm? -48.06 -58.14 4.87 Favored 'General case' 0 CA--C 1.536 0.429 0 O-C-N 123.94 0.775 . . . . 3.77 110.734 -173.772 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -38.64 -49.19 1.53 Allowed 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 128.105 2.562 . . . . 1.86 112.45 179.315 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -82.56 -51.79 7.45 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 110.162 -0.31 . . . . 1.37 110.162 -178.14 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -48.83 -40.12 28.09 Favored 'General case' 0 CA--C 1.528 0.128 0 C-N-CA 124.267 1.027 . . . . 1.55 112.221 -179.528 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -72.97 83.43 1.24 Allowed 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 109.79 -0.448 . . . . 0.91 109.79 179.121 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 46.3 m-80 -74.79 37.39 0.11 Allowed 'General case' 0 CA--C 1.539 0.526 0 O-C-N 121.383 -0.823 . . . . 3.08 111.772 177.761 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 20.5 m-20 -121.92 -55.48 1.89 Allowed 'General case' 0 N--CA 1.458 -0.054 0 C-N-CA 124.872 1.269 . . . . 1.24 108.392 174.398 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 93.2 43.53 4.03 Favored Glycine 0 CA--C 1.531 1.071 0 N-CA-C 109.008 -1.637 . . . . 0.82 109.008 -159.28 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -122.05 -55.73 1.87 Allowed 'General case' 0 C--N 1.34 0.182 0 C-N-CA 125.069 1.347 . . . . 2.44 109.655 174.701 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 135.51 -58.49 0.67 Allowed Glycine 0 CA--C 1.528 0.875 0 N-CA-C 110.901 -0.879 . . . . 0.81 110.901 -174.136 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 18.8 mttt -63.78 113.59 3.49 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 109.089 -0.708 . . . . 4.8 109.089 -176.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 6.7 mt -90.8 150.78 3.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 N-CA-C 107.427 -1.323 . . . . 1.69 107.427 174.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -126.94 -178.35 15.27 Favored Glycine 0 CA--C 1.522 0.495 0 N-CA-C 109.711 -1.355 . . . . 0.92 109.711 171.734 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -62.95 -42.67 99.89 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-N 117.288 0.544 . . . . 2.06 109.976 -174.146 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -58.39 -63.51 1.25 Allowed 'General case' 0 N--CA 1.449 -0.515 0 CA-C-O 118.237 -0.887 . . . . 2.62 110.282 177.37 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -45.48 -50.79 12.43 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 119.126 0.876 . . . . 1.24 111.949 175.399 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 57.6 t80 -60.98 -54.07 49.49 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 109.628 -0.508 . . . . 4.68 109.628 -175.407 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 24.9 tt0 -59.34 -46.13 89.46 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 123.769 0.828 . . . . 2.61 110.68 -179.259 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -49.58 -58.84 4.48 Favored 'General case' 0 C--O 1.23 0.038 0 CA-C-N 119.214 0.916 . . . . 3.74 110.416 175.298 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.61 -50.2 68.09 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 120.669 -0.412 . . . . 3.39 110.589 -176.318 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 55.3 t -54.43 -39.29 44.12 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.304 0 C-N-CA 123.02 0.528 . . . . 2.1 111.227 177.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 13.1 t60 -66.31 -19.93 65.95 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 124.247 1.019 . . . . 3.09 110.536 -178.161 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 4.3 t . . . . . 0 C--O 1.253 1.261 0 CA-C-O 117.506 -1.235 . . . . 3.58 110.406 -179.989 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 5.3 pt . . . . . 0 CA--C 1.531 0.223 0 N-CA-C 112.877 0.695 . . . . 4.1 112.877 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 8.2 t -51.02 -27.9 8.89 Favored 'General case' 0 N--CA 1.425 -1.687 0 C-N-CA 129.326 3.05 . . . . 3.25 113.734 178.136 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 24.8 t0 -152.72 52.1 0.76 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.662 0.785 . . . . 3.56 110.547 -178.762 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 4.5 t -118.98 -56.46 3.61 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.194 0 C-N-CA 125.139 1.376 . . . . 2.43 109.612 175.856 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 2.4 tp -167.67 -55.92 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 105.703 -1.962 . . . . 2.01 105.703 -177.004 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 70.1 m -51.53 -29.0 15.27 Favored 'General case' 0 N--CA 1.442 -0.871 0 N-CA-C 114.894 1.442 . . . . 1.92 114.894 -167.148 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -50.29 -42.86 53.14 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 121.151 -0.968 . . . . 1.98 112.171 173.132 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -69.09 -38.03 78.75 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-O 121.48 0.657 . . . . 2.07 110.462 176.293 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -58.96 -49.35 78.19 Favored 'General case' 0 C--O 1.234 0.257 0 C-N-CA 122.941 0.497 . . . . 4.94 109.716 -179.914 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 11.5 pt -65.35 -38.88 83.62 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.41 0 N-CA-C 109.277 -0.638 . . . . 2.36 109.277 -176.703 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -53.86 -47.7 70.77 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 118.321 0.509 . . . . 1.91 110.595 175.56 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.66 -59.22 5.73 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-O 120.512 0.196 . . . . 1.86 111.088 175.606 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -50.65 -46.83 58.61 Favored 'General case' 0 CA--C 1.528 0.117 0 C-N-CA 124.111 0.964 . . . . 1.66 111.637 -176.827 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 5.1 mp -51.34 -37.6 48.7 Favored 'General case' 0 C--N 1.333 -0.146 0 C-N-CA 124.417 1.087 . . . . 4.96 111.477 178.722 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -82.39 -46.62 13.31 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 109.519 -0.549 . . . . 6.54 109.519 178.306 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -70.56 -31.16 68.09 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 112.112 0.412 . . . . 2.42 112.112 -167.681 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 65.9 m -118.05 47.97 1.48 Allowed 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 125.572 1.549 . . . . 2.0 108.571 171.345 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 37.9 ttt85 -68.88 -32.22 71.72 Favored 'General case' 0 CA--C 1.534 0.339 0 O-C-N 121.673 -0.642 . . . . 6.21 109.983 173.586 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 91.8 m-20 -80.79 150.12 68.76 Favored Pre-proline 0 CA--C 1.539 0.522 0 C-N-CA 125.591 1.556 . . . . 2.25 110.924 -166.542 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -66.05 141.06 62.38 Favored 'Trans proline' 0 N--CA 1.455 -0.747 0 C-N-CA 123.105 2.537 . . . . 1.49 110.21 -174.89 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 63.97 9.18 4.4 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.583 1.553 . . . . 2.31 113.417 177.034 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 24.2 m -92.6 -9.52 40.74 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 119.568 1.077 . . . . 1.98 113.221 -171.666 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -58.43 115.21 2.84 Favored 'General case' 0 N--CA 1.448 -0.569 0 O-C-N 121.764 -0.585 . . . . 4.05 109.672 176.436 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -102.98 148.19 35.23 Favored Pre-proline 0 CA--C 1.532 0.288 0 N-CA-C 108.859 -0.793 . . . . 3.7 108.859 164.07 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -67.23 -65.94 0.04 OUTLIER 'Trans proline' 0 N--CA 1.451 -0.998 0 C-N-CA 123.254 2.636 . . . . 1.18 111.02 -177.062 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 35.4 mt-30 -58.8 -32.33 69.24 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 124.15 0.98 . . . . 2.33 110.841 -178.478 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 18.6 tptm -61.37 -66.56 0.52 Allowed 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 123.5 0.72 . . . . 3.6 109.943 173.093 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 51.3 t80 -54.38 -47.69 72.38 Favored 'General case' 0 C--O 1.221 -0.402 0 C-N-CA 122.975 0.51 . . . . 3.63 109.896 -176.93 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 3.8 t80 -39.01 -58.47 1.11 Allowed 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 126.514 1.926 . . . . 6.4 112.078 172.566 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 30.8 tt0 -72.09 -47.02 54.44 Favored 'General case' 0 N--CA 1.45 -0.458 0 N-CA-C 109.291 -0.633 . . . . 3.09 109.291 -176.803 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -57.63 -34.42 69.29 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 123.197 0.599 . . . . 1.65 110.977 -177.043 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 26.1 t -81.4 -5.03 57.46 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 125.942 1.697 . . . . 2.05 109.876 -177.862 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 74.69 4.13 69.65 Favored Glycine 0 CA--C 1.527 0.841 0 O-C-N 119.11 -2.244 . . . . 1.06 111.608 171.912 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 89.8 mt -60.78 -33.98 73.8 Favored 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 124.814 1.246 . . . . 2.91 109.16 178.147 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 21.1 t -61.64 -33.97 74.86 Favored 'General case' 0 N--CA 1.462 0.156 0 C-N-CA 123.952 0.901 . . . . 2.79 111.229 172.72 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 25.9 tttt -80.6 -36.86 32.18 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 108.403 -0.962 . . . . 5.29 108.403 -176.747 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 25.8 mmt -69.36 135.45 50.37 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-O 121.689 0.757 . . . . 4.97 111.832 -179.573 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 2.6 m -69.89 154.19 42.29 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 123.356 0.662 . . . . 2.18 110.671 179.593 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -42.27 -40.02 2.29 Favored 'General case' 0 C--O 1.222 -0.359 0 C-N-CA 123.853 0.861 . . . . 1.65 112.099 175.301 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 62.8 m-20 -47.52 -59.46 3.23 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.232 1.013 . . . . 2.13 110.94 175.259 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 2.6 mm100 -69.19 -40.17 78.24 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 109.441 -0.577 . . . . 2.72 109.441 -176.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 89.6 t -62.58 -36.6 75.85 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.525 0 CA-C-N 118.748 0.704 . . . . 1.73 109.53 -178.386 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 48.2 tttm -66.26 -46.09 78.3 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 123.213 0.605 . . . . 3.88 109.824 174.372 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -55.31 -57.83 10.19 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 117.93 0.332 . . . . 3.1 110.935 176.141 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 4.7 m -55.77 -46.08 79.67 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.239 0 CA-C-O 118.858 -0.592 . . . . 1.7 109.929 179.218 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -45.24 -53.69 7.97 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 118.603 0.638 . . . . 6.07 110.677 172.017 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 68.3 mtp180 -61.39 -43.42 98.89 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 119.057 0.844 . . . . 3.78 111.721 -179.868 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 13.6 m-85 -62.52 -38.63 90.69 Favored 'General case' 0 C--O 1.235 0.313 0 O-C-N 121.835 -0.541 . . . . 6.14 110.751 179.678 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 38.6 mm -82.65 -39.93 16.3 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 CA-C-O 118.053 -0.975 . . . . 2.81 112.005 -174.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 60.8 t0 -64.12 74.62 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 125.313 1.445 . . . . 1.98 108.141 169.097 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -54.49 155.38 4.02 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 106.612 -1.625 . . . . 3.21 106.612 164.647 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 76.22 -47.15 0.55 Allowed 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 118.757 0.708 . . . . 3.11 111.97 -173.686 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 8.3 mt-30 61.12 45.83 8.73 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.578 0.751 . . . . 3.63 110.351 -174.087 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 34.3 p -53.6 -33.02 53.51 Favored 'General case' 0 C--N 1.34 0.156 0 C-N-CA 124.703 1.201 . . . . 1.93 111.24 173.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 121.34 -23.78 7.5 Favored Glycine 0 CA--C 1.528 0.872 0 N-CA-C 109.633 -1.387 . . . . 1.81 109.633 -167.152 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 65.9 m-85 -126.38 151.89 47.03 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 123.785 0.834 . . . . 3.72 110.107 -176.165 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 18.6 mt -80.56 82.33 6.6 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 105.316 -2.105 . . . . 3.76 105.316 152.516 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -65.17 146.89 54.39 Favored 'General case' 0 CA--C 1.549 0.909 0 CA-C-N 113.268 -1.787 . . . . 2.38 108.416 173.122 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -45.22 -55.87 5.39 Favored 'General case' 0 C--O 1.234 0.287 0 O-C-N 120.668 -1.27 . . . . 3.89 114.324 -171.34 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -51.35 -30.69 19.52 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.781 0.832 . . . . 3.62 111.547 179.041 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -68.34 -45.82 71.85 Favored 'General case' 0 N--CA 1.444 -0.754 0 O-C-N 121.749 -0.595 . . . . 3.1 110.465 178.532 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.74 -30.21 71.34 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 119.556 -0.858 . . . . 3.9 110.156 178.236 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 12.1 ttpp -57.5 -5.96 0.41 Allowed 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.772 1.229 . . . . 2.98 113.465 171.111 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 36.7 p90 -137.67 27.72 2.73 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 119.864 1.211 . . . . 6.38 112.395 165.476 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 63.8 t80 -53.99 -73.38 0.05 OUTLIER 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 124.543 1.137 . . . . 4.12 112.263 -176.136 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.81 -26.0 65.86 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 108.909 -0.774 . . . . 5.01 108.909 -171.636 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -52.22 -38.43 57.98 Favored 'General case' 0 C--O 1.226 -0.151 0 C-N-CA 126.861 2.065 . . . . 3.59 111.231 174.313 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 20.8 mtpt -63.34 -29.29 70.62 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 117.997 0.362 . . . . 3.89 111.744 176.383 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -79.59 -56.18 4.49 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 124.126 0.97 . . . . 6.95 108.875 -178.5 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -104.24 -123.52 0.21 Allowed 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 108.023 -1.102 . . . . 4.16 108.023 -173.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 21.8 p -157.29 -5.64 0.1 Allowed 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 116.577 2.066 . . . . 3.17 116.577 175.608 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -169.33 66.25 0.17 Allowed Glycine 0 C--N 1.334 0.465 0 N-CA-C 108.222 -1.951 . . . . 2.39 108.222 175.528 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -89.02 -106.46 0.08 Allowed 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 117.385 0.593 . . . . 1.99 109.557 -171.16 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 9.4 tpt180 -151.11 50.49 0.84 Allowed 'General case' 0 N--CA 1.457 -0.109 0 CA-C-O 122.194 0.997 . . . . 5.76 110.474 -174.421 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -95.85 -18.05 20.66 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 126.008 1.723 . . . . 4.77 108.946 178.636 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -71.54 -42.86 67.37 Favored 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 124.375 1.07 . . . . 2.29 110.632 -179.204 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.91 126.5 28.73 Favored 'General case' 0 C--N 1.343 0.308 0 C-N-CA 118.401 -1.32 . . . . 2.26 109.47 179.485 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -61.91 -37.41 84.56 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 114.098 -1.41 . . . . 3.62 109.412 174.514 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -66.75 -60.16 2.93 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 117.994 0.361 . . . . 2.17 111.09 -179.083 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -52.94 -41.57 64.62 Favored 'General case' 0 N--CA 1.454 -0.246 0 O-C-N 121.135 -0.978 . . . . 3.11 110.797 177.071 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 4.4 m -59.44 -60.32 4.03 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 119.355 -0.938 . . . . 2.15 110.911 173.144 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 35.4 pttt -61.37 -27.52 68.58 Favored 'General case' 0 C--O 1.213 -0.848 0 C-N-CA 123.511 0.724 . . . . 7.3 110.603 -168.732 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 34.8 m -48.26 -47.3 36.2 Favored 'General case' 0 C--N 1.326 -0.426 0 O-C-N 121.251 -0.906 . . . . 2.3 110.832 170.822 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 11.6 mt -75.09 -54.42 7.18 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 109.183 -0.673 . . . . 3.46 109.183 171.349 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 1.6 tpt -54.67 -20.09 7.49 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 115.178 1.547 . . . . 6.83 115.178 -175.808 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -83.12 -61.17 1.93 Allowed 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 127.057 2.143 . . . . 1.49 109.457 -179.128 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -80.89 -34.14 33.76 Favored 'General case' 0 N--CA 1.455 -0.213 0 O-C-N 121.903 -0.498 . . . . 2.5 111.917 -171.654 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -60.2 -38.94 84.82 Favored 'General case' 0 C--O 1.227 -0.086 0 CA-C-N 118.418 0.554 . . . . 1.73 109.69 172.256 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -66.18 -62.67 1.36 Allowed 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 109.549 -0.538 . . . . 1.9 109.549 176.842 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 10.1 p30 43.59 23.13 0.04 OUTLIER 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 126.553 1.941 . . . . 4.47 115.038 -173.668 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 52.4 m-20 -95.78 -45.44 6.99 Favored 'General case' 0 C--N 1.338 0.091 0 C-N-CA 124.373 1.069 . . . . 1.93 108.339 171.947 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 97.75 41.49 3.34 Favored Glycine 0 CA--C 1.53 0.97 0 N-CA-C 109.463 -1.455 . . . . 1.31 109.463 -158.604 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . 0.252 1.7 p30 -127.74 -54.81 1.32 Allowed 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 118.416 1.108 . . . . 2.08 111.917 171.604 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 114.49 -34.37 4.94 Favored Glycine 0 CA--C 1.53 1.009 0 C-N-CA 124.611 1.101 . . . . 0.89 112.46 176.868 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 52.8 pttt -70.1 127.85 34.26 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-N 118.858 1.329 . . . . 4.72 108.058 173.105 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 8.7 mt -117.46 107.45 22.24 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.156 0 N-CA-C 108.307 -0.998 . . . . 1.96 108.307 -173.185 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -61.88 163.59 24.22 Favored Glycine 0 CA--C 1.526 0.752 0 N-CA-C 111.04 -0.824 . . . . 0.77 111.04 172.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -51.01 -42.86 60.68 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 109.039 -0.726 . . . . 1.87 109.039 168.359 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 8.8 tt0 -57.64 -56.74 18.01 Favored 'General case' 0 N--CA 1.445 -0.68 0 C-N-CA 124.121 0.968 . . . . 2.73 110.044 179.003 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -50.87 -48.07 60.29 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.68 0.792 . . . . 1.5 110.98 176.22 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 79.5 t80 -58.31 -54.56 45.67 Favored 'General case' 0 CA--C 1.538 0.492 0 O-C-N 121.745 -0.597 . . . . 5.46 110.896 179.052 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 13.0 mt-30 -61.96 -29.0 69.94 Favored 'General case' 0 C--O 1.221 -0.422 0 CA-C-O 118.001 -0.999 . . . . 4.05 112.534 177.519 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 23.5 mm-40 -63.01 -59.37 4.91 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 120.288 1.404 . . . . 3.29 107.778 172.374 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 5.6 tpt -54.99 -41.6 71.42 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 110.231 -0.285 . . . . 4.09 110.231 -176.378 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 52.8 t -78.4 -54.86 11.35 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.51 0 N-CA-C 113.153 0.797 . . . . 2.04 113.153 -177.142 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 4.5 t-80 -72.05 -8.77 56.47 Favored 'General case' 0 C--N 1.326 -0.425 0 O-C-N 119.508 -1.995 . . . . 4.7 111.057 -175.702 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 33.2 t . . . . . 0 C--O 1.254 1.319 0 CA-C-O 115.084 -2.389 . . . . 2.79 113.643 167.14 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.3 pp . . . . . 0 CA--C 1.536 0.413 0 N-CA-C 112.393 0.516 . . . . 1.95 112.393 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 9.1 t -64.87 -8.96 17.49 Favored 'General case' 0 N--CA 1.432 -1.361 0 C-N-CA 127.542 2.337 . . . . 2.59 111.541 -176.087 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 29.8 t0 -132.83 7.35 4.05 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 126.681 1.992 . . . . 2.4 109.477 -175.838 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 77.7 t -90.6 -61.31 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.344 0.347 0 O-C-N 121.574 -0.704 . . . . 2.93 109.827 174.361 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -166.26 -60.32 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.196 0 N-CA-C 107.517 -1.29 . . . . 2.02 107.517 -174.116 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 27.5 m -41.45 -25.89 0.05 Allowed 'General case' 0 C--O 1.221 -0.437 0 C-N-CA 126.959 2.103 . . . . 2.14 115.969 -169.846 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -48.09 -47.33 34.26 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 119.81 1.186 . . . . 1.91 112.387 171.416 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -64.71 -41.32 96.08 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-O 122.477 1.132 . . . . 1.75 109.716 179.838 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -68.88 -45.49 70.82 Favored 'General case' 0 N--CA 1.445 -0.683 0 C-N-CA 124.285 1.034 . . . . 2.39 109.384 -172.674 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 32.4 pt -60.93 -37.46 77.02 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.807 0 O-C-N 121.256 -0.902 . . . . 1.9 111.076 175.564 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.85 -43.95 77.58 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 118.68 0.673 . . . . 1.8 110.626 173.52 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.02 -57.12 14.22 Favored 'General case' 0 CA--C 1.534 0.363 0 O-C-N 121.946 -0.471 . . . . 1.98 110.524 172.803 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -47.31 -43.57 22.75 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.845 1.258 . . . . 1.95 111.222 -179.596 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.62 -36.99 77.43 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 126.16 1.784 . . . . 4.25 110.9 -177.614 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -91.38 -42.98 10.02 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 122.818 0.447 . . . . 3.43 110.005 -175.047 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.437 ' OE1' ' NZ ' ' A' ' 29' ' ' LYS . 10.8 pt-20 -69.58 -32.9 71.94 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-O 119.792 -0.146 . . . . 3.54 110.973 -176.531 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 62.1 m -109.15 55.83 0.63 Allowed 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.927 0.891 . . . . 2.21 108.615 175.312 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.88 -53.67 12.48 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 121.608 0.718 . . . . 6.45 109.977 -168.156 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -69.66 140.28 89.32 Favored Pre-proline 0 N--CA 1.445 -0.709 0 CA-C-N 114.266 -1.334 . . . . 3.18 107.592 176.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -51.16 -70.92 0.05 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.659 0 C-N-CA 124.386 3.391 . . . . 4.12 112.089 -164.225 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 12.3 p-10 -77.08 49.35 0.66 Allowed 'General case' 0 CA--C 1.543 0.675 0 O-C-N 121.493 -0.754 . . . . 3.32 112.582 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 2.8 m -122.13 27.76 7.85 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 124.367 1.067 . . . . 2.03 110.151 174.851 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 12.0 t80 -109.1 135.91 49.46 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 124.695 1.198 . . . . 6.04 108.704 -179.869 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 -122.13 142.86 37.61 Favored Pre-proline 0 N--CA 1.451 -0.422 0 N-CA-C 107.696 -1.224 . . . . 3.82 107.696 169.639 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -64.86 -59.03 0.18 Allowed 'Trans proline' 0 N--CA 1.452 -0.963 0 C-N-CA 123.601 2.868 . . . . 1.02 111.296 -177.054 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -52.44 -50.66 62.18 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.307 0.643 . . . . 3.74 110.818 -179.179 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.437 ' NZ ' ' OE1' ' A' ' 18' ' ' GLU . 12.6 tptp -45.53 -65.14 0.58 Allowed 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.433 1.093 . . . . 3.63 108.852 170.105 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -50.49 -44.36 55.86 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 124.879 1.272 . . . . 4.36 112.873 -176.957 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 13.5 m-85 -56.35 -46.54 79.92 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-N 120.036 1.289 . . . . 5.88 111.006 -178.189 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 -70.32 -46.53 64.03 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 109.454 -0.573 . . . . 2.89 109.454 178.019 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -63.8 -33.39 75.56 Favored 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 124.764 1.226 . . . . 1.57 113.137 -174.073 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.4 t -85.67 -1.32 57.04 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 125.319 1.448 . . . . 2.24 109.669 178.843 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 76.95 -11.83 13.61 Favored Glycine 0 CA--C 1.531 1.054 0 O-C-N 121.396 -0.815 . . . . 0.92 112.238 179.309 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 32.6 mt -55.93 -33.84 65.07 Favored 'General case' 0 N--CA 1.444 -0.728 0 C-N-CA 126.518 1.927 . . . . 2.4 112.525 -177.654 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 46.9 t -69.23 -32.95 72.52 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 118.803 0.729 . . . . 2.48 111.301 173.292 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 10.6 tttt -75.43 -34.79 61.02 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 108.563 -0.903 . . . . 4.98 108.563 -179.078 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 36.3 mtt -57.34 124.69 19.75 Favored 'General case' 0 N--CA 1.442 -0.848 0 N-CA-C 109.601 -0.518 . . . . 3.83 109.601 171.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 6.0 m -63.34 160.48 15.89 Favored 'General case' 0 N--CA 1.452 -0.337 0 O-C-N 121.537 -0.727 . . . . 2.24 110.73 176.46 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -41.6 -41.99 2.34 Favored 'General case' 0 C--O 1.224 -0.253 0 C-N-CA 125.005 1.322 . . . . 1.74 112.332 176.22 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 75.8 m-20 -48.69 -61.13 2.19 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.223 0.609 . . . . 2.13 109.886 175.514 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 9.0 mm-40 -62.84 -46.43 87.95 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 115.83 -0.623 . . . . 2.66 109.682 -178.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 62.6 t -58.82 -39.07 76.19 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 CA-C-N 119.789 1.177 . . . . 1.8 110.77 -176.836 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 6.7 ttmt -64.27 -48.43 75.77 Favored 'General case' 0 CA--C 1.536 0.432 0 O-C-N 121.366 -0.834 . . . . 5.76 110.707 172.861 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 78.1 m-20 -61.19 -51.1 70.45 Favored 'General case' 0 CA--C 1.535 0.387 0 O-C-N 121.807 -0.558 . . . . 3.41 110.06 -176.178 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 9.0 m -58.8 -46.65 90.8 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.27 0 CA-C-O 118.412 -0.804 . . . . 1.83 110.105 174.485 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 11.8 t80 -45.65 -48.71 14.82 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 119.291 0.951 . . . . 5.76 111.233 173.257 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 86.3 mtt-85 -61.19 -36.28 79.44 Favored 'General case' 0 CA--C 1.532 0.277 0 O-C-N 121.608 -0.682 . . . . 5.15 112.169 176.377 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 25.1 t80 -64.89 -33.76 76.78 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 118.805 0.729 . . . . 4.95 110.071 173.158 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 14.1 mm -67.25 -58.0 7.83 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.284 0 CA-C-O 117.895 -1.05 . . . . 2.45 111.721 176.583 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -73.18 70.97 1.15 Allowed 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 119.21 0.914 . . . . 2.37 109.457 -173.663 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 15.5 t30 -59.9 -32.63 70.93 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 125.967 1.707 . . . . 2.01 111.887 -170.791 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 17.2 p-10 -74.3 -21.05 59.91 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.473 1.109 . . . . 2.34 111.607 174.494 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 8.1 mt-30 49.92 63.07 2.33 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 126.496 1.919 . . . . 3.15 111.389 -178.103 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.2 p -93.71 -38.82 11.11 Favored 'General case' 0 CA--C 1.521 -0.149 0 CA-C-N 115.698 -0.683 . . . . 1.98 109.978 167.572 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 99.72 18.49 22.82 Favored Glycine 0 CA--C 1.53 0.971 0 CA-C-O 119.71 -0.494 . . . . 1.6 111.925 -169.329 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 36.7 m-85 -135.14 137.64 42.96 Favored 'General case' 0 C--O 1.238 0.454 0 N-CA-C 108.717 -0.846 . . . . 3.93 108.717 163.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -90.91 70.79 6.48 Favored 'General case' 0 C--O 1.231 0.099 0 C-N-CA 126.067 1.747 . . . . 2.78 107.87 168.89 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -63.56 165.64 7.78 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 123.314 0.646 . . . . 1.77 110.59 177.411 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -48.93 -47.38 43.64 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.147 0.979 . . . . 4.32 111.601 -176.837 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -73.74 -18.8 60.94 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 115.679 -0.691 . . . . 3.09 112.56 -177.03 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -70.51 -48.79 53.88 Favored 'General case' 0 CA--C 1.522 -0.105 0 N-CA-C 108.58 -0.896 . . . . 2.67 108.58 165.445 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -49.37 -41.96 40.65 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 115.642 -0.708 . . . . 3.72 110.208 176.861 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 30.3 ttpt -55.02 -8.15 0.25 Allowed 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 114.5 1.296 . . . . 2.86 114.5 176.636 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 32.2 p90 -136.46 18.94 3.12 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 120.584 1.538 . . . . 7.01 113.564 168.37 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 2.7 t80 -42.48 -75.92 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.042 1.337 . . . . 3.86 114.107 -172.562 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 1.5 mt -73.89 -0.2 15.3 Favored 'General case' 0 CA--C 1.532 0.267 0 O-C-N 121.251 -0.905 . . . . 3.34 111.529 178.223 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -72.34 -19.17 61.69 Favored 'General case' 0 CA--C 1.532 0.257 0 O-C-N 120.599 -1.313 . . . . 3.0 110.714 -176.552 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.0 -29.6 68.58 Favored 'General case' 0 CA--C 1.534 0.332 0 O-C-N 122.006 -0.434 . . . . 3.88 111.321 163.654 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 2.5 m-30 -90.56 -65.02 1.05 Allowed 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 108.576 -0.898 . . . . 4.55 108.576 -176.479 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -117.33 119.47 35.25 Favored 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 107.922 -1.14 . . . . 3.08 107.922 -172.79 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 4.2 p -49.22 -34.45 14.91 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 123.73 0.812 . . . . 3.05 112.324 179.536 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -111.81 36.69 4.04 Favored Glycine 0 CA--C 1.524 0.643 0 C-N-CA 124.903 1.239 . . . . 1.68 110.925 -178.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.77 175.68 1.08 Allowed 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 117.617 0.708 . . . . 1.95 110.602 169.397 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.63 3.63 28.1 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 114.523 1.305 . . . . 6.56 114.523 -164.989 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -55.26 -26.51 40.42 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.092 0.957 . . . . 3.05 112.639 -162.702 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.73 -41.81 99.36 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.324 1.45 . . . . 1.94 112.155 173.86 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 53.9 m -64.06 106.29 1.03 Allowed 'General case' 0 C--O 1.236 0.36 0 N-CA-C 108.862 -0.792 . . . . 2.89 108.862 175.059 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -56.54 -37.33 70.35 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-N 115.611 -0.722 . . . . 3.39 110.478 174.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -49.85 -69.72 0.11 Allowed 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 119.394 0.997 . . . . 2.45 112.153 176.129 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 21.6 mt-10 -53.95 -48.18 70.56 Favored 'General case' 0 C--N 1.343 0.285 0 CA-C-N 119.357 0.981 . . . . 4.66 110.611 178.557 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -54.76 -51.82 64.49 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-O 121.658 0.742 . . . . 1.92 109.392 -175.036 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.93 -34.64 73.72 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 124.624 1.17 . . . . 6.2 110.29 -176.268 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 73.4 m -61.07 -48.73 80.34 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 120.14 1.336 . . . . 1.58 110.82 174.039 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 6.3 tp -54.02 -59.26 4.88 Favored 'General case' 0 C--N 1.342 0.271 0 N-CA-C 108.254 -1.017 . . . . 4.19 108.254 172.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 1.7 ttt -47.99 -50.47 27.39 Favored 'General case' 0 CA--C 1.538 0.501 0 O-C-N 123.771 0.669 . . . . 4.72 111.818 -179.014 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -54.92 -51.79 64.98 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 126.141 1.777 . . . . 1.39 111.275 -173.031 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -73.58 -49.08 28.1 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 120.112 -0.635 . . . . 1.37 110.29 177.43 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -48.99 -33.97 12.11 Favored 'General case' 0 C--N 1.339 0.14 0 C-N-CA 123.537 0.735 . . . . 1.66 111.598 -178.781 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 17.3 t0 -79.75 112.13 16.73 Favored 'General case' 0 N--CA 1.439 -0.995 0 C-N-CA 124.41 1.084 . . . . 1.18 112.483 -179.574 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 10.0 m120 -80.41 35.4 0.34 Allowed 'General case' 0 CA--C 1.539 0.534 0 O-C-N 120.958 -1.089 . . . . 3.13 112.312 176.85 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -142.92 -55.04 0.41 Allowed 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 119.727 1.148 . . . . 1.94 111.783 -174.465 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 88.25 40.4 6.52 Favored Glycine 0 CA--C 1.533 1.206 0 N-CA-C 109.283 -1.527 . . . . 1.52 109.283 -152.066 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 20.5 p30 -113.63 -65.03 1.23 Allowed 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 126.087 1.755 . . . . 1.9 109.227 169.254 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 129.45 -32.61 3.18 Favored Glycine 0 CA--C 1.524 0.598 0 C-N-CA 124.751 1.167 . . . . 0.84 111.001 -177.575 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 19.2 pttm -63.03 121.71 14.25 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 107.549 -1.278 . . . . 6.55 107.549 173.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 14.4 mt -123.57 118.56 54.73 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 C-N-CA 124.996 1.318 . . . . 1.82 107.726 -172.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -86.31 174.0 46.69 Favored Glycine 0 CA--C 1.531 1.041 0 N-CA-C 110.9 -0.88 . . . . 0.81 110.9 172.607 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -60.51 -42.22 95.94 Favored 'General case' 0 C--O 1.224 -0.271 0 O-C-N 122.222 -0.575 . . . . 2.07 109.643 175.915 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 -57.08 -57.46 12.48 Favored 'General case' 0 N--CA 1.447 -0.575 0 C-N-CA 123.39 0.676 . . . . 2.5 109.726 177.031 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 -48.36 -51.25 27.24 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 121.669 0.747 . . . . 1.31 110.213 177.017 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 12.5 t80 -61.24 -54.31 45.77 Favored 'General case' 0 CA--C 1.534 0.334 0 O-C-N 121.944 -0.473 . . . . 4.13 111.632 -176.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 23.9 tt0 -58.59 -45.27 89.45 Favored 'General case' 0 C--O 1.225 -0.185 0 C-N-CA 125.487 1.515 . . . . 2.64 110.885 -178.085 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 55.1 mt-10 -49.2 -54.21 17.64 Favored 'General case' 0 C--N 1.34 0.168 0 CA-C-N 119.219 0.918 . . . . 3.16 110.154 175.042 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 2.5 tpp -64.61 -52.84 55.39 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 116.088 -0.506 . . . . 5.41 110.117 -177.649 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 50.1 t -53.62 -37.72 32.07 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.225 0 C-N-CA 123.493 0.717 . . . . 1.6 111.647 -179.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 10.4 t-80 -63.9 -21.35 66.42 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 124.967 1.307 . . . . 4.5 110.487 -178.904 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 18.4 t . . . . . 0 C--O 1.252 1.193 0 N-CA-C 112.564 0.579 . . . . 3.7 112.564 -177.96 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.535 0.366 0 N-CA-C 112.932 0.716 . . . . 3.15 112.932 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -56.04 -40.16 73.08 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-O 122.04 0.924 . . . . 3.08 108.985 178.49 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 41.9 t0 -89.7 42.46 1.09 Allowed 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 128.04 2.536 . . . . 3.34 109.248 -172.793 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 40.3 t -144.94 -63.96 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.341 0.21 0 C-N-CA 125.075 1.35 . . . . 2.8 109.319 -176.926 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 10.8 tp -166.52 -57.16 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.131 0 N-CA-C 107.074 -1.454 . . . . 2.36 107.074 -174.858 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 1.6 m -42.01 -29.27 0.21 Allowed 'General case' 0 N--CA 1.446 -0.638 0 C-N-CA 128.553 2.741 . . . . 1.89 115.465 -165.3 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -45.89 -49.08 15.94 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.925 0.89 . . . . 1.66 112.139 173.798 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -61.52 -45.16 95.38 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 122.419 1.104 . . . . 1.79 109.283 -179.076 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -67.04 -47.28 71.85 Favored 'General case' 0 N--CA 1.445 -0.708 0 C-N-CA 124.608 1.163 . . . . 2.3 109.044 -171.768 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 19.2 pt -63.62 -39.59 85.92 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.801 0 O-C-N 121.774 -0.578 . . . . 2.23 111.175 176.221 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.44 -46.54 83.48 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 118.733 0.697 . . . . 2.04 110.779 173.852 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.59 -53.16 61.5 Favored 'General case' 0 CA--C 1.531 0.232 0 O-C-N 121.752 -0.593 . . . . 1.82 110.642 173.744 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -51.81 -43.92 63.28 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 124.683 1.193 . . . . 1.58 111.172 -178.818 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -54.6 -35.74 63.7 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 124.539 1.136 . . . . 3.83 111.079 176.972 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 4.7 mt-30 -86.43 -43.89 12.45 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 118.238 0.472 . . . . 3.69 111.383 179.326 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.12 -45.5 92.79 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-O 121.689 0.757 . . . . 3.48 109.608 179.94 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 4.2 t -99.01 36.91 1.61 Allowed 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 126.216 1.806 . . . . 2.53 110.035 -175.229 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 57.7 ttp180 -74.14 -45.98 45.39 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 108.895 -0.78 . . . . 6.8 108.895 -178.719 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -81.56 147.88 60.68 Favored Pre-proline 0 N--CA 1.446 -0.665 0 N-CA-C 108.008 -1.108 . . . . 2.28 108.008 -163.111 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -65.1 146.7 87.63 Favored 'Trans proline' 0 N--CA 1.452 -0.951 0 C-N-CA 121.803 1.669 . . . . 1.35 110.923 -168.053 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 53.02 46.08 27.49 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 126.102 1.761 . . . . 2.6 112.203 177.043 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 3.0 m -118.01 6.5 12.14 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.147 1.379 . . . . 1.61 112.79 -179.172 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 2.8 t80 -81.7 83.98 6.95 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 119.86 -1.775 . . . . 3.53 110.358 -172.748 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -69.77 138.31 88.07 Favored Pre-proline 0 CA--C 1.539 0.522 0 N-CA-C 109.051 -0.722 . . . . 2.71 109.051 166.798 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -64.54 -60.97 0.12 Allowed 'Trans proline' 0 N--CA 1.45 -1.042 0 C-N-CA 122.674 2.249 . . . . 0.72 111.21 -179.393 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -59.6 -45.74 91.03 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 122.914 0.486 . . . . 3.25 110.456 -177.425 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -49.36 -60.44 2.82 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 109.769 -0.456 . . . . 5.27 109.769 174.389 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 7.6 t80 -63.25 -41.53 99.08 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-O 120.783 0.325 . . . . 5.37 111.176 -173.068 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -46.0 -54.81 7.75 Favored 'General case' 0 C--O 1.235 0.297 0 C-N-CA 125.243 1.417 . . . . 6.56 110.257 173.388 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -72.2 -49.29 36.57 Favored 'General case' 0 N--CA 1.443 -0.811 0 N-CA-C 108.426 -0.953 . . . . 2.52 108.426 -173.348 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -54.99 -36.23 65.19 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 124.193 0.997 . . . . 1.89 111.164 -179.5 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 22.3 t -85.17 -2.33 57.91 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 123.577 0.751 . . . . 2.39 111.932 -176.143 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 82.79 0.8 90.41 Favored Glycine 0 C--N 1.339 0.736 0 CA-C-N 119.216 0.916 . . . . 0.94 112.253 168.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -59.33 -30.33 68.29 Favored 'General case' 0 CA--C 1.536 0.43 0 O-C-N 121.65 -0.912 . . . . 3.65 109.609 175.13 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 28.9 p -52.58 -42.31 64.39 Favored 'General case' 0 CA--C 1.523 -0.085 0 C-N-CA 124.73 1.212 . . . . 4.14 112.153 168.217 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 9.5 tttt -91.71 -28.45 17.42 Favored 'General case' 0 N--CA 1.444 -0.736 0 N-CA-C 109.52 -0.548 . . . . 6.74 109.52 -168.25 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 8.2 mmt -52.9 -46.5 68.04 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 113.599 0.963 . . . . 3.37 113.599 -175.484 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 19.4 m 93.19 147.79 0.03 OUTLIER 'General case' 0 C--N 1.34 0.164 0 C-N-CA 128.323 2.649 . . . . 2.84 109.675 -176.958 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -41.21 -36.72 0.8 Allowed 'General case' 0 N--CA 1.463 0.189 0 C-N-CA 125.682 1.593 . . . . 2.03 113.233 -174.665 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -67.76 -60.96 2.12 Favored 'General case' 0 N--CA 1.456 -0.136 0 N-CA-C 108.406 -0.961 . . . . 2.06 108.406 -174.594 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 23.3 mm100 -53.45 -49.98 66.25 Favored 'General case' 0 C--O 1.22 -0.49 0 CA-C-N 115.349 -0.841 . . . . 2.71 108.85 175.677 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 74.2 t -54.15 -46.93 67.61 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.503 0 CA-C-N 118.404 0.547 . . . . 1.8 111.222 -178.066 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 10.2 tmtt? -62.71 -43.14 99.58 Favored 'General case' 0 CA--C 1.535 0.402 0 O-C-N 121.034 -1.041 . . . . 5.16 110.801 176.881 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 80.5 m-20 -65.24 -48.13 74.37 Favored 'General case' 0 CA--C 1.537 0.449 0 O-C-N 121.483 -0.761 . . . . 3.78 110.297 -179.012 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 3.4 m -57.01 -43.87 81.76 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.213 0 O-C-N 121.241 -0.912 . . . . 1.71 110.31 174.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 6.9 t80 -47.87 -52.95 17.23 Favored 'General case' 0 C--N 1.344 0.327 0 N-CA-C 109.358 -0.608 . . . . 5.3 109.358 172.652 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 11.8 mtt180 -66.53 -32.72 74.25 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 113.733 1.012 . . . . 6.12 113.733 179.526 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 20.0 m-85 -56.21 -40.0 73.36 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 119.937 1.244 . . . . 5.82 110.715 170.451 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.9 mp -78.65 -44.56 25.77 Favored 'Isoleucine or valine' 0 C--O 1.241 0.607 0 O-C-N 121.82 -0.55 . . . . 3.2 111.923 -178.325 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 20.6 t0 -65.61 79.31 0.07 Allowed 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 125.131 1.372 . . . . 1.76 109.106 178.749 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 13.5 t30 -44.78 -56.86 4.12 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 126.516 1.926 . . . . 2.4 112.433 -173.474 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -60.94 -15.68 34.01 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.984 1.714 . . . . 2.52 113.421 177.188 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 13.9 mt-30 57.04 29.79 17.09 Favored 'General case' 0 C--O 1.235 0.3 0 C-N-CA 125.092 1.357 . . . . 3.18 111.331 -175.374 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.4 p -64.05 -20.77 66.17 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.541 0.737 . . . . 2.08 111.636 178.55 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 86.64 15.66 63.24 Favored Glycine 0 CA--C 1.53 0.979 0 N-CA-C 110.38 -1.088 . . . . 1.73 110.38 -172.459 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 76.6 m-85 -136.99 124.77 22.5 Favored 'General case' 0 CA--C 1.515 -0.375 0 C-N-CA 124.803 1.241 . . . . 4.08 108.612 -175.916 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -73.38 83.63 1.44 Allowed 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 104.064 -2.569 . . . . 3.44 104.064 151.972 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -66.75 164.85 16.22 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 107.206 -1.405 . . . . 3.07 107.206 166.204 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -42.07 -51.49 4.53 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 124.545 1.138 . . . . 5.94 112.347 -176.051 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -68.17 -24.31 64.95 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 113.012 0.745 . . . . 3.33 113.012 -173.226 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -57.67 -40.87 80.35 Favored 'General case' 0 C--N 1.341 0.224 0 CA-C-N 120.314 1.415 . . . . 3.29 110.218 172.152 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.2 mp -65.64 -17.95 64.97 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 120.191 -0.603 . . . . 3.65 111.514 179.858 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 29.5 ttpt -79.1 -14.3 59.21 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 118.956 0.798 . . . . 3.24 111.353 172.844 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 68.5 m-85 -145.17 61.34 1.3 Allowed 'General case' 0 C--O 1.241 0.612 0 C-N-CA 124.267 1.027 . . . . 6.04 109.996 175.054 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 18.4 t80 -91.84 -80.42 0.36 Allowed 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.974 1.31 . . . . 4.0 108.84 -175.3 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 8.2 mp -65.25 -4.79 5.68 Favored 'General case' 0 N--CA 1.465 0.301 0 O-C-N 120.683 -1.26 . . . . 3.03 113.379 170.871 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.13 -23.18 66.41 Favored 'General case' 0 N--CA 1.45 -0.466 0 O-C-N 121.262 -0.898 . . . . 2.83 111.4 171.213 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 6.8 mptt -91.52 -42.73 10.09 Favored 'General case' 0 C--N 1.342 0.277 0 CA-C-N 119.298 0.954 . . . . 4.49 110.886 167.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 45.0 m-85 -55.4 -50.23 70.3 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 118.447 0.567 . . . . 4.99 111.462 -177.377 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 25.2 tp10 -110.97 -66.78 1.05 Allowed 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 124.927 1.291 . . . . 3.47 108.904 -177.087 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 48.6 m 107.63 113.52 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 128.377 2.671 . . . . 4.03 109.026 -165.564 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 74.25 44.74 27.52 Favored Glycine 0 CA--C 1.527 0.842 0 N-CA-C 111.384 -0.686 . . . . 2.52 111.384 176.618 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -85.47 -118.59 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.537 0.735 . . . . 2.04 110.13 177.166 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.24 -7.08 12.41 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.242 1.017 . . . . 4.52 113.006 -169.239 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -54.38 -32.86 57.97 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 126.252 1.821 . . . . 2.93 112.871 -158.893 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -57.63 -41.72 81.94 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 124.26 1.024 . . . . 2.23 111.596 176.136 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 49.5 m -67.55 104.6 1.62 Allowed 'General case' 0 C--O 1.235 0.295 0 CA-C-N 118.957 0.799 . . . . 1.98 110.04 -178.846 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 13.9 mp0 -61.8 -36.5 81.29 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 115.66 -0.7 . . . . 3.41 110.508 -177.461 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 22.1 t -54.72 -55.68 27.32 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 118.828 0.74 . . . . 1.95 110.687 177.86 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -63.45 -47.89 79.97 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 123.991 0.917 . . . . 3.15 109.124 -178.193 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -52.96 -45.66 67.84 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 115.897 -0.592 . . . . 1.96 110.432 176.534 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 5.1 mmpt? -68.69 -37.74 79.79 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 124.249 1.02 . . . . 5.92 110.883 -178.971 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 22.7 t -51.89 -51.43 56.87 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 119.343 0.974 . . . . 2.3 109.129 171.373 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -62.85 -54.27 41.38 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 118.98 -0.533 . . . . 3.4 110.207 179.19 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 51.4 ttm -46.68 -50.95 17.03 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 118.254 0.479 . . . . 4.14 111.408 176.11 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -54.91 -46.66 74.9 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 125.735 1.614 . . . . 1.64 111.624 -171.009 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -82.16 -38.26 24.95 Favored 'General case' 0 CA--C 1.529 0.14 0 N-CA-C 111.779 0.289 . . . . 2.07 111.779 -179.79 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -63.98 -44.06 93.83 Favored 'General case' 0 N--CA 1.457 -0.115 0 N-CA-C 111.646 0.239 . . . . 1.61 111.646 -179.085 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -65.4 119.27 10.68 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 108.875 -0.787 . . . . 1.04 108.875 178.934 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -103.2 12.01 36.21 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 122.501 0.32 . . . . 3.72 111.508 -174.473 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 34.2 m-20 -103.45 -43.74 5.32 Favored 'General case' 0 C--N 1.34 0.159 0 C-N-CA 124.035 0.934 . . . . 1.59 109.803 179.811 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 90.33 40.17 5.82 Favored Glycine 0 CA--C 1.529 0.968 0 N-CA-C 108.95 -1.66 . . . . 0.96 108.95 -156.354 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -118.45 -59.7 1.85 Allowed 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 117.811 0.805 . . . . 2.46 110.322 177.688 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 131.11 -43.2 1.31 Allowed Glycine 0 CA--C 1.528 0.861 0 C-N-CA 123.827 0.727 . . . . 0.57 111.432 179.559 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 18.5 mtpt -69.36 123.91 22.47 Favored 'General case' 0 N--CA 1.451 -0.405 0 N-CA-C 108.771 -0.826 . . . . 6.64 108.771 176.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 9.7 mt -108.5 110.37 31.76 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.204 0 N-CA-C 109.854 -0.424 . . . . 1.87 109.854 -168.412 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -63.62 157.51 41.43 Favored Glycine 0 CA--C 1.532 1.113 0 N-CA-C 111.106 -0.798 . . . . 0.84 111.106 170.655 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -55.24 -37.75 67.59 Favored 'General case' 0 C--N 1.339 0.137 0 O-C-N 121.936 -0.744 . . . . 1.74 109.745 169.798 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -55.48 -60.88 2.81 Favored 'General case' 0 N--CA 1.448 -0.53 0 C-N-CA 124.308 1.043 . . . . 2.85 109.672 176.582 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -47.87 -49.21 30.24 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.203 1.001 . . . . 1.3 111.279 176.225 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -61.34 -51.79 67.34 Favored 'General case' 0 N--CA 1.457 -0.117 0 CA-C-O 121.401 0.62 . . . . 4.48 110.99 -178.033 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 10.7 tm0? -58.61 -36.5 74.13 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-O 117.74 -1.124 . . . . 3.66 110.438 178.573 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -60.11 -61.46 2.59 Favored 'General case' 0 N--CA 1.457 -0.099 0 CA-C-N 120.012 1.278 . . . . 3.37 110.761 170.44 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 3.7 ttp -54.31 -38.73 66.28 Favored 'General case' 0 C--N 1.34 0.161 0 CA-C-O 120.881 0.372 . . . . 6.31 110.508 -173.569 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 54.6 t -70.56 -76.02 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.446 -0.673 0 C-N-CA 123.388 0.675 . . . . 1.75 110.085 174.363 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 52.8 t-80 -50.82 -44.32 59.13 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 123.668 0.787 . . . . 4.25 111.211 -167.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.251 1.151 0 O-C-N 124.622 1.202 . . . . 5.64 109.557 -174.425 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 51.4 mtt . . . . . 0 N--CA 1.476 0.831 0 N-CA-C 110.418 -0.215 . . . . 7.96 110.418 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.0 m -161.95 -66.92 0.05 Allowed 'General case' 0 C--O 1.225 -0.195 0 N-CA-C 108.616 -0.883 . . . . 3.22 108.616 176.356 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.6 pp -91.65 -30.06 4.72 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.206 0 C-N-CA 123.77 0.828 . . . . 2.02 110.567 -169.416 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 12.5 t -66.0 -9.85 34.12 Favored 'General case' 0 N--CA 1.426 -1.667 0 C-N-CA 127.673 2.389 . . . . 2.42 112.078 -174.386 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 26.4 t0 -138.59 28.46 2.44 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.14 0.976 . . . . 2.81 109.822 178.206 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 1.1 p -100.55 -46.74 11.77 Favored 'Isoleucine or valine' 0 C--N 1.344 0.327 0 O-C-N 121.682 -0.636 . . . . 3.05 109.907 173.554 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 173.24 -58.8 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 106.956 -1.498 . . . . 2.26 106.956 -165.742 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -43.48 -31.62 0.74 Allowed 'General case' 0 C--O 1.218 -0.556 0 C-N-CA 126.291 1.836 . . . . 2.78 114.478 -169.386 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -45.5 -47.9 14.08 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 119.235 0.925 . . . . 1.72 112.874 173.775 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -67.21 -42.31 84.31 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-O 122.239 1.019 . . . . 1.78 109.789 -179.86 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -64.86 -43.52 92.72 Favored 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 123.734 0.814 . . . . 2.41 109.425 -175.059 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 26.6 pt -67.1 -39.38 83.1 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.858 0 O-C-N 121.426 -0.796 . . . . 1.65 111.02 176.522 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.63 -40.56 72.31 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 118.649 0.659 . . . . 1.5 110.787 171.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.85 -57.09 10.91 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 121.914 -0.491 . . . . 1.74 111.057 171.557 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -46.81 -47.59 21.0 Favored 'General case' 0 N--CA 1.462 0.158 0 C-N-CA 125.895 1.678 . . . . 1.6 111.138 -177.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 16.0 tp -48.45 -48.54 37.42 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 125.941 1.696 . . . . 3.61 109.595 178.243 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 -82.94 -43.3 16.63 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 110.517 -0.179 . . . . 3.93 110.517 -174.297 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -66.87 -38.85 87.12 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 110.527 -0.175 . . . . 2.29 110.527 -173.561 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 56.6 m -106.92 62.55 0.63 Allowed 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 124.537 1.135 . . . . 2.0 108.084 166.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -74.95 -41.93 58.66 Favored 'General case' 0 N--CA 1.464 0.265 0 O-C-N 121.799 -0.563 . . . . 6.54 109.514 170.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -78.81 148.39 72.4 Favored Pre-proline 0 N--CA 1.45 -0.459 0 C-N-CA 123.741 0.816 . . . . 1.98 111.126 -160.238 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -66.3 130.11 23.18 Favored 'Trans proline' 0 N--CA 1.449 -1.114 0 C-N-CA 123.006 2.471 . . . . 1.3 110.915 -175.146 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 74.4 37.62 0.56 Allowed 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 127.689 2.396 . . . . 2.97 110.343 173.317 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 16.1 m -115.71 -6.56 12.14 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.214 1.006 . . . . 1.78 112.759 -173.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -80.62 83.42 6.4 Favored 'General case' 0 CA--C 1.535 0.393 0 O-C-N 120.694 -1.254 . . . . 3.24 111.248 -160.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -68.17 143.54 96.02 Favored Pre-proline 0 CA--C 1.534 0.332 0 O-C-N 121.596 -0.69 . . . . 2.57 110.183 178.143 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -71.6 -62.52 0.04 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.24 0 C-N-CA 122.562 2.175 . . . . 0.78 111.883 -175.095 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 37.1 mt-30 -55.07 -46.05 75.38 Favored 'General case' 0 C--O 1.233 0.193 0 C-N-CA 123.254 0.621 . . . . 2.4 109.801 179.336 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 42.8 tptt -49.96 -56.64 9.82 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 116.009 -0.541 . . . . 4.13 109.786 173.218 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 54.9 t80 -56.26 -50.97 69.84 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 111.534 0.198 . . . . 3.52 111.534 179.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 31.0 m-85 -56.67 -34.6 67.53 Favored 'General case' 0 CA--C 1.532 0.272 0 O-C-N 121.319 -0.863 . . . . 6.48 112.008 -178.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 5.5 mm-40 -71.93 -58.6 3.32 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 108.568 -0.901 . . . . 4.0 108.568 174.567 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -63.99 -25.28 68.06 Favored 'General case' 0 N--CA 1.439 -1.005 0 C-N-CA 123.945 0.898 . . . . 1.55 111.839 -169.401 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 18.5 t -85.02 -7.83 58.97 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 126.02 1.728 . . . . 2.4 111.44 179.318 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 86.24 -11.78 62.21 Favored Glycine 0 C--N 1.338 0.674 0 N-CA-C 111.376 -0.69 . . . . 0.9 111.376 174.512 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 93.5 mt -54.78 -42.83 72.23 Favored 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 125.516 1.526 . . . . 2.32 111.029 -179.654 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 5.3 t -72.02 -13.5 61.62 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.102 0.561 . . . . 2.5 111.977 177.159 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -89.45 -35.94 15.71 Favored 'General case' 0 N--CA 1.452 -0.345 0 O-C-N 121.337 -0.852 . . . . 4.13 109.863 174.469 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 59.9 mtt -57.13 152.39 13.57 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 121.603 0.716 . . . . 3.84 111.361 174.295 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 23.8 t -78.69 154.76 29.86 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 116.213 -0.449 . . . . 2.41 109.905 174.579 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -41.0 -44.57 2.4 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 125.602 1.561 . . . . 1.58 112.129 176.018 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 68.3 m-80 -54.33 -58.22 8.24 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.304 0.642 . . . . 1.91 110.339 178.85 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 3.6 mm-40 -59.82 -44.61 93.93 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 123.077 0.551 . . . . 2.67 109.849 -179.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.416 ' CG1' ' CZ ' ' A' ' 48' ' ' PHE . 53.1 t -57.91 -43.95 85.59 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 CA-C-O 121.293 0.568 . . . . 1.66 109.523 -179.264 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 21.6 tttt -63.27 -48.92 76.14 Favored 'General case' 0 N--CA 1.452 -0.37 0 O-C-N 121.289 -0.882 . . . . 3.87 110.922 176.288 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -51.54 -54.09 31.02 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 118.18 0.446 . . . . 3.07 110.671 176.363 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . 0.27 17.4 m -54.7 -44.34 70.04 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.206 0 CA-C-O 118.826 -0.607 . . . . 1.77 110.984 178.802 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.496 ' CZ ' ' HB3' ' A' ' 103' ' ' PHE . 15.1 m-30 -54.21 -40.39 67.6 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 119.153 0.888 . . . . 7.47 112.783 174.343 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 69.7 mtp85 -57.25 -42.02 80.72 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 118.613 0.642 . . . . 3.77 109.947 174.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 -68.64 -33.24 73.67 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 118.67 -0.681 . . . . 7.01 110.949 176.77 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 14.0 mm -63.65 -59.81 3.72 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 CA-C-O 118.433 -0.794 . . . . 2.41 110.89 175.718 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 55.6 t0 -74.13 71.18 1.63 Allowed 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 119.194 0.906 . . . . 1.87 110.554 -175.791 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 27.7 t30 -46.32 -47.24 18.49 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 125.888 1.675 . . . . 1.92 111.0 176.617 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -64.39 -19.26 65.38 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 126.639 1.976 . . . . 3.96 112.12 -177.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 59.64 12.64 2.97 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 127.08 2.152 . . . . 4.71 113.58 178.677 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 3.9 p -70.12 -10.32 58.39 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 113.83 1.048 . . . . 2.54 113.83 -170.138 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 85.71 34.89 12.4 Favored Glycine 0 CA--C 1.529 0.937 0 CA-C-N 118.933 0.788 . . . . 2.43 111.968 172.067 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -171.05 143.71 2.01 Favored 'General case' 0 CA--C 1.519 -0.233 0 C-N-CA 127.289 2.235 . . . . 4.01 105.001 175.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -102.93 68.54 1.0 Allowed 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 107.309 -1.367 . . . . 3.18 107.309 176.272 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -56.81 146.45 26.16 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.744 1.618 . . . . 1.67 110.761 179.362 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -44.89 -51.26 9.84 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 123.512 0.725 . . . . 3.54 112.953 -175.395 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -69.67 -19.62 63.59 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 121.968 -0.457 . . . . 3.28 111.917 -173.39 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 91.4 mt-10 -77.64 -44.57 27.77 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-O 121.293 0.568 . . . . 3.08 109.598 167.413 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 6.4 tp -53.23 -28.24 26.2 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.644 0.777 . . . . 3.89 110.978 174.191 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 30.2 ttpt -50.67 -16.71 0.42 Allowed 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 113.904 1.076 . . . . 3.26 113.904 169.326 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 27.5 p90 -127.48 33.93 4.76 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 120.097 1.317 . . . . 6.57 112.634 170.138 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 46.4 t80 -57.76 -67.36 0.34 Allowed 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.649 0.78 . . . . 3.75 110.794 178.431 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 2.9 tp -85.38 -9.27 57.79 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.473 -0.767 . . . . 3.52 112.066 -175.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 49.5 mm-40 -56.0 -18.72 10.11 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.098 0.959 . . . . 1.98 111.399 171.405 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -83.04 -16.39 47.22 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 121.196 -0.94 . . . . 4.33 111.476 177.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 6.3 m-30 -101.16 -53.87 2.92 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 124.674 1.189 . . . . 4.57 108.916 -179.1 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -112.83 161.2 17.21 Favored 'General case' 0 C--O 1.222 -0.371 0 N-CA-C 106.606 -1.627 . . . . 3.35 106.606 175.8 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 24.1 m -85.66 -34.62 21.27 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 118.896 0.771 . . . . 2.64 110.524 172.629 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -114.48 42.61 1.88 Allowed Glycine 0 CA--C 1.519 0.324 0 N-CA-C 109.568 -1.413 . . . . 1.79 109.568 -170.444 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.08 -171.57 0.92 Allowed 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 120.953 0.406 . . . . 2.08 111.01 177.552 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.7 -13.59 39.31 Favored 'General case' 0 N--CA 1.453 -0.287 0 O-C-N 121.696 -0.628 . . . . 4.2 112.545 -166.112 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -46.47 -40.59 12.64 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 126.842 2.057 . . . . 3.11 112.802 -163.445 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -49.04 -43.1 40.37 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.607 1.163 . . . . 1.64 112.144 175.584 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 91.8 m -69.26 104.77 2.31 Favored 'General case' 0 C--O 1.235 0.304 0 O-C-N 121.523 -0.736 . . . . 1.6 109.98 175.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -54.77 -41.98 71.14 Favored 'General case' 0 C--O 1.219 -0.542 0 CA-C-N 115.609 -0.723 . . . . 3.2 111.671 178.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 34.7 t -54.28 -53.91 47.37 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-O 121.463 0.649 . . . . 1.94 111.081 -178.463 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -63.36 -47.67 81.12 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 124.074 0.949 . . . . 2.89 108.577 -178.765 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -52.22 -44.91 65.03 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 116.177 -0.465 . . . . 1.67 111.229 174.232 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -76.42 -27.3 56.2 Favored 'General case' 0 C--O 1.221 -0.422 0 C-N-CA 124.219 1.007 . . . . 5.82 110.718 -175.793 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 24.6 m -61.6 -45.96 91.87 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 119.089 0.859 . . . . 2.41 109.798 168.667 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -59.3 -57.91 10.96 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 110.039 -0.356 . . . . 3.61 110.039 172.194 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 22.2 ttp -47.16 -52.64 15.05 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.22 0.608 . . . . 3.9 111.366 178.214 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -49.65 -51.37 38.41 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 126.117 1.767 . . . . 1.37 111.537 -172.028 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -78.02 -41.73 34.81 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-O 119.853 -0.118 . . . . 1.33 111.294 179.835 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -54.81 -41.36 70.54 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-O 120.682 0.277 . . . . 1.62 111.036 179.263 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -77.76 80.96 4.21 Favored 'General case' 0 N--CA 1.445 -0.688 0 C-N-CA 123.245 0.618 . . . . 0.93 111.083 -176.574 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 52.8 p-10 -76.26 41.31 0.23 Allowed 'General case' 0 CA--C 1.541 0.633 0 O-C-N 121.405 -0.809 . . . . 2.97 112.16 176.374 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 29.2 m-20 -126.11 -58.98 1.35 Allowed 'General case' 0 C--N 1.342 0.251 0 C-N-CA 126.193 1.797 . . . . 1.25 108.299 172.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 93.94 44.33 3.62 Favored Glycine 0 CA--C 1.53 0.971 0 N-CA-C 109.147 -1.581 . . . . 0.82 109.147 -157.304 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 41.0 p-10 -124.87 -47.43 1.8 Allowed 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 124.621 1.168 . . . . 2.05 110.318 172.395 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 115.7 -31.24 6.22 Favored Glycine 0 CA--C 1.524 0.638 0 C-N-CA 124.618 1.104 . . . . 0.64 111.227 170.655 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 21.5 pttp -69.34 114.22 7.39 Favored 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 107.692 -1.225 . . . . 5.93 107.692 168.715 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 19.7 mt -103.83 115.57 46.02 Favored 'Isoleucine or valine' 0 C--O 1.231 0.13 0 C-N-CA 123.551 0.74 . . . . 1.72 109.36 -171.842 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -72.28 162.15 54.48 Favored Glycine 0 CA--C 1.534 1.267 0 CA-C-O 121.831 0.684 . . . . 0.84 112.143 172.463 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -57.11 -40.09 76.38 Favored 'General case' 0 C--O 1.226 -0.184 0 O-C-N 121.78 -0.835 . . . . 1.64 109.673 172.106 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -56.19 -54.18 48.23 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.978 0.911 . . . . 2.57 110.274 177.262 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -51.66 -50.53 60.19 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.079 0.952 . . . . 1.27 110.422 176.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . 0.496 ' HB3' ' CZ ' ' A' ' 48' ' ' PHE . 3.4 m-85 -61.12 -44.22 97.68 Favored 'General case' 0 CA--C 1.534 0.364 0 O-C-N 121.87 -0.519 . . . . 5.11 111.709 177.847 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 30.9 tt0 -57.42 -49.83 74.95 Favored 'General case' 0 C--O 1.222 -0.384 0 N-CA-C 108.796 -0.816 . . . . 2.6 108.796 178.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -47.01 -60.39 2.48 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 123.521 0.729 . . . . 3.24 110.548 172.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.22 -43.42 98.87 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 120.378 -0.529 . . . . 3.52 110.976 -172.257 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 66.2 t -64.23 -38.93 83.78 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.428 0 CA-C-O 119.306 -0.378 . . . . 2.0 111.227 176.596 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 79.5 t60 -66.42 -22.48 66.23 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 124.376 1.07 . . . . 3.73 110.055 -173.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 22.7 t . . . . . 0 C--O 1.253 1.273 0 CA-C-O 115.343 -2.265 . . . . 2.58 112.986 176.886 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 51.4 mtt . . . . . 0 N--CA 1.476 0.831 0 N-CA-C 110.418 -0.215 . . . . 7.96 110.418 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.0 m -161.95 -66.92 0.05 Allowed 'General case' 0 C--O 1.225 -0.195 0 N-CA-C 108.616 -0.883 . . . . 3.22 108.616 176.356 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.6 pp -91.65 -30.06 4.72 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.206 0 C-N-CA 123.77 0.828 . . . . 2.02 110.567 -169.416 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 12.5 t -66.0 -9.85 34.12 Favored 'General case' 0 N--CA 1.426 -1.667 0 C-N-CA 127.673 2.389 . . . . 2.42 112.078 -174.386 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 26.4 t0 -138.59 28.46 2.44 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.14 0.976 . . . . 2.81 109.822 178.206 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 1.1 p -100.55 -46.74 11.77 Favored 'Isoleucine or valine' 0 C--N 1.344 0.327 0 O-C-N 121.682 -0.636 . . . . 3.05 109.907 173.554 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 173.24 -58.8 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 106.956 -1.498 . . . . 2.26 106.956 -165.742 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -43.48 -31.62 0.74 Allowed 'General case' 0 C--O 1.218 -0.556 0 C-N-CA 126.291 1.836 . . . . 2.78 114.478 -169.386 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -45.5 -47.9 14.08 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 119.235 0.925 . . . . 1.72 112.874 173.775 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -67.21 -42.31 84.31 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-O 122.239 1.019 . . . . 1.78 109.789 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -64.86 -43.52 92.72 Favored 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 123.734 0.814 . . . . 2.41 109.425 -175.059 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 26.6 pt -67.1 -39.38 83.1 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.858 0 O-C-N 121.426 -0.796 . . . . 1.65 111.02 176.522 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.63 -40.56 72.31 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 118.649 0.659 . . . . 1.5 110.787 171.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.85 -57.09 10.91 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 121.914 -0.491 . . . . 1.74 111.057 171.557 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -46.81 -47.59 21.0 Favored 'General case' 0 N--CA 1.462 0.158 0 C-N-CA 125.895 1.678 . . . . 1.6 111.138 -177.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 16.0 tp -48.45 -48.54 37.42 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 125.941 1.696 . . . . 3.61 109.595 178.243 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 -82.94 -43.3 16.63 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 110.517 -0.179 . . . . 3.93 110.517 -174.297 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -66.87 -38.85 87.12 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 110.527 -0.175 . . . . 2.29 110.527 -173.561 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 56.6 m -106.92 62.55 0.63 Allowed 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 124.537 1.135 . . . . 2.0 108.084 166.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -74.95 -41.93 58.66 Favored 'General case' 0 N--CA 1.464 0.265 0 O-C-N 121.799 -0.563 . . . . 6.54 109.514 170.972 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -78.81 148.39 72.4 Favored Pre-proline 0 N--CA 1.45 -0.459 0 C-N-CA 123.741 0.816 . . . . 1.98 111.126 -160.238 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -66.3 130.11 23.18 Favored 'Trans proline' 0 N--CA 1.449 -1.114 0 C-N-CA 123.006 2.471 . . . . 1.3 110.915 -175.146 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 74.4 37.62 0.56 Allowed 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 127.689 2.396 . . . . 2.97 110.343 173.317 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 16.1 m -115.71 -6.56 12.14 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.214 1.006 . . . . 1.78 112.759 -173.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -80.62 83.42 6.4 Favored 'General case' 0 CA--C 1.535 0.393 0 O-C-N 120.694 -1.254 . . . . 3.24 111.248 -160.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -68.17 143.54 96.02 Favored Pre-proline 0 CA--C 1.534 0.332 0 O-C-N 121.596 -0.69 . . . . 2.57 110.183 178.143 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -71.6 -62.52 0.04 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.24 0 C-N-CA 122.562 2.175 . . . . 0.78 111.883 -175.095 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 37.1 mt-30 -55.07 -46.05 75.38 Favored 'General case' 0 C--O 1.233 0.193 0 C-N-CA 123.254 0.621 . . . . 2.4 109.801 179.336 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 42.8 tptt -49.96 -56.64 9.82 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 116.009 -0.541 . . . . 4.13 109.786 173.218 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 54.9 t80 -56.26 -50.97 69.84 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 111.534 0.198 . . . . 3.52 111.534 179.841 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 31.0 m-85 -56.67 -34.6 67.53 Favored 'General case' 0 CA--C 1.532 0.272 0 O-C-N 121.319 -0.863 . . . . 6.48 112.008 -178.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 5.5 mm-40 -71.93 -58.6 3.32 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 108.568 -0.901 . . . . 4.0 108.568 174.567 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -63.99 -25.28 68.06 Favored 'General case' 0 N--CA 1.439 -1.005 0 C-N-CA 123.945 0.898 . . . . 1.55 111.839 -169.401 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 18.5 t -85.02 -7.83 58.97 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 126.02 1.728 . . . . 2.4 111.44 179.318 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 86.24 -11.78 62.21 Favored Glycine 0 C--N 1.338 0.674 0 N-CA-C 111.376 -0.69 . . . . 0.9 111.376 174.512 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 93.5 mt -54.78 -42.83 72.23 Favored 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 125.516 1.526 . . . . 2.32 111.029 -179.654 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 5.3 t -72.02 -13.5 61.62 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.102 0.561 . . . . 2.5 111.977 177.159 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -89.45 -35.94 15.71 Favored 'General case' 0 N--CA 1.452 -0.345 0 O-C-N 121.337 -0.852 . . . . 4.13 109.863 174.469 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 59.9 mtt -57.13 152.39 13.57 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 121.603 0.716 . . . . 3.84 111.361 174.295 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 23.8 t -78.69 154.76 29.86 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 116.213 -0.449 . . . . 2.41 109.905 174.579 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -41.0 -44.57 2.4 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 125.602 1.561 . . . . 1.58 112.129 176.018 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 68.3 m-80 -54.33 -58.22 8.24 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.304 0.642 . . . . 1.91 110.339 178.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 3.6 mm-40 -59.82 -44.61 93.93 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 123.077 0.551 . . . . 2.67 109.849 -179.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.416 ' CG1' ' CZ ' ' A' ' 48' ' ' PHE . 53.1 t -57.91 -43.95 85.59 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 CA-C-O 121.293 0.568 . . . . 1.66 109.523 -179.264 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 21.6 tttt -63.27 -48.92 76.14 Favored 'General case' 0 N--CA 1.452 -0.37 0 O-C-N 121.289 -0.882 . . . . 3.87 110.922 176.288 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -51.54 -54.09 31.02 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 118.18 0.446 . . . . 3.07 110.671 176.363 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . 0.27 17.4 m -54.7 -44.34 70.04 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.206 0 CA-C-O 118.826 -0.607 . . . . 1.77 110.984 178.802 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.496 ' CZ ' ' HB3' ' A' ' 103' ' ' PHE . 15.1 m-30 -54.21 -40.39 67.6 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 119.153 0.888 . . . . 7.47 112.783 174.343 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 69.7 mtp85 -57.25 -42.02 80.72 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 118.613 0.642 . . . . 3.77 109.947 174.906 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 -68.64 -33.24 73.67 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 118.67 -0.681 . . . . 7.01 110.949 176.77 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 14.0 mm -63.65 -59.81 3.72 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 CA-C-O 118.433 -0.794 . . . . 2.41 110.89 175.718 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 55.6 t0 -74.13 71.18 1.63 Allowed 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 119.194 0.906 . . . . 1.87 110.554 -175.791 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 27.7 t30 -46.32 -47.24 18.49 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 125.888 1.675 . . . . 1.92 111.0 176.617 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -64.39 -19.26 65.38 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 126.639 1.976 . . . . 3.96 112.12 -177.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 59.64 12.64 2.97 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 127.08 2.152 . . . . 4.71 113.58 178.677 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 3.9 p -70.12 -10.32 58.39 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 113.83 1.048 . . . . 2.54 113.83 -170.138 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 85.71 34.89 12.4 Favored Glycine 0 CA--C 1.529 0.937 0 CA-C-N 118.933 0.788 . . . . 2.43 111.968 172.067 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -171.05 143.71 2.01 Favored 'General case' 0 CA--C 1.519 -0.233 0 C-N-CA 127.289 2.235 . . . . 4.01 105.001 175.625 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -102.93 68.54 1.0 Allowed 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 107.309 -1.367 . . . . 3.18 107.309 176.272 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -56.81 146.45 26.16 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.744 1.618 . . . . 1.67 110.761 179.362 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -44.89 -51.26 9.84 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 123.512 0.725 . . . . 3.54 112.953 -175.395 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -69.67 -19.62 63.59 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 121.968 -0.457 . . . . 3.28 111.917 -173.39 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 91.4 mt-10 -77.64 -44.57 27.77 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-O 121.293 0.568 . . . . 3.08 109.598 167.413 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 6.4 tp -53.23 -28.24 26.2 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.644 0.777 . . . . 3.89 110.978 174.191 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 30.2 ttpt -50.67 -16.71 0.42 Allowed 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 113.904 1.076 . . . . 3.26 113.904 169.326 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 27.5 p90 -127.48 33.93 4.76 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 120.097 1.317 . . . . 6.57 112.634 170.138 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 46.4 t80 -57.76 -67.36 0.34 Allowed 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.649 0.78 . . . . 3.75 110.794 178.431 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 2.9 tp -85.38 -9.27 57.79 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.473 -0.767 . . . . 3.52 112.066 -175.79 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 49.5 mm-40 -56.0 -18.72 10.11 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.098 0.959 . . . . 1.98 111.399 171.405 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -83.04 -16.39 47.22 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 121.196 -0.94 . . . . 4.33 111.476 177.969 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 6.3 m-30 -101.16 -53.87 2.92 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 124.674 1.189 . . . . 4.57 108.916 -179.1 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -112.83 161.2 17.21 Favored 'General case' 0 C--O 1.222 -0.371 0 N-CA-C 106.606 -1.627 . . . . 3.35 106.606 175.8 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 24.1 m -85.66 -34.62 21.27 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 118.896 0.771 . . . . 2.64 110.524 172.629 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -114.48 42.61 1.88 Allowed Glycine 0 CA--C 1.519 0.324 0 N-CA-C 109.568 -1.413 . . . . 1.79 109.568 -170.444 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.08 -171.57 0.92 Allowed 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 120.953 0.406 . . . . 2.08 111.01 177.552 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.7 -13.59 39.31 Favored 'General case' 0 N--CA 1.453 -0.287 0 O-C-N 121.696 -0.628 . . . . 4.2 112.545 -166.112 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -46.47 -40.59 12.64 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 126.842 2.057 . . . . 3.11 112.802 -163.445 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -49.04 -43.1 40.37 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.607 1.163 . . . . 1.64 112.144 175.584 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 91.8 m -69.26 104.77 2.31 Favored 'General case' 0 C--O 1.235 0.304 0 O-C-N 121.523 -0.736 . . . . 1.6 109.98 175.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -54.77 -41.98 71.14 Favored 'General case' 0 C--O 1.219 -0.542 0 CA-C-N 115.609 -0.723 . . . . 3.2 111.671 178.807 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 34.7 t -54.28 -53.91 47.37 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-O 121.463 0.649 . . . . 1.94 111.081 -178.463 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -63.36 -47.67 81.12 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 124.074 0.949 . . . . 2.89 108.577 -178.765 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -52.22 -44.91 65.03 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 116.177 -0.465 . . . . 1.67 111.229 174.232 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -76.42 -27.3 56.2 Favored 'General case' 0 C--O 1.221 -0.422 0 C-N-CA 124.219 1.007 . . . . 5.82 110.718 -175.793 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 24.6 m -61.6 -45.96 91.87 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 119.089 0.859 . . . . 2.41 109.798 168.667 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -59.3 -57.91 10.96 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 110.039 -0.356 . . . . 3.61 110.039 172.194 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 22.2 ttp -47.16 -52.64 15.05 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.22 0.608 . . . . 3.9 111.366 178.214 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -49.65 -51.37 38.41 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 126.117 1.767 . . . . 1.37 111.537 -172.028 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -78.02 -41.73 34.81 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-O 119.853 -0.118 . . . . 1.33 111.294 179.835 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -54.81 -41.36 70.54 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-O 120.682 0.277 . . . . 1.62 111.036 179.263 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -77.76 80.96 4.21 Favored 'General case' 0 N--CA 1.445 -0.688 0 C-N-CA 123.245 0.618 . . . . 0.93 111.083 -176.574 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 52.8 p-10 -76.26 41.31 0.23 Allowed 'General case' 0 CA--C 1.541 0.633 0 O-C-N 121.405 -0.809 . . . . 2.97 112.16 176.374 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 29.2 m-20 -126.11 -58.98 1.35 Allowed 'General case' 0 C--N 1.342 0.251 0 C-N-CA 126.193 1.797 . . . . 1.25 108.299 172.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 93.94 44.33 3.62 Favored Glycine 0 CA--C 1.53 0.971 0 N-CA-C 109.147 -1.581 . . . . 0.82 109.147 -157.304 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 41.0 p-10 -124.87 -47.43 1.8 Allowed 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 124.621 1.168 . . . . 2.05 110.318 172.395 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 115.7 -31.24 6.22 Favored Glycine 0 CA--C 1.524 0.638 0 C-N-CA 124.618 1.104 . . . . 0.64 111.227 170.655 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 21.5 pttp -69.34 114.22 7.39 Favored 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 107.692 -1.225 . . . . 5.93 107.692 168.715 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 19.7 mt -103.83 115.57 46.02 Favored 'Isoleucine or valine' 0 C--O 1.231 0.13 0 C-N-CA 123.551 0.74 . . . . 1.72 109.36 -171.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -72.28 162.15 54.48 Favored Glycine 0 CA--C 1.534 1.267 0 CA-C-O 121.831 0.684 . . . . 0.84 112.143 172.463 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -57.11 -40.09 76.38 Favored 'General case' 0 C--O 1.226 -0.184 0 O-C-N 121.78 -0.835 . . . . 1.64 109.673 172.106 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -56.19 -54.18 48.23 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.978 0.911 . . . . 2.57 110.274 177.262 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -51.66 -50.53 60.19 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.079 0.952 . . . . 1.27 110.422 176.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . 0.496 ' HB3' ' CZ ' ' A' ' 48' ' ' PHE . 3.4 m-85 -61.12 -44.22 97.68 Favored 'General case' 0 CA--C 1.534 0.364 0 O-C-N 121.87 -0.519 . . . . 5.11 111.709 177.847 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 30.9 tt0 -57.42 -49.83 74.95 Favored 'General case' 0 C--O 1.222 -0.384 0 N-CA-C 108.796 -0.816 . . . . 2.6 108.796 178.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -47.01 -60.39 2.48 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 123.521 0.729 . . . . 3.24 110.548 172.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.22 -43.42 98.87 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 120.378 -0.529 . . . . 3.52 110.976 -172.257 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 66.2 t -64.23 -38.93 83.78 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.428 0 CA-C-O 119.306 -0.378 . . . . 2.0 111.227 176.596 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 79.5 t60 -66.42 -22.48 66.23 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 124.376 1.07 . . . . 3.73 110.055 -173.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 22.7 t . . . . . 0 C--O 1.253 1.273 0 CA-C-O 115.343 -2.265 . . . . 2.58 112.986 176.886 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 17.1 mmt . . . . . 0 N--CA 1.47 0.565 0 N-CA-C 108.514 -0.921 . . . . 9.63 108.514 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 75.7 m -161.38 170.49 19.98 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 104.771 -2.307 . . . . 3.39 104.771 176.562 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.3 pp -47.27 -37.79 4.71 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.679 0 C-N-CA 123.806 0.842 . . . . 2.34 112.662 -173.062 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 14.8 t -68.89 -7.06 31.22 Favored 'General case' 0 N--CA 1.429 -1.491 0 C-N-CA 127.866 2.466 . . . . 2.84 112.812 -177.241 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 47.1 t0 -153.11 44.34 0.64 Allowed 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.438 1.495 . . . . 2.54 108.891 -177.766 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 13.2 t -128.29 -59.14 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.339 0.133 0 C-N-CA 126.171 1.788 . . . . 2.45 108.936 174.49 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -172.54 -47.55 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.14 0 N-CA-C 106.986 -1.487 . . . . 2.72 106.986 -175.194 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 2.4 m -48.15 -32.66 7.24 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 114.46 1.282 . . . . 1.63 114.46 -175.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -51.19 -40.72 59.3 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 119.363 0.983 . . . . 1.95 113.218 174.818 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -76.04 -37.15 58.67 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 121.54 0.686 . . . . 2.17 109.791 177.854 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 23.2 m-20 -57.47 -52.31 65.9 Favored 'General case' 0 C--O 1.234 0.278 0 C-N-CA 124.083 0.953 . . . . 2.59 108.569 -179.43 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 28.3 pt -61.8 -39.3 82.9 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.278 0 CA-C-N 115.352 -0.84 . . . . 1.86 109.929 -178.131 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -54.23 -44.68 71.91 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 118.267 0.485 . . . . 1.98 111.045 174.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.96 -59.14 5.24 Favored 'General case' 0 CA--C 1.53 0.185 0 O-C-N 121.908 -0.495 . . . . 1.75 110.84 174.495 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -48.79 -46.06 41.05 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 124.132 0.973 . . . . 1.8 112.015 -177.56 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -50.11 -44.07 52.02 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 125.369 1.468 . . . . 3.72 109.346 177.52 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 13.7 mt-30 -85.09 -30.19 24.26 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-O 118.285 -0.864 . . . . 3.61 112.623 -178.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -74.33 -25.56 59.62 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 119.956 1.253 . . . . 2.43 111.207 -179.66 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 91.6 m -128.16 46.51 2.56 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.037 1.335 . . . . 2.19 110.009 177.419 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.67 -40.43 63.7 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 119.048 0.84 . . . . 7.63 109.309 171.769 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -62.18 133.96 94.42 Favored Pre-proline 0 N--CA 1.445 -0.702 0 C-N-CA 124.756 1.222 . . . . 3.06 108.151 -171.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 55.1 Cg_endo -60.17 142.83 99.16 Favored 'Trans proline' 0 N--CA 1.448 -1.189 0 C-N-CA 121.957 1.771 . . . . 1.42 109.751 -174.128 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 69.45 21.73 6.74 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.905 0.882 . . . . 3.32 111.615 170.049 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.1 m -113.81 11.02 17.89 Favored 'General case' 0 C--N 1.347 0.458 0 C-N-CA 125.142 1.377 . . . . 1.84 112.148 -179.531 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -84.98 114.16 21.95 Favored 'General case' 0 C--O 1.232 0.143 0 N-CA-C 107.863 -1.162 . . . . 3.17 107.863 179.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -110.78 149.05 39.79 Favored Pre-proline 0 CA--C 1.534 0.331 0 C-N-CA 124.264 1.026 . . . . 2.76 109.473 174.319 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_endo -65.7 -73.34 0.02 OUTLIER 'Trans proline' 0 N--CA 1.452 -0.917 0 C-N-CA 123.353 2.702 . . . . 0.8 111.614 -173.578 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -49.73 -43.79 48.0 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 124.964 1.306 . . . . 2.54 110.772 -179.858 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.53 -64.57 0.77 Allowed 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 125.834 1.654 . . . . 3.75 110.454 175.81 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 65.8 t80 -58.14 -43.51 87.35 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-O 122.85 1.31 . . . . 3.21 110.981 -179.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.435 ' CE1' ' HA ' ' A' ' 107' ' ' VAL . 3.8 t80 -52.16 -51.57 57.18 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.117 0.967 . . . . 5.85 112.1 178.485 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 30.1 mt-30 -72.56 -36.81 68.31 Favored 'General case' 0 N--CA 1.45 -0.43 0 O-C-N 121.431 -0.793 . . . . 3.81 110.724 176.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -64.14 -41.18 97.3 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-N 119.139 0.881 . . . . 1.5 110.983 -176.559 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 11.5 p -62.3 -50.3 72.19 Favored 'General case' 0 N--CA 1.441 -0.895 0 N-CA-C 106.777 -1.564 . . . . 3.28 106.777 173.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 102.39 20.58 11.9 Favored Glycine 0 CA--C 1.521 0.464 0 N-CA-C 109.619 -1.392 . . . . 2.31 109.619 -176.829 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 32.5 mt -60.08 -24.81 64.91 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 121.866 -0.785 . . . . 2.88 109.772 168.809 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 22.8 t -62.05 -24.78 67.29 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 123.459 0.704 . . . . 2.87 110.52 173.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -92.83 -24.74 18.4 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 123.006 0.522 . . . . 5.29 109.831 178.457 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 21.1 mmt -66.85 144.88 56.02 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 121.674 0.749 . . . . 4.52 111.141 176.387 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 8.5 t -75.01 156.26 36.44 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.983 -0.553 . . . . 2.41 109.512 179.336 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -45.53 -43.35 11.76 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 124.335 1.054 . . . . 1.84 111.435 176.447 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -49.96 -62.85 1.33 Allowed 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.66 0.784 . . . . 3.25 110.587 175.339 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 1.7 mm-40 -56.25 -46.45 79.63 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 122.983 0.513 . . . . 3.19 109.924 -179.315 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 78.4 t -58.4 -38.67 71.07 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.646 0 O-C-N 122.07 -0.394 . . . . 1.97 110.419 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 14.7 tptt -68.68 -44.26 74.39 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 121.182 -0.948 . . . . 5.11 111.091 176.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 73.6 m-20 -59.09 -53.43 58.47 Favored 'General case' 0 C--O 1.232 0.163 0 N-CA-C 109.767 -0.457 . . . . 2.9 109.767 178.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 7.8 m -58.2 -43.75 86.36 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 N-CA-C 109.505 -0.554 . . . . 1.8 109.505 176.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 7.7 t80 -49.19 -48.69 45.01 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 118.482 0.583 . . . . 5.3 111.019 175.274 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 73.2 mtp180 -58.73 -37.68 76.71 Favored 'General case' 0 CA--C 1.532 0.266 0 O-C-N 121.684 -0.635 . . . . 4.74 112.432 177.583 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 9.8 m-85 -62.7 -33.71 75.66 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 118.497 0.589 . . . . 4.9 110.18 174.122 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.3 mm -73.59 -47.14 45.97 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 CA-C-O 118.707 -0.663 . . . . 2.38 110.407 -179.303 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 20.1 t0 -73.32 65.29 0.85 Allowed 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 118.898 0.772 . . . . 1.9 108.969 176.445 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 10.8 t30 -58.29 -36.17 72.91 Favored 'General case' 0 C--N 1.332 -0.179 0 C-N-CA 125.104 1.361 . . . . 2.29 111.863 -170.598 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -73.38 -20.06 60.85 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.438 1.095 . . . . 2.55 111.955 175.782 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 14.0 mt-30 53.87 72.09 0.47 Allowed 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.831 1.652 . . . . 3.11 110.954 -175.016 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 89.4 p -105.72 -28.97 10.37 Favored 'General case' 0 C--N 1.34 0.171 0 C-N-CA 123.824 0.849 . . . . 1.84 111.909 174.609 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 87.74 7.41 74.97 Favored Glycine 0 CA--C 1.532 1.096 0 CA-C-O 119.398 -0.668 . . . . 1.53 112.063 -167.513 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 16.2 m-85 -134.11 133.57 41.23 Favored 'General case' 0 C--O 1.233 0.218 0 N-CA-C 108.214 -1.032 . . . . 3.76 108.214 164.526 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -93.33 80.58 4.42 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 126.689 1.995 . . . . 2.89 105.809 163.716 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -63.65 153.73 35.13 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 114.393 -1.276 . . . . 1.93 109.431 169.568 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -50.41 -46.1 56.08 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 124.345 1.058 . . . . 3.79 112.252 -173.15 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.5 tm-20 -59.56 -46.1 89.88 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 123.293 0.637 . . . . 3.61 110.355 -177.059 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 90.3 mt-10 -59.17 -43.79 92.13 Favored 'General case' 0 N--CA 1.451 -0.425 0 O-C-N 121.763 -0.585 . . . . 2.85 110.129 175.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -58.25 -37.63 75.31 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 122.289 -0.257 . . . . 3.29 110.607 175.559 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 21.0 ttmt -58.77 -12.32 4.18 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.966 0.906 . . . . 4.02 112.968 172.287 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 9.0 t80 -123.08 28.21 7.27 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.573 1.149 . . . . 6.44 110.47 173.176 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -66.06 -74.63 0.1 Allowed 'General case' 0 CA--C 1.53 0.181 0 O-C-N 121.247 -0.908 . . . . 3.8 110.604 -179.764 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.01 -17.2 64.35 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 121.619 -0.675 . . . . 4.05 110.999 -164.592 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 78.0 mm-40 -51.03 -21.63 1.91 Allowed 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.911 1.684 . . . . 2.06 112.354 166.125 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 1.9 mmpt? -80.07 -25.35 40.09 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 121.07 -1.019 . . . . 4.15 111.385 176.077 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 16.6 m-30 -94.07 -62.7 1.3 Allowed 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 125.435 1.494 . . . . 4.37 109.551 -179.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -105.65 -178.91 3.79 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 125.983 1.713 . . . . 2.99 107.864 -179.276 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 20.0 m -124.04 47.45 2.06 Favored 'General case' 0 N--CA 1.461 0.101 0 C-N-CA 123.123 0.569 . . . . 2.7 111.088 177.535 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 154.18 59.39 0.01 OUTLIER Glycine 0 CA--C 1.519 0.343 0 N-CA-C 110.019 -1.232 . . . . 1.62 110.019 179.147 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -91.1 -142.41 0.18 Allowed 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 108.558 -0.904 . . . . 2.05 108.558 175.104 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -123.26 41.69 3.4 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 123.91 0.884 . . . . 6.11 110.659 -175.831 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 4.2 mp0 -77.06 -36.84 55.64 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 125.296 1.439 . . . . 4.78 109.028 177.557 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -52.99 -44.85 67.53 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 114.75 -1.114 . . . . 1.96 110.54 178.026 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 23.8 m -67.87 113.47 5.63 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 121.7 0.762 . . . . 1.81 110.43 179.55 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -58.75 -41.95 87.71 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-N 114.737 -1.12 . . . . 2.95 111.002 177.591 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 15.8 m -47.66 -60.21 2.72 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 119.066 0.848 . . . . 1.6 111.318 173.634 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.74 -40.39 79.86 Favored 'General case' 0 N--CA 1.454 -0.229 0 O-C-N 121.896 -0.503 . . . . 3.41 109.932 -171.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 1.1 m -53.28 -47.74 68.92 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-O 122.06 0.933 . . . . 1.96 108.89 171.303 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 33.5 tttp -70.14 -27.77 64.82 Favored 'General case' 0 N--CA 1.44 -0.973 0 C-N-CA 124.236 1.014 . . . . 5.83 111.473 -174.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 52.5 m -55.94 -47.91 76.7 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 120.195 1.362 . . . . 1.79 109.998 168.189 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 9.0 mt -60.76 -58.21 9.43 Favored 'General case' 0 C--O 1.233 0.226 0 N-CA-C 109.47 -0.567 . . . . 3.16 109.47 172.612 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 2.6 ttp -46.96 -43.6 19.33 Favored 'General case' 0 CA--C 1.535 0.366 0 O-C-N 123.528 0.517 . . . . 4.29 112.39 -178.092 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -56.45 -45.92 80.58 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 125.886 1.675 . . . . 1.63 111.668 -173.34 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -84.91 -44.6 13.02 Favored 'General case' 0 CA--C 1.521 -0.137 0 N-CA-C 110.575 -0.157 . . . . 1.5 110.575 178.51 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -55.99 -45.4 79.02 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 122.706 0.403 . . . . 1.64 110.483 -176.644 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -73.75 77.8 1.56 Allowed 'General case' 0 N--CA 1.448 -0.566 0 CA-C-O 121.274 0.559 . . . . 0.93 109.571 177.325 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -76.19 45.48 0.37 Allowed 'General case' 0 CA--C 1.538 0.496 0 O-C-N 121.477 -0.764 . . . . 3.45 111.827 178.286 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 62.5 m-20 -135.37 -58.93 0.78 Allowed 'General case' 0 C--N 1.338 0.07 0 C-N-CA 125.463 1.505 . . . . 1.57 109.278 -177.517 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 103.26 45.67 1.54 Allowed Glycine 0 CA--C 1.532 1.106 0 N-CA-C 110.025 -1.23 . . . . 0.87 110.025 -163.329 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -124.6 -61.89 1.29 Allowed 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 125.078 1.351 . . . . 1.97 109.687 171.085 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 127.43 -24.28 5.3 Favored Glycine 0 CA--C 1.529 0.948 0 C-N-CA 124.678 1.133 . . . . 0.7 111.563 177.733 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 40.0 mtpt -80.71 114.08 19.34 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 106.823 -1.547 . . . . 4.99 106.823 175.544 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 5.5 mt -95.16 153.6 3.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 N-CA-C 107.232 -1.395 . . . . 1.85 107.232 -178.09 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -132.03 -179.35 16.14 Favored Glycine 0 CA--C 1.522 0.47 0 N-CA-C 108.903 -1.679 . . . . 1.3 108.903 175.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -66.06 -36.79 84.18 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 117.601 0.701 . . . . 1.83 110.404 -177.242 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 -60.02 -59.13 5.9 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-O 118.797 -0.62 . . . . 2.51 110.13 173.594 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -52.24 -47.98 65.44 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-O 121.767 0.794 . . . . 1.43 110.648 -179.664 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 58.7 t80 -62.46 -54.22 43.34 Favored 'General case' 0 N--CA 1.454 -0.27 0 O-C-N 121.821 -0.55 . . . . 5.0 110.363 -178.205 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 46.7 tt0 -55.44 -46.44 76.73 Favored 'General case' 0 C--O 1.22 -0.497 0 CA-C-O 118.294 -0.86 . . . . 2.58 110.613 177.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -51.96 -58.88 5.19 Favored 'General case' 0 CA--C 1.522 -0.126 0 CA-C-N 119.462 1.028 . . . . 3.09 110.075 176.67 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -55.8 -47.21 77.52 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 109.44 -0.578 . . . . 5.74 109.44 -179.475 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . 0.435 ' HA ' ' CE1' ' A' ' 31' ' ' PHE . 76.1 t -75.35 -6.06 8.08 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.795 0 C-N-CA 124.293 1.037 . . . . 1.91 112.552 -177.284 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 6.6 t60 -90.15 -11.58 40.75 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 120.086 -1.634 . . . . 3.7 110.221 173.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 28.5 t . . . . . 0 C--O 1.252 1.219 0 CA-C-O 114.935 -2.459 . . . . 2.31 114.016 -174.109 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.9 ttt . . . . . 0 N--CA 1.474 0.753 0 N-CA-C 108.3 -1.0 . . . . 7.66 108.3 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 11.6 t 157.74 -72.24 0.0 OUTLIER 'General case' 0 C--O 1.224 -0.284 0 C-N-CA 126.533 1.933 . . . . 4.85 106.154 -171.572 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.7 pp -96.66 -23.1 4.86 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.289 0 CA-C-O 121.65 0.738 . . . . 1.98 111.942 -167.73 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 12.9 t -65.91 -15.38 62.9 Favored 'General case' 0 N--CA 1.422 -1.844 0 C-N-CA 126.879 2.071 . . . . 2.74 111.616 -174.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 36.6 t0 -134.0 44.72 2.7 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.914 0.886 . . . . 2.86 109.537 -179.326 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 20.1 t -121.02 -61.82 2.09 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.229 0 C-N-CA 124.912 1.285 . . . . 2.45 109.4 177.636 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 9.1 tp -171.95 -61.55 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 104.991 -2.226 . . . . 2.78 104.991 -174.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -33.03 -37.83 0.03 OUTLIER 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 128.921 2.888 . . . . 2.67 115.8 -173.213 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -51.27 -41.12 60.18 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 118.94 0.791 . . . . 1.9 112.893 179.54 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.3 t0 -68.2 -45.5 73.17 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 122.86 1.314 . . . . 1.9 108.56 177.027 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -62.62 -47.63 82.9 Favored 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 125.143 1.377 . . . . 2.51 109.34 -170.171 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 26.6 pt -60.57 -38.28 77.8 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.877 0 C-N-CA 123.188 0.595 . . . . 1.94 111.394 176.402 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.84 -44.72 93.94 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 118.34 0.518 . . . . 1.86 110.045 177.484 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.85 -54.76 43.52 Favored 'General case' 0 C--O 1.234 0.247 0 O-C-N 122.174 -0.328 . . . . 2.0 110.471 172.055 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -48.55 -46.49 39.01 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 124.549 1.14 . . . . 1.73 111.272 -177.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -54.32 -43.44 71.17 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 124.6 1.16 . . . . 4.61 109.65 -179.475 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -77.99 -49.27 14.39 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 109.699 -0.482 . . . . 3.76 109.699 -176.096 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -59.69 -33.2 71.29 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 122.025 0.13 . . . . 3.2 110.904 -175.205 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 75.0 m -107.98 36.91 2.6 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 124.796 1.238 . . . . 2.15 110.493 177.359 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 53.7 ttt-85 -78.93 -30.86 44.91 Favored 'General case' 0 C--O 1.234 0.242 0 O-C-N 121.364 -0.835 . . . . 5.96 109.964 179.155 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 61.3 m-20 -74.27 144.87 82.18 Favored Pre-proline 0 CA--C 1.539 0.551 0 C-N-CA 123.789 0.836 . . . . 2.05 109.613 177.212 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -64.31 140.79 72.18 Favored 'Trans proline' 0 N--CA 1.456 -0.68 0 C-N-CA 123.505 2.803 . . . . 1.5 111.02 -176.087 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 62.73 10.83 4.45 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.084 1.353 . . . . 2.41 113.184 177.356 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 29.3 m -92.7 16.21 12.76 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.299 1.44 . . . . 1.93 110.957 -177.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 7.4 t80 -99.86 112.47 24.74 Favored 'General case' 0 N--CA 1.444 -0.764 0 N-CA-C 106.767 -1.568 . . . . 3.69 106.767 179.693 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -104.42 147.64 34.7 Favored Pre-proline 0 C--O 1.235 0.303 0 N-CA-C 108.257 -1.016 . . . . 4.86 108.257 167.598 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -62.05 -62.67 0.11 Allowed 'Trans proline' 0 N--CA 1.451 -1.015 0 C-N-CA 122.88 2.387 . . . . 0.67 111.176 -176.013 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 48.9 mt-30 -59.0 -40.63 85.5 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 123.177 0.591 . . . . 2.2 110.937 -173.684 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -50.45 -69.41 0.11 Allowed 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.54 1.136 . . . . 6.04 108.966 169.817 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 80.8 t80 -53.65 -43.39 68.77 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 123.583 0.753 . . . . 3.87 112.183 -175.216 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -50.59 -59.07 4.42 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 127.325 2.25 . . . . 6.05 109.983 177.093 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.73 -48.0 76.2 Favored 'General case' 0 N--CA 1.445 -0.693 0 N-CA-C 107.972 -1.121 . . . . 4.75 107.972 -177.072 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -63.35 -35.74 81.4 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 123.514 0.726 . . . . 1.61 112.914 -171.682 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 43.5 m -76.49 2.65 13.16 Favored 'General case' 0 N--CA 1.449 -0.518 0 O-C-N 123.705 0.628 . . . . 2.94 110.803 176.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 79.62 9.42 86.86 Favored Glycine 0 C--N 1.339 0.73 0 N-CA-C 110.951 -0.859 . . . . 0.9 110.951 169.258 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 50.0 mt -73.91 -24.06 59.63 Favored 'General case' 0 N--CA 1.441 -0.879 0 O-C-N 121.378 -1.072 . . . . 2.6 109.818 -172.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 26.3 p -66.29 -25.69 66.97 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.34 0.656 . . . . 3.41 111.063 168.853 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 13.1 tptt -86.27 -34.09 20.48 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 108.175 -1.046 . . . . 4.68 108.175 -177.726 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.4 ' O ' ' CB ' ' A' ' 40' ' ' SER . 36.2 mtt -47.67 -66.88 0.33 Allowed 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 114.702 1.371 . . . . 4.9 114.702 -177.064 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' SER . . . . . 0.4 ' CB ' ' O ' ' A' ' 39' ' ' MET . 42.1 t 113.99 139.93 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 128.714 2.806 . . . . 2.58 108.021 -172.788 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -37.22 -40.34 0.32 Allowed 'General case' 0 C--N 1.341 0.217 0 C-N-CA 125.206 1.402 . . . . 1.87 112.688 173.695 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 60.8 m-80 -56.9 -61.37 2.49 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-O 122.028 0.918 . . . . 2.71 109.703 -179.031 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 28.8 tt0 -70.43 -35.57 73.46 Favored 'General case' 0 N--CA 1.439 -1.002 0 CA-C-N 115.165 -0.925 . . . . 3.24 109.558 -176.244 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 51.8 t -59.26 -49.31 83.91 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.67 0 CA-C-N 119.063 0.847 . . . . 1.52 108.994 178.653 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -55.08 -46.78 75.49 Favored 'General case' 0 N--CA 1.455 -0.221 0 O-C-N 121.361 -0.837 . . . . 3.75 110.608 173.31 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 33.7 t0 -56.2 -55.36 34.08 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 118.076 0.398 . . . . 2.47 110.778 178.597 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 3.1 m -52.79 -44.4 47.75 Favored 'Isoleucine or valine' 0 C--N 1.342 0.27 0 CA-C-O 118.983 -0.532 . . . . 1.85 110.304 179.468 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 16.0 m-30 -49.98 -39.71 41.82 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 118.535 0.607 . . . . 7.12 112.067 177.109 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 69.0 mtp180 -58.89 -30.17 67.58 Favored 'General case' 0 CA--C 1.532 0.259 0 O-C-N 121.195 -0.941 . . . . 3.77 111.989 179.145 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 18.1 t80 -70.02 -25.14 63.44 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.503 0.721 . . . . 5.48 110.919 178.054 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 4.1 mp -125.69 99.61 6.08 Favored 'Isoleucine or valine' 0 C--N 1.342 0.266 0 C-N-CA 124.066 0.946 . . . . 3.69 111.206 -177.02 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 57.0 t0 -155.99 -49.04 0.08 Allowed 'General case' 0 C--O 1.223 -0.338 0 C-N-CA 125.979 1.712 . . . . 3.9 106.388 166.56 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 17.6 t-20 97.62 -52.88 0.01 OUTLIER 'General case' 0 C--N 1.34 0.195 0 C-N-CA 128.31 2.644 . . . . 4.87 107.825 -178.128 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 40.6 m-20 -56.88 -46.22 82.03 Favored 'General case' 0 CA--C 1.528 0.107 0 CA-C-O 121.455 0.645 . . . . 3.57 110.24 169.201 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 59.26 63.32 1.61 Allowed 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 114.468 -1.242 . . . . 4.79 109.491 -152.569 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 98.0 p -103.22 -43.69 5.39 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 127.185 2.194 . . . . 2.57 110.424 178.821 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 108.97 -11.73 34.5 Favored Glycine 0 CA--C 1.534 1.23 0 C-N-CA 124.591 1.091 . . . . 1.98 111.626 -166.447 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 76.6 m-85 -100.51 115.44 30.11 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 124.698 1.199 . . . . 4.74 109.187 175.412 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -87.43 81.51 7.8 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 125.889 1.676 . . . . 2.76 106.855 167.101 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -63.59 144.14 57.25 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 114.306 -1.316 . . . . 1.38 109.19 174.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -40.26 -51.35 2.73 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 125.247 1.419 . . . . 3.48 113.95 -171.056 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -71.57 -22.27 61.76 Favored 'General case' 0 N--CA 1.452 -0.325 0 O-C-N 121.274 -0.891 . . . . 3.54 112.14 -173.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 89.0 mt-10 -67.9 -38.42 82.96 Favored 'General case' 0 N--CA 1.456 -0.171 0 O-C-N 120.725 -1.235 . . . . 2.4 108.694 169.29 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -51.02 -47.35 61.67 Favored 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 109.231 -0.655 . . . . 3.58 109.231 171.714 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 29.3 ttpt -54.99 -13.57 1.17 Allowed 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 114.466 1.284 . . . . 3.09 114.466 176.234 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 78.8 m-85 -124.03 10.21 8.79 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 119.876 1.217 . . . . 6.57 112.289 173.61 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -49.76 -64.51 0.79 Allowed 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.89 1.276 . . . . 4.08 111.548 -169.321 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 70.2 mt -65.2 -12.86 55.7 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 113.443 0.905 . . . . 3.57 113.443 -176.79 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 11.1 mm-40 -61.31 -30.66 70.64 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 120.458 1.481 . . . . 2.22 110.505 -179.796 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.9 mptm? -59.74 -30.03 68.56 Favored 'General case' 0 CA--C 1.531 0.247 0 O-C-N 122.157 -0.339 . . . . 3.72 111.897 172.344 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 9.4 m-30 -86.75 -53.75 4.76 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 123.305 0.642 . . . . 4.31 109.659 -179.438 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -143.22 123.29 13.63 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.275 1.03 . . . . 3.7 108.493 -174.99 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 79.8 p -44.7 -37.12 3.5 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 126.423 1.889 . . . . 3.06 112.26 174.585 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -106.4 28.44 13.54 Favored Glycine 0 CA--C 1.525 0.669 0 C-N-CA 125.883 1.706 . . . . 2.06 111.946 -172.649 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -71.42 -165.85 0.16 Allowed 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 117.956 0.878 . . . . 1.82 111.681 174.546 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 6.0 tpt180 -113.48 -9.75 13.27 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 115.626 1.713 . . . . 3.88 115.626 -158.412 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 55.1 mm-40 -59.35 -6.9 1.11 Allowed 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 114.06 1.133 . . . . 4.57 114.06 -175.827 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -57.31 -39.97 76.92 Favored 'General case' 0 N--CA 1.446 -0.673 0 O-C-N 121.105 -0.997 . . . . 2.17 110.562 171.922 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 4.1 m -76.84 129.95 36.95 Favored 'General case' 0 C--N 1.345 0.385 0 C-N-CA 118.987 -1.085 . . . . 1.65 109.875 177.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -65.45 -43.81 89.22 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-N 115.285 -0.87 . . . . 3.25 110.677 177.497 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 73.7 m -50.11 -62.86 1.33 Allowed 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 119.41 1.005 . . . . 1.5 111.761 171.755 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -54.09 -42.51 69.45 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 118.207 0.458 . . . . 2.94 111.074 -177.532 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 5.8 m -57.7 -53.62 56.08 Favored 'General case' 0 C--N 1.34 0.179 0 CA-C-O 121.913 0.863 . . . . 2.17 109.785 173.824 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 8.5 tptt -58.67 -38.58 78.48 Favored 'General case' 0 N--CA 1.445 -0.722 0 C-N-CA 125.91 1.684 . . . . 4.53 110.591 -170.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 67.4 m -52.1 -46.99 65.49 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 118.988 0.813 . . . . 1.86 111.696 170.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -65.66 -56.38 12.44 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 108.298 -1.001 . . . . 3.02 108.298 177.542 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 3.5 ttp -45.3 -45.27 12.08 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.456 0.702 . . . . 4.24 111.991 178.628 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -58.84 -43.57 90.78 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 126.086 1.755 . . . . 1.92 112.21 -171.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -90.27 -31.66 16.88 Favored 'General case' 0 N--CA 1.461 0.098 0 C-N-CA 122.552 0.341 . . . . 1.46 111.45 -179.694 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -62.05 -48.56 79.69 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 123.025 0.53 . . . . 1.56 110.675 175.525 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -71.24 114.41 9.28 Favored 'General case' 0 N--CA 1.446 -0.626 0 N-CA-C 108.856 -0.794 . . . . 1.01 108.856 178.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 8.0 m-80 -110.22 37.14 2.8 Favored 'General case' 0 N--CA 1.463 0.202 0 N-CA-C 109.661 -0.496 . . . . 3.97 109.661 -179.135 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 32.9 m-20 -119.06 -47.53 2.48 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 125.093 1.357 . . . . 1.43 110.195 173.333 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 89.75 41.56 5.63 Favored Glycine 0 CA--C 1.53 0.989 0 N-CA-C 108.672 -1.771 . . . . 0.87 108.672 -155.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -121.94 -55.03 1.91 Allowed 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.363 1.065 . . . . 2.69 110.134 -179.861 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 121.44 -38.15 2.74 Favored Glycine 0 CA--C 1.527 0.828 0 C-N-CA 124.19 0.9 . . . . 0.7 111.253 176.78 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 77.9 mttt -69.58 121.87 17.95 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 107.384 -1.339 . . . . 5.19 107.384 176.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 9.0 mt -105.71 127.65 60.49 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.323 0 N-CA-C 108.603 -0.888 . . . . 1.83 108.603 -173.728 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -85.11 158.88 33.46 Favored Glycine 0 CA--C 1.528 0.905 0 N-CA-C 110.387 -1.085 . . . . 0.76 110.387 169.688 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -51.27 -34.82 34.52 Favored 'General case' 0 C--N 1.34 0.176 0 O-C-N 122.044 -0.68 . . . . 2.17 109.896 167.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 25.8 tt0 -61.67 -62.27 1.92 Allowed 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 123.57 0.748 . . . . 2.52 110.67 179.021 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -44.57 -48.61 10.31 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.164 0.985 . . . . 2.19 110.167 172.613 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -65.72 -42.05 91.53 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 115.956 -0.566 . . . . 3.92 111.522 -175.682 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 12.4 tt0 -61.19 -43.8 98.3 Favored 'General case' 0 C--O 1.222 -0.38 0 CA-C-O 118.166 -0.921 . . . . 3.81 108.962 173.697 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -54.15 -53.16 57.2 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 120.032 1.287 . . . . 3.12 110.916 176.57 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.97 -54.42 47.15 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 108.449 -0.945 . . . . 3.27 108.449 -179.026 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 92.5 t -74.9 -15.74 16.04 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 CA-C-N 115.308 -0.86 . . . . 1.94 112.866 -169.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 3.0 t60 -98.15 3.86 49.05 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 120.423 -1.423 . . . . 3.34 111.186 175.521 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 31.3 t . . . . . 0 C--O 1.254 1.297 0 CA-C-O 115.995 -1.955 . . . . 2.4 111.37 179.491 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.47 0.568 0 N-CA-C 106.602 -1.629 . . . . 8.13 106.602 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 51.1 m -144.61 176.13 9.64 Favored 'General case' 0 N--CA 1.443 -0.808 0 O-C-N 125.265 1.603 . . . . 4.1 106.952 179.49 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.2 pp -52.08 -39.16 25.68 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 CA-C-N 115.795 -0.638 . . . . 2.53 110.275 178.449 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 2.8 t -82.44 52.37 2.04 Favored 'General case' 0 N--CA 1.438 -1.063 0 C-N-CA 125.979 1.712 . . . . 4.21 108.919 179.885 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -174.64 -50.89 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.126 0 C-N-CA 125.026 1.33 . . . . 3.11 108.394 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 24.2 t -51.08 -46.71 31.52 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 C-N-CA 124.144 0.978 . . . . 2.89 111.683 -177.734 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 11.7 tp -164.34 -58.47 0.03 OUTLIER 'General case' 0 CA--C 1.517 -0.305 0 N-CA-C 106.901 -1.518 . . . . 2.48 106.901 -177.229 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 2.3 m -49.26 -26.08 2.76 Favored 'General case' 0 C--O 1.215 -0.747 0 CA-C-O 117.785 -1.103 . . . . 1.86 112.948 -171.382 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -36.86 -48.46 0.75 Allowed 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 114.402 1.26 . . . . 2.57 114.402 168.741 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -70.17 -44.39 68.89 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-O 122.69 1.233 . . . . 2.09 109.375 -179.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -64.0 -41.57 97.44 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 124.612 1.165 . . . . 2.6 110.434 -173.365 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 45.8 pt -60.6 -39.74 82.38 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.811 0 O-C-N 121.289 -0.882 . . . . 2.81 110.299 175.153 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.16 -41.16 99.21 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 118.347 0.521 . . . . 1.87 109.788 178.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.48 -59.7 4.98 Favored 'General case' 0 CA--C 1.536 0.415 0 O-C-N 122.229 -0.294 . . . . 1.7 110.416 171.701 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -48.78 -47.52 41.9 Favored 'General case' 0 C--O 1.234 0.248 0 C-N-CA 125.842 1.657 . . . . 1.74 111.589 -176.525 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 18.9 tp -48.52 -43.86 35.63 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 126.199 1.799 . . . . 4.07 110.227 178.164 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -90.73 -42.98 10.4 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 110.052 -0.351 . . . . 3.87 110.052 -173.106 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -65.86 -34.46 78.2 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 122.379 0.271 . . . . 2.31 111.374 -173.657 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 58.2 m -123.18 62.93 1.01 Allowed 'General case' 0 C--O 1.234 0.263 0 C-N-CA 124.038 0.935 . . . . 2.13 108.495 171.777 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 36.4 ttt180 -82.5 -18.75 40.49 Favored 'General case' 0 CA--C 1.535 0.392 0 O-C-N 121.715 -0.616 . . . . 6.62 111.729 176.817 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -97.21 147.34 32.81 Favored Pre-proline 0 C--O 1.235 0.341 0 C-N-CA 124.986 1.315 . . . . 2.23 111.314 -166.429 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_endo -60.0 127.94 24.93 Favored 'Trans proline' 0 N--CA 1.452 -0.934 0 C-N-CA 123.049 2.499 . . . . 1.25 111.233 -173.658 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 41.7 m-20 76.29 18.44 1.87 Allowed 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 126.925 2.09 . . . . 2.92 111.944 169.36 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 7.2 m -90.15 -17.09 28.25 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.494 0.718 . . . . 1.74 111.989 -178.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -86.01 97.15 10.11 Favored 'General case' 0 CA--C 1.534 0.362 0 O-C-N 121.731 -0.606 . . . . 5.02 111.313 -157.857 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -80.44 155.47 74.02 Favored Pre-proline 0 CA--C 1.534 0.331 0 C-N-CA 123.918 0.887 . . . . 2.71 110.548 -178.938 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -70.81 -63.27 0.04 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.209 0 C-N-CA 122.534 2.156 . . . . 0.78 111.243 -177.636 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 38.2 mt-30 -61.12 -31.93 71.63 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 122.765 0.426 . . . . 2.46 110.867 -178.245 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.79 -64.43 0.96 Allowed 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 109.337 -0.616 . . . . 4.48 109.337 171.014 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 4.8 t80 -54.82 -48.38 72.88 Favored 'General case' 0 C--O 1.22 -0.469 0 C-N-CA 123.281 0.632 . . . . 3.55 110.676 -174.355 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -34.99 -64.09 0.29 Allowed 'General case' 0 C--O 1.234 0.267 0 C-N-CA 127.741 2.417 . . . . 6.34 111.837 171.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 -66.75 -48.61 68.58 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 108.747 -0.834 . . . . 3.32 108.747 -177.408 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -60.63 -25.57 66.39 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 123.582 0.753 . . . . 2.03 112.238 -174.627 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 30.7 t -89.82 -3.53 58.08 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 126.616 1.967 . . . . 2.39 111.086 -179.472 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 80.61 5.85 89.68 Favored Glycine 0 C--N 1.335 0.52 0 N-CA-C 111.326 -0.709 . . . . 0.88 111.326 172.359 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 80.7 mt -68.55 -26.57 65.48 Favored 'General case' 0 N--CA 1.445 -0.695 0 O-C-N 121.831 -0.805 . . . . 2.58 109.902 -177.153 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 24.2 t -64.02 -30.61 71.67 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.604 1.162 . . . . 2.59 111.387 169.117 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -86.6 -38.09 17.46 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 109.296 -0.631 . . . . 4.78 109.296 -176.353 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 28.6 mtt -56.18 128.13 34.1 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-O 120.968 0.413 . . . . 4.31 111.039 174.66 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 7.7 m -63.73 158.67 21.03 Favored 'General case' 0 N--CA 1.452 -0.335 0 O-C-N 121.74 -0.6 . . . . 2.86 110.057 173.428 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -43.01 -41.55 3.46 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 124.231 1.013 . . . . 2.02 111.983 177.005 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 7.8 m120 -55.0 -58.46 7.53 Favored 'General case' 0 N--CA 1.457 -0.093 0 C-N-CA 123.787 0.835 . . . . 3.94 110.075 177.648 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 13.4 mm-40 -60.49 -48.0 83.68 Favored 'General case' 0 C--O 1.219 -0.527 0 N-CA-C 109.555 -0.535 . . . . 2.85 109.555 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 77.1 t -54.55 -48.69 70.16 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 CA-C-N 118.975 0.807 . . . . 1.66 110.489 -179.645 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 63.9 tttt -74.9 -24.05 58.47 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 121.087 -1.008 . . . . 3.88 111.812 -178.784 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 61.3 t0 -66.66 -65.46 0.68 Allowed 'General case' 0 CA--C 1.529 0.151 0 N-CA-C 108.782 -0.821 . . . . 2.84 108.782 168.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 15.2 m -47.35 -50.88 7.2 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 C-N-CA 123.678 0.791 . . . . 1.76 110.805 179.406 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 20.9 m-85 -55.29 -43.77 75.07 Favored 'General case' 0 C--O 1.225 -0.225 0 CA-C-N 118.843 0.747 . . . . 8.19 111.975 177.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 84.0 mtm180 -68.37 -36.44 79.2 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 119.169 0.895 . . . . 7.13 112.261 176.524 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 49.4 t80 -63.96 -41.2 97.64 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 118.448 0.567 . . . . 4.07 109.509 -179.819 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.0 mp -78.02 -32.52 17.46 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 CA-C-O 118.607 -0.711 . . . . 3.44 111.975 177.003 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 52.4 t0 -66.98 75.57 0.12 Allowed 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 119.354 0.979 . . . . 1.86 108.983 170.501 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 25.3 t-20 -54.73 156.46 3.58 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 107.699 -1.223 . . . . 3.37 107.699 167.922 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 72.23 -44.77 0.6 Allowed 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 123.916 0.886 . . . . 3.48 113.118 -173.861 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 59.09 52.09 6.53 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 124.207 1.003 . . . . 4.51 111.312 -172.645 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 16.6 p -57.78 -6.98 0.6 Allowed 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.3 1.44 . . . . 2.02 113.093 166.419 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 73.78 14.07 80.18 Favored Glycine 0 CA--C 1.527 0.808 0 N-CA-C 110.0 -1.24 . . . . 1.61 110.0 -167.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 -148.06 141.93 25.78 Favored 'General case' 0 N--CA 1.441 -0.894 0 C-N-CA 124.929 1.292 . . . . 4.93 108.207 -179.235 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 4.9 mp -95.25 78.99 3.49 Favored 'General case' 0 N--CA 1.435 -1.212 0 N-CA-C 105.26 -2.126 . . . . 4.43 105.26 161.333 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -63.19 170.39 2.92 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-N 113.754 -1.566 . . . . 1.5 109.224 175.733 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -48.7 -57.33 6.45 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 120.059 1.299 . . . . 4.08 111.727 -171.255 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -45.32 -35.4 3.48 Favored 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 115.258 1.577 . . . . 3.51 115.258 172.082 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -57.86 -44.08 86.37 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 121.213 1.824 . . . . 3.46 109.379 174.498 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -77.89 16.81 0.65 Allowed 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 115.219 -0.901 . . . . 3.34 111.259 175.439 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 26.7 ttpt -106.22 5.78 30.19 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.825 1.25 . . . . 3.09 109.019 161.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 25.3 p90 -152.8 30.28 0.51 Allowed 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 118.606 0.639 . . . . 7.17 112.189 171.631 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 27.4 t80 -57.83 -61.75 2.3 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 119.116 0.871 . . . . 3.8 108.916 -179.277 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 1.3 mp -82.58 -13.91 55.75 Favored 'General case' 0 CA--C 1.535 0.374 0 O-C-N 120.951 -1.093 . . . . 3.47 113.238 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 48.9 mm-40 -69.5 14.06 0.11 Allowed 'General case' 0 CA--C 1.544 0.734 0 O-C-N 121.146 -0.971 . . . . 2.15 112.114 176.881 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.86 -25.85 12.46 Favored 'General case' 0 CA--C 1.533 0.293 0 O-C-N 120.21 -1.556 . . . . 4.77 110.326 165.28 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -81.14 -48.26 12.37 Favored 'General case' 0 N--CA 1.456 -0.159 0 N-CA-C 108.184 -1.043 . . . . 9.29 108.184 173.629 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -120.7 177.46 5.07 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 123.688 0.795 . . . . 4.03 110.672 -175.073 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 7.0 m -96.32 -28.16 14.62 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.704 1.202 . . . . 2.69 111.031 165.581 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -113.08 15.01 23.46 Favored Glycine 0 CA--C 1.527 0.802 0 C-N-CA 123.706 0.669 . . . . 1.66 112.081 -166.504 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -72.09 157.58 37.52 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 117.288 0.544 . . . . 2.07 111.059 -176.567 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.87 18.41 0.1 Allowed 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 115.597 1.702 . . . . 4.63 115.597 -159.228 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 73.1 mm-40 -58.96 -34.25 71.57 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 122.43 1.109 . . . . 3.96 111.718 -173.229 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -55.21 -35.4 64.83 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 114.764 -1.107 . . . . 1.6 111.912 175.759 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 52.6 m -76.6 106.03 8.01 Favored 'General case' 0 C--N 1.342 0.273 0 CA-C-N 119.117 0.871 . . . . 1.62 109.758 -179.045 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -56.17 -41.33 75.32 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 114.942 -1.027 . . . . 3.17 110.92 -176.605 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 69.8 m -62.38 -53.33 56.61 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.103 0.561 . . . . 2.51 111.864 -178.266 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -58.7 -46.63 86.84 Favored 'General case' 0 C--O 1.233 0.229 0 O-C-N 121.482 -0.761 . . . . 3.17 110.341 176.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -50.0 -51.17 43.87 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-O 121.545 0.688 . . . . 1.68 109.764 175.176 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 89.2 mttt -66.62 -28.25 68.34 Favored 'General case' 0 C--O 1.22 -0.481 0 C-N-CA 124.969 1.308 . . . . 5.81 111.61 -177.517 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 3.4 t -60.79 -47.19 87.46 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 119.561 1.073 . . . . 2.16 109.446 171.14 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -63.67 -51.3 65.72 Favored 'General case' 0 C--O 1.234 0.28 0 O-C-N 121.871 -0.518 . . . . 4.36 110.412 174.744 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 31.6 ttm -45.82 -50.97 13.6 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 123.263 0.352 . . . . 3.99 111.747 173.659 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -54.6 -46.27 73.76 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 125.831 1.652 . . . . 1.42 111.863 -169.177 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -86.54 -41.29 14.45 Favored 'General case' 0 C--O 1.226 -0.157 0 N-CA-C 111.635 0.235 . . . . 1.31 111.635 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -59.16 -39.3 82.03 Favored 'General case' 0 CA--C 1.521 -0.135 0 CA-C-N 118.092 0.406 . . . . 1.64 111.288 179.761 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 15.7 t0 -67.04 112.56 4.45 Favored 'General case' 0 N--CA 1.443 -0.811 0 N-CA-C 108.206 -1.035 . . . . 1.59 108.206 174.087 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 76.0 m-20 -93.14 4.97 53.09 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-O 118.747 -0.644 . . . . 2.9 110.908 -179.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 49.8 m-20 -99.71 -56.22 2.45 Favored 'General case' 0 C--N 1.345 0.404 0 CA-C-N 118.904 0.775 . . . . 1.21 110.975 -178.799 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 99.44 50.62 1.4 Allowed Glycine 0 CA--C 1.53 1.025 0 N-CA-C 108.69 -1.764 . . . . 0.8 108.69 -156.63 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 30.1 p-10 -134.74 -50.63 0.78 Allowed 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 126.191 1.796 . . . . 1.92 110.544 176.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 126.9 -46.87 1.05 Allowed Glycine 0 CA--C 1.521 0.428 0 C-N-CA 124.785 1.183 . . . . 0.83 110.716 170.473 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 6.3 ptpp? -57.21 136.29 56.46 Favored 'General case' 0 C--O 1.241 0.649 0 CA-C-N 117.282 0.541 . . . . 4.99 109.542 171.304 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 8.1 mt -125.41 114.6 40.45 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.197 0 C-N-CA 124.538 1.135 . . . . 1.56 108.646 -172.001 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -71.13 160.16 54.01 Favored Glycine 0 CA--C 1.531 1.032 0 N-CA-C 110.121 -1.192 . . . . 0.83 110.121 172.643 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -57.76 -36.91 72.75 Favored 'General case' 0 C--O 1.227 -0.12 0 O-C-N 121.848 -0.796 . . . . 2.49 109.354 171.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -47.51 -69.57 0.12 Allowed 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.98 0.912 . . . . 4.44 111.847 166.256 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -44.01 -46.46 8.36 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.428 1.091 . . . . 2.15 111.942 179.045 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -67.38 -50.16 60.88 Favored 'General case' 0 CA--C 1.541 0.629 0 O-C-N 121.997 -0.439 . . . . 4.96 111.869 -178.698 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 5.7 tm0? -62.22 -32.75 73.46 Favored 'General case' 0 C--O 1.223 -0.301 0 C-N-CA 124.083 0.953 . . . . 2.74 110.618 178.189 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -60.1 -60.11 4.35 Favored 'General case' 0 N--CA 1.456 -0.156 0 CA-C-N 119.123 0.874 . . . . 4.3 109.523 169.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 7.7 tpt -54.0 -44.32 70.77 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-O 121.072 0.463 . . . . 3.65 109.919 -174.019 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 46.0 t -72.44 -64.59 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.595 0 CA-C-N 115.872 -0.604 . . . . 1.95 111.403 178.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 22.5 t60 -58.17 -36.19 72.66 Favored 'General case' 0 C--N 1.331 -0.233 0 O-C-N 121.038 -1.039 . . . . 4.25 110.529 -169.529 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 80.6 p . . . . . 0 C--O 1.251 1.175 0 C-N-CA 125.938 1.695 . . . . 5.71 113.166 173.622 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.472 0.661 0 N-CA-C 106.465 -1.68 . . . . 8.25 106.465 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.4 m 143.9 -82.17 0.0 OUTLIER 'General case' 0 C--O 1.223 -0.334 0 C-N-CA 129.267 3.027 . . . . 2.97 106.0 -176.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 2.9 pt -84.04 -24.67 7.59 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.181 0 CA-C-O 121.509 0.671 . . . . 3.16 112.237 -168.39 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 11.9 t -54.51 -37.44 65.35 Favored 'General case' 0 N--CA 1.424 -1.763 0 C-N-CA 126.281 1.832 . . . . 3.08 112.355 -178.753 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 39.5 t0 -112.58 45.17 1.34 Allowed 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.769 0.828 . . . . 3.06 109.994 -175.635 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 66.1 t -120.05 -64.4 1.63 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.21 0 C-N-CA 124.23 1.012 . . . . 2.25 109.724 175.367 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -169.89 -54.45 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 106.704 -1.591 . . . . 2.15 106.704 -173.849 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 2.5 m -34.7 -29.61 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 129.507 3.123 . . . . 1.94 116.446 -172.185 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -49.08 -49.77 40.09 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 119.076 0.853 . . . . 1.74 111.939 172.781 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -63.03 -42.15 99.7 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-O 122.51 1.147 . . . . 2.09 109.484 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -68.29 -43.68 77.18 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-N 115.197 -0.911 . . . . 2.42 108.905 -171.647 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 10.0 pt -61.92 -37.49 78.37 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.943 0 O-C-N 121.21 -0.931 . . . . 2.78 111.526 174.029 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.44 -44.57 89.22 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 118.928 0.785 . . . . 1.69 110.305 175.331 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.21 -56.26 24.4 Favored 'General case' 0 CA--C 1.535 0.4 0 O-C-N 122.198 -0.314 . . . . 1.8 110.737 173.018 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -53.72 -44.19 69.67 Favored 'General case' 0 N--CA 1.457 -0.097 0 C-N-CA 124.691 1.196 . . . . 1.82 111.256 -175.579 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.9 tt -51.29 -38.72 54.4 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 125.302 1.441 . . . . 4.39 110.838 177.428 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 13.0 tt0 -89.18 -43.54 10.94 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 117.725 0.238 . . . . 2.91 110.807 -177.328 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -69.15 -34.74 75.46 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 117.865 0.302 . . . . 3.16 111.104 -175.528 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 19.6 t -108.29 52.62 0.71 Allowed 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 125.303 1.441 . . . . 3.19 109.462 175.416 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 5.8 ttt-85 -92.41 -46.92 7.43 Favored 'General case' 0 C--O 1.231 0.112 0 C-N-CA 123.426 0.69 . . . . 5.32 109.516 179.027 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -62.72 148.67 90.89 Favored Pre-proline 0 CA--C 1.537 0.471 0 C-N-CA 125.523 1.529 . . . . 2.81 109.483 178.665 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -67.83 138.58 45.12 Favored 'Trans proline' 0 N--CA 1.451 -1.022 0 C-N-CA 122.123 1.882 . . . . 1.54 111.386 -175.364 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 64.48 25.58 13.31 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 126.165 1.786 . . . . 2.36 111.695 170.78 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 8.6 m -91.53 -13.62 31.78 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 124.558 1.143 . . . . 2.54 111.574 -179.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 3.4 t80 -54.51 120.6 6.89 Favored 'General case' 0 CA--C 1.534 0.339 0 O-C-N 121.635 -0.666 . . . . 5.66 111.325 179.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -119.43 155.37 54.11 Favored Pre-proline 0 CA--C 1.537 0.477 0 C-N-CA 125.393 1.477 . . . . 2.42 109.665 169.674 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -67.19 -82.21 0.01 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.706 0 C-N-CA 123.736 2.958 . . . . 1.29 112.083 -176.085 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 47.1 mt-30 -49.31 -45.64 45.61 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 124.584 1.154 . . . . 2.76 111.189 -176.481 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -39.41 -68.2 0.18 Allowed 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 125.111 1.364 . . . . 3.3 110.004 166.963 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 25.2 t80 -65.05 -38.21 90.1 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 122.421 0.288 . . . . 4.56 111.291 -174.764 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 9.0 m-30 -57.41 -43.0 83.37 Favored 'General case' 0 CA--C 1.53 0.189 0 O-C-N 121.345 -0.847 . . . . 6.15 110.323 179.001 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -69.73 -52.45 25.31 Favored 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 109.481 -0.563 . . . . 2.74 109.481 174.643 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -63.64 -26.72 68.8 Favored 'General case' 0 N--CA 1.446 -0.63 0 C-N-CA 123.033 0.533 . . . . 1.6 111.559 -170.141 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 25.8 t -93.42 1.14 56.97 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 125.488 1.515 . . . . 2.41 111.787 178.623 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 88.79 -11.46 68.75 Favored Glycine 0 C--N 1.337 0.632 0 C-N-CA 124.276 0.941 . . . . 1.35 111.288 171.398 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 52.8 mt -65.15 -38.17 89.72 Favored 'General case' 0 N--CA 1.44 -0.936 0 C-N-CA 124.578 1.151 . . . . 2.26 111.367 -167.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 46.0 m -70.13 -20.6 63.16 Favored 'General case' 0 N--CA 1.461 0.106 0 CA-C-N 118.524 0.602 . . . . 3.43 111.954 174.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 13.2 tttt -86.65 -38.04 17.44 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 108.678 -0.86 . . . . 4.91 108.678 -178.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 31.1 mmt -58.87 131.47 51.08 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-O 121.588 0.709 . . . . 3.95 109.625 169.331 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -68.63 158.47 34.0 Favored 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 108.659 -0.867 . . . . 2.9 108.659 179.575 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -41.82 -42.58 2.71 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 124.407 1.083 . . . . 2.13 112.408 177.606 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -52.34 -55.11 23.71 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.523 0.729 . . . . 3.45 111.535 174.707 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 16.9 mm100 -69.0 -39.1 79.52 Favored 'General case' 0 N--CA 1.454 -0.234 0 O-C-N 122.04 -0.413 . . . . 2.89 110.426 -177.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 94.2 t -59.1 -41.14 82.65 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 O-C-N 121.568 -0.707 . . . . 1.71 109.408 175.736 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 83.2 tttt -64.47 -40.21 95.26 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.21 0.604 . . . . 3.17 111.023 175.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -57.5 -64.65 0.82 Allowed 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 118.759 0.709 . . . . 3.23 110.513 173.164 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 14.9 m -53.61 -45.27 59.64 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.306 0 N-CA-C 110.32 -0.252 . . . . 1.95 110.32 -175.71 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 14.6 t80 -40.96 -44.83 2.43 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 125.16 1.384 . . . . 6.19 112.72 172.67 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 47.4 mtp180 -58.63 -30.34 67.21 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 119.107 0.867 . . . . 3.49 112.071 -178.046 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -79.0 -38.07 37.6 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 123.291 0.636 . . . . 5.46 109.509 -178.559 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 4.1 mp -66.72 176.14 0.44 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.939 0 C-N-CA 124.319 1.048 . . . . 2.63 108.398 168.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 18.5 t70 73.67 -51.05 0.7 Allowed 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 127.199 2.2 . . . . 3.86 111.209 -174.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 7.1 t30 77.51 -42.09 0.38 Allowed 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 125.442 1.497 . . . . 1.85 112.581 175.456 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 86.1 m-20 -48.48 -52.32 22.94 Favored 'General case' 0 C--N 1.342 0.242 0 N-CA-C 108.237 -1.023 . . . . 3.14 108.237 165.302 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 91.88 -1.88 0.17 Allowed 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 128.817 2.847 . . . . 4.33 110.477 -164.565 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 95.5 p -46.75 -41.86 15.89 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 126.936 2.094 . . . . 2.25 111.309 168.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 87.3 -14.16 58.31 Favored Glycine 0 CA--C 1.528 0.892 0 C-N-CA 123.747 0.689 . . . . 2.66 113.073 -174.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 33.6 m-85 -76.86 100.75 5.63 Favored 'General case' 0 CA--C 1.511 -0.524 0 N-CA-C 107.064 -1.458 . . . . 3.61 107.064 165.113 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 8.6 mp -68.87 87.93 0.37 Allowed 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 106.137 -1.801 . . . . 3.86 106.137 163.012 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -67.28 152.18 46.18 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.133 1.373 . . . . 1.47 108.415 168.015 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -46.4 -53.83 10.27 Favored 'General case' 0 CA--C 1.535 0.374 0 O-C-N 121.229 -0.919 . . . . 3.76 112.973 -173.192 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -55.38 -27.7 49.2 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.256 0.622 . . . . 3.17 112.509 179.739 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 64.9 mt-10 -75.18 -29.29 60.34 Favored 'General case' 0 C--N 1.33 -0.268 0 O-C-N 120.083 -1.635 . . . . 2.44 111.074 177.376 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 17.4 mt -66.42 -20.65 66.11 Favored 'General case' 0 N--CA 1.449 -0.476 0 O-C-N 121.82 -0.55 . . . . 3.44 110.498 173.165 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 26.6 ttpt -63.52 -6.83 5.63 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.299 0.64 . . . . 2.99 111.843 168.054 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 20.6 p90 -135.33 31.37 3.18 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 120.061 1.3 . . . . 6.6 112.561 169.306 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -50.92 -70.45 0.08 Allowed 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 123.567 0.747 . . . . 3.45 112.304 -178.327 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 2.4 tp -77.94 -20.47 52.71 Favored 'General case' 0 CA--C 1.533 0.318 0 O-C-N 121.059 -1.026 . . . . 3.78 111.63 -179.8 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.07 -13.09 10.05 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.638 1.175 . . . . 2.71 111.111 175.684 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.56 -34.11 77.17 Favored 'General case' 0 N--CA 1.449 -0.479 0 O-C-N 120.996 -1.065 . . . . 3.71 111.991 170.413 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -90.62 -61.86 1.58 Allowed 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 108.06 -1.089 . . . . 8.68 108.06 178.09 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -104.1 -176.65 3.14 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 124.467 1.107 . . . . 3.58 108.418 -170.368 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 66.3 m -124.55 -15.57 6.55 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 119.639 1.109 . . . . 3.16 113.686 -177.801 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -131.72 39.34 1.78 Allowed Glycine 0 CA--C 1.525 0.681 0 C-N-CA 125.151 1.358 . . . . 1.75 111.007 -176.256 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -74.9 -134.51 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.183 0.993 . . . . 2.02 110.286 173.839 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . 0.414 ' HE ' ' CD ' ' A' ' 82' ' ' GLU . 5.4 tpt85 -124.47 -4.14 7.8 Favored 'General case' 0 CA--C 1.534 0.362 0 O-C-N 121.028 -1.045 . . . . 5.1 113.028 -168.057 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -57.18 -23.52 48.17 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.274 1.03 . . . . 3.12 112.956 -163.177 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.488 ' H ' ' CD2' ' A' ' 78' ' ' LEU . 0.0 OUTLIER -56.07 -42.19 76.27 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 125.104 1.362 . . . . 2.02 111.834 173.31 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 90.6 m -71.78 102.44 2.84 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 121.599 0.714 . . . . 2.03 110.258 -176.127 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -52.35 -42.1 63.62 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 114.663 -1.153 . . . . 3.09 111.754 -179.278 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 65.7 m -57.76 -40.64 80.25 Favored 'General case' 0 CA--C 1.531 0.23 0 O-C-N 121.342 -0.849 . . . . 1.42 112.308 177.331 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.414 ' CD ' ' HE ' ' A' ' 76' ' ' ARG . 46.6 mt-10 -79.39 -45.77 18.87 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 108.634 -0.876 . . . . 2.69 108.634 -172.705 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -47.79 -55.18 10.24 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-O 121.144 0.497 . . . . 1.71 110.136 167.658 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 27.4 pttt -71.54 -22.27 61.79 Favored 'General case' 0 C--O 1.217 -0.642 0 CA-C-O 118.535 -0.745 . . . . 6.45 111.132 -172.281 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 15.6 t -60.6 -49.83 75.96 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 119.965 1.257 . . . . 2.33 109.073 169.084 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.7 tt -58.16 -54.4 47.41 Favored 'General case' 0 C--N 1.342 0.256 0 N-CA-C 109.404 -0.591 . . . . 3.89 109.404 174.15 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 25.2 ttp -48.21 -52.54 20.54 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 121.046 0.451 . . . . 3.53 111.853 178.717 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -55.01 -40.62 70.36 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 126.293 1.837 . . . . 1.48 111.749 -169.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -92.41 -40.35 10.93 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 122.369 0.267 . . . . 1.34 111.701 -178.828 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -58.23 -40.39 81.58 Favored 'General case' 0 C--N 1.339 0.119 0 CA-C-N 118.123 0.42 . . . . 1.57 110.533 176.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -70.18 120.68 16.22 Favored 'General case' 0 N--CA 1.444 -0.768 0 N-CA-C 108.469 -0.938 . . . . 1.02 108.469 174.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 9.2 m-80 -106.53 12.78 29.14 Favored 'General case' 0 C--N 1.331 -0.21 0 C-N-CA 122.794 0.438 . . . . 3.16 111.152 -179.602 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 38.1 m-20 -99.1 -39.25 8.59 Favored 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 122.987 0.515 . . . . 1.38 109.901 178.09 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 86.09 38.98 8.18 Favored Glycine 0 CA--C 1.529 0.907 0 N-CA-C 108.753 -1.739 . . . . 0.82 108.753 -156.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -119.87 -58.77 1.86 Allowed 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 117.795 0.797 . . . . 2.47 111.089 -178.991 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 126.77 -38.93 2.07 Favored Glycine 0 CA--C 1.528 0.889 0 C-N-CA 124.171 0.891 . . . . 0.66 111.506 178.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 31.6 mmtp -60.81 117.25 5.17 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 108.141 -1.059 . . . . 4.75 108.141 173.798 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 6.8 mt -108.66 113.8 45.02 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.09 0 N-CA-C 109.317 -0.623 . . . . 1.54 109.317 -178.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -75.96 170.42 54.71 Favored Glycine 0 CA--C 1.53 1.015 0 N-CA-C 110.879 -0.888 . . . . 0.72 110.879 170.6 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -55.34 -42.39 73.77 Favored 'General case' 0 CA--C 1.515 -0.372 0 O-C-N 122.234 -0.568 . . . . 1.8 109.672 173.104 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.16 -63.54 1.26 Allowed 'General case' 0 N--CA 1.447 -0.576 0 O-C-N 124.264 0.977 . . . . 2.75 108.822 -177.057 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -42.25 -52.59 4.4 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.787 0.835 . . . . 1.35 111.769 173.139 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 42.3 t80 -59.76 -56.37 22.7 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-O 121.267 0.556 . . . . 4.79 110.603 -176.625 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -61.57 -37.91 85.6 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 124.764 1.226 . . . . 3.89 110.89 -176.264 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -54.61 -62.98 1.3 Allowed 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 119.411 1.005 . . . . 3.77 109.155 172.095 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 1.7 tpt -63.59 -37.59 87.89 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 120.622 -0.431 . . . . 4.52 111.417 -171.685 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 49.7 t -62.74 -48.21 89.24 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.22 0 C-N-CA 123.063 0.545 . . . . 1.84 110.886 174.024 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 83.9 t60 -67.83 -30.82 70.31 Favored 'General case' 0 N--CA 1.456 -0.141 0 C-N-CA 123.371 0.668 . . . . 3.01 110.55 -173.435 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 5.1 t . . . . . 0 C--O 1.251 1.159 0 C-N-CA 125.962 1.705 . . . . 2.95 112.141 177.694 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.3 ptm . . . . . 0 N--CA 1.477 0.921 0 N-CA-C 112.929 0.714 . . . . 8.37 112.929 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.6 m -174.08 -56.47 0.01 OUTLIER 'General case' 0 C--O 1.223 -0.325 0 C-N-CA 125.066 1.346 . . . . 2.75 107.973 177.494 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.5 pp -92.5 -38.17 9.77 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.224 0 CA-C-O 121.397 0.618 . . . . 1.98 111.139 179.333 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 62.8 p -58.12 -56.27 24.26 Favored 'General case' 0 N--CA 1.439 -1.004 0 C-N-CA 123.881 0.872 . . . . 4.5 108.81 -178.085 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 38.5 t0 -80.99 45.33 0.82 Allowed 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.929 2.091 . . . . 2.43 111.4 -169.73 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 73.9 t -143.46 -57.59 0.16 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.14 0 C-N-CA 126.832 2.053 . . . . 2.85 107.77 -178.085 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 4.2 tp -166.25 -56.11 0.03 OUTLIER 'General case' 0 C--N 1.334 -0.093 0 N-CA-C 106.302 -1.74 . . . . 2.16 106.302 -176.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -45.9 -23.57 0.3 Allowed 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 127.631 2.372 . . . . 2.55 115.496 -165.313 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -49.66 -47.57 49.95 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 119.558 1.072 . . . . 1.97 111.525 170.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -63.81 -39.81 95.13 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-O 122.449 1.119 . . . . 1.79 109.725 -179.414 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -72.76 -42.58 63.86 Favored 'General case' 0 N--CA 1.443 -0.792 0 C-N-CA 123.714 0.806 . . . . 2.44 109.987 -173.271 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 29.0 pt -61.92 -41.43 90.83 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.769 0 O-C-N 121.224 -0.923 . . . . 2.35 110.249 172.707 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.25 -46.53 76.07 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 118.947 0.794 . . . . 1.8 111.129 173.062 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -57.04 -59.14 5.5 Favored 'General case' 0 CA--C 1.536 0.41 0 O-C-N 121.617 -0.677 . . . . 1.61 110.837 174.046 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -46.11 -43.58 14.92 Favored 'General case' 0 CA--C 1.528 0.132 0 C-N-CA 125.633 1.573 . . . . 1.81 111.484 178.717 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 39.5 tp -60.26 -40.56 90.76 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 123.833 0.853 . . . . 3.65 110.508 -176.622 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 18.2 tt0 -87.91 -40.1 14.23 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 110.3 -0.259 . . . . 3.28 110.3 -173.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.4 pp20? -68.11 -49.19 62.7 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 109.232 -0.655 . . . . 3.4 109.232 -179.392 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -86.4 46.88 1.39 Allowed 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 124.543 1.137 . . . . 3.59 108.855 -179.608 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 61.1 ttt180 -87.29 -56.42 3.38 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 108.458 -0.941 . . . . 4.9 108.458 -176.351 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -55.13 131.35 68.62 Favored Pre-proline 0 N--CA 1.449 -0.508 0 CA-C-O 118.657 -0.687 . . . . 2.32 109.47 176.381 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -62.78 150.1 89.21 Favored 'Trans proline' 0 N--CA 1.453 -0.895 0 C-N-CA 122.443 2.095 . . . . 1.25 110.304 -173.813 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 66.99 3.78 3.27 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.902 1.681 . . . . 2.99 113.367 174.62 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 12.5 m -77.9 -7.74 57.14 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 120.783 -1.198 . . . . 1.76 111.981 -176.519 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 41.3 t80 -68.48 113.68 6.23 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 121.429 -0.794 . . . . 6.0 111.927 -173.114 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -102.87 155.61 36.35 Favored Pre-proline 0 CA--C 1.542 0.65 0 C-N-CA 125.396 1.478 . . . . 2.74 111.035 166.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.36 -71.8 0.02 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.531 0 C-N-CA 124.47 3.446 . . . . 0.96 112.575 -175.114 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 35.1 mt-30 -52.94 -46.35 68.08 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 123.734 0.814 . . . . 2.65 110.567 -178.428 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -44.56 -67.39 0.29 Allowed 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 124.931 1.292 . . . . 4.62 108.349 170.182 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 51.1 t80 -48.95 -52.96 21.83 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-O 118.635 -0.697 . . . . 4.14 111.768 178.47 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 16.9 m-85 -52.11 -45.46 64.9 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 119.486 1.039 . . . . 6.05 111.698 -176.441 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -72.87 -42.84 63.23 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 119.704 -0.798 . . . . 3.1 110.293 179.265 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -61.31 -36.28 79.69 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 123.357 0.663 . . . . 1.51 111.716 -178.517 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 57.7 p -83.03 -0.12 47.45 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 124.245 1.018 . . . . 2.87 111.206 178.848 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 82.19 -8.58 60.44 Favored Glycine 0 C--N 1.337 0.636 0 N-CA-C 110.773 -0.931 . . . . 1.04 110.773 176.363 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 75.0 mt -59.39 -38.03 79.5 Favored 'General case' 0 N--CA 1.442 -0.855 0 C-N-CA 124.456 1.102 . . . . 2.19 111.212 -174.381 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 21.3 m -71.45 -23.14 61.78 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 118.663 0.665 . . . . 3.26 112.057 176.352 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 6.8 ttpt -83.87 -36.36 23.47 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 109.124 -0.695 . . . . 5.24 109.124 179.008 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 14.2 mmt -59.95 135.72 57.79 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-O 121.631 0.729 . . . . 3.28 110.445 173.21 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 69.5 m -63.58 152.45 38.74 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 116.082 -0.508 . . . . 2.47 110.382 174.458 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -39.51 -40.76 0.9 Allowed 'General case' 0 C--O 1.224 -0.246 0 C-N-CA 125.674 1.59 . . . . 2.04 111.976 172.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 67.7 m-20 -52.33 -56.16 16.73 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.632 1.173 . . . . 2.12 111.45 176.103 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -72.65 -38.87 67.54 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 108.98 -0.748 . . . . 3.86 108.98 -174.922 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.422 ' CG1' ' CZ ' ' A' ' 48' ' ' PHE . 52.7 t -58.52 -47.77 87.39 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 CA-C-O 121.342 0.591 . . . . 1.64 109.557 175.565 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -55.58 -48.97 73.95 Favored 'General case' 0 N--CA 1.453 -0.291 0 O-C-N 121.228 -0.92 . . . . 3.65 109.952 173.84 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -57.31 -51.13 70.63 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 120.224 -0.59 . . . . 2.99 111.294 179.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 3.7 m -55.19 -42.14 64.17 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 O-C-N 121.785 -0.572 . . . . 1.82 110.484 178.186 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.484 ' CZ ' ' HB3' ' A' ' 103' ' ' PHE . 17.3 m-30 -54.34 -34.42 61.03 Favored 'General case' 0 C--N 1.341 0.217 0 N-CA-C 113.027 0.751 . . . . 7.4 113.027 174.746 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 81.2 mtp180 -61.58 -40.53 95.09 Favored 'General case' 0 CA--C 1.529 0.154 0 CA-C-N 119.506 1.048 . . . . 5.15 109.975 174.882 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -64.5 -43.56 93.72 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 109.36 -0.607 . . . . 5.44 109.36 176.23 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 27.9 mm -58.09 -54.91 25.92 Favored 'Isoleucine or valine' 0 C--O 1.237 0.401 0 CA-C-O 118.799 -0.62 . . . . 2.82 110.874 177.64 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -75.89 64.19 1.81 Allowed 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 124.821 1.248 . . . . 1.92 109.326 -173.179 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 31.6 t30 -55.27 -32.83 62.68 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 125.869 1.668 . . . . 1.87 111.942 -174.139 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 16.6 p-10 -74.5 -29.05 61.26 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.947 1.699 . . . . 2.36 111.977 175.163 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 8.7 mt-30 57.31 60.64 2.83 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 125.285 1.434 . . . . 2.92 110.859 -173.152 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 79.1 p -89.34 -46.02 9.06 Favored 'General case' 0 C--N 1.337 0.048 0 C-N-CA 123.858 0.863 . . . . 1.9 111.134 174.193 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 113.47 -18.87 20.06 Favored Glycine 0 CA--C 1.531 1.066 0 C-N-CA 123.912 0.768 . . . . 1.49 111.42 -164.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 77.9 m-85 -118.48 142.8 47.22 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 124.073 0.949 . . . . 3.81 110.076 178.324 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -104.01 70.3 0.99 Allowed 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 124.648 1.179 . . . . 4.23 108.695 173.352 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -56.29 158.5 4.13 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.584 1.553 . . . . 2.04 111.472 176.931 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 54.9 mt-10 -43.67 -56.29 3.85 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 125.029 1.332 . . . . 3.41 113.633 -175.728 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 16.3 tt0 -62.88 -25.64 68.39 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 121.969 -0.457 . . . . 3.08 111.789 -178.633 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -71.02 -41.2 71.18 Favored 'General case' 0 N--CA 1.446 -0.652 0 O-C-N 121.109 -0.994 . . . . 2.81 109.272 175.205 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -53.78 -40.67 66.46 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 122.85 0.46 . . . . 4.05 110.416 172.629 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 21.3 ttpt -53.58 -16.55 1.6 Allowed 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.143 0.977 . . . . 2.84 112.814 174.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 59.5 m-85 -132.8 53.76 1.99 Allowed 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 118.923 0.783 . . . . 5.84 110.368 167.295 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 48.8 t80 -79.21 -75.84 0.23 Allowed 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.98 0.912 . . . . 3.62 109.97 173.787 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 1.7 tp -76.11 -8.91 58.07 Favored 'General case' 0 CA--C 1.542 0.636 0 O-C-N 120.438 -1.414 . . . . 3.39 112.341 -176.776 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 61.1 mm-40 -47.5 -49.43 25.91 Favored 'General case' 0 C--N 1.343 0.289 0 C-N-CA 124.264 1.025 . . . . 2.18 110.886 175.478 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.4 -11.25 14.62 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 112.919 0.711 . . . . 4.38 112.919 -177.958 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 13.4 m-30 -100.96 -60.13 1.58 Allowed 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 124.025 0.93 . . . . 4.92 110.067 178.688 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -101.21 -22.43 14.66 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 112.354 0.502 . . . . 3.51 112.354 -170.256 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 3.4 t 74.97 -50.7 0.67 Allowed 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 125.663 1.585 . . . . 2.99 110.654 -174.385 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -99.99 41.02 2.26 Favored Glycine 0 CA--C 1.526 0.777 0 O-C-N 121.239 -0.913 . . . . 1.68 111.065 179.096 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -80.98 -172.03 3.51 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 117.199 0.499 . . . . 2.05 111.287 179.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -87.84 -7.26 57.49 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 123.427 0.691 . . . . 3.77 112.536 -167.187 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -49.28 -35.55 18.2 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.453 1.501 . . . . 3.18 113.299 -163.426 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -52.08 -44.57 64.41 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.389 1.076 . . . . 1.74 112.025 173.58 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 32.1 m -65.1 107.71 1.62 Allowed 'General case' 0 C--O 1.236 0.366 0 CA-C-O 122.075 0.94 . . . . 1.87 110.294 179.025 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -58.29 -41.58 84.69 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 113.925 -1.489 . . . . 2.94 110.347 -178.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -48.1 -59.13 3.62 Favored 'General case' 0 C--O 1.225 -0.215 0 CA-C-N 118.863 0.756 . . . . 1.77 111.341 176.649 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 14.5 mt-10 -71.7 -42.68 67.08 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 123.795 0.838 . . . . 2.68 109.382 -168.049 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -49.08 -52.73 24.03 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 116.105 -0.498 . . . . 1.66 110.049 168.3 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 15.0 mmmt -69.17 -31.91 70.87 Favored 'General case' 0 C--O 1.22 -0.463 0 C-N-CA 123.402 0.681 . . . . 5.54 111.07 -174.323 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 70.9 m -58.26 -42.82 87.27 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 120.084 1.311 . . . . 1.7 110.644 170.2 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.33 -62.56 1.75 Allowed 'General case' 0 C--O 1.234 0.254 0 N-CA-C 108.397 -0.964 . . . . 3.79 108.397 172.062 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 9.7 ttm -49.27 -48.51 45.84 Favored 'General case' 0 CA--C 1.536 0.418 0 O-C-N 123.666 0.604 . . . . 5.35 112.435 -173.272 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -49.72 -46.04 49.84 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 126.627 1.971 . . . . 1.99 111.955 -178.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -83.63 -49.86 8.77 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 110.433 -0.21 . . . . 2.07 110.433 -177.689 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -54.46 -41.83 69.94 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 122.691 0.396 . . . . 1.71 111.681 -178.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -74.42 81.75 1.92 Allowed 'General case' 0 N--CA 1.446 -0.658 0 CA-C-O 121.352 0.596 . . . . 1.23 110.084 178.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 42.6 p-10 -77.46 49.88 0.76 Allowed 'General case' 0 CA--C 1.536 0.414 0 O-C-N 121.646 -0.659 . . . . 2.68 111.315 176.023 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 34.2 m-20 -137.53 -60.44 0.66 Allowed 'General case' 0 C--N 1.341 0.231 0 C-N-CA 126.356 1.862 . . . . 1.22 109.258 178.595 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 102.26 43.27 2.06 Favored Glycine 0 CA--C 1.533 1.199 0 C-N-CA 125.028 1.299 . . . . 1.08 110.247 -161.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -121.85 -61.53 1.49 Allowed 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.948 1.699 . . . . 1.94 109.552 173.427 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 119.55 -24.13 8.17 Favored Glycine 0 CA--C 1.53 0.975 0 C-N-CA 125.2 1.381 . . . . 0.79 111.28 -179.533 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 41.0 mttt -78.86 103.72 9.0 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 107.673 -1.232 . . . . 5.96 107.673 171.393 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 67.8 mt -94.43 118.92 41.57 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.577 0 N-CA-C 107.794 -1.188 . . . . 2.0 107.794 -176.121 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -72.51 166.87 53.83 Favored Glycine 0 CA--C 1.534 1.244 0 CA-C-O 121.69 0.606 . . . . 0.88 111.835 170.577 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -61.18 -37.15 81.92 Favored 'General case' 0 N--CA 1.456 -0.143 0 O-C-N 121.285 -1.127 . . . . 1.73 110.087 178.058 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 56.0 mt-10 -62.34 -55.81 24.45 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-O 118.686 -0.673 . . . . 2.75 110.552 176.173 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -43.7 -50.3 7.61 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-O 121.829 0.824 . . . . 1.44 110.008 173.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . 0.484 ' HB3' ' CZ ' ' A' ' 48' ' ' PHE . 0.8 OUTLIER -61.3 -54.2 47.0 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 112.868 0.692 . . . . 5.43 112.868 177.867 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 18.7 tt0 -53.66 -49.88 66.99 Favored 'General case' 0 C--O 1.223 -0.308 0 C-N-CA 124.55 1.14 . . . . 3.49 108.756 -178.714 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 65.4 mt-10 -48.99 -58.23 5.23 Favored 'General case' 0 C--O 1.232 0.165 0 C-N-CA 123.952 0.901 . . . . 3.46 110.064 176.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.3 -47.86 84.02 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 120.776 -0.37 . . . . 4.32 111.193 -175.518 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 37.4 t -58.67 -44.95 90.9 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.193 0 C-N-CA 122.974 0.509 . . . . 1.57 111.393 178.444 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 63.4 t60 -62.88 -30.08 71.24 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 125.65 1.58 . . . . 3.66 110.179 -173.268 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 2.9 t . . . . . 0 C--O 1.251 1.154 0 CA-C-O 116.848 -1.549 . . . . 2.77 111.701 -177.195 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.411 ' N ' ' OD2' ' A' ' 5' ' ' ASP . 12.6 ptm . . . . . 0 N--CA 1.473 0.704 0 N-CA-C 113.793 1.034 . . . . 9.16 113.793 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.0 m -136.05 -88.86 0.31 Allowed 'General case' 0 C--O 1.224 -0.241 0 N-CA-C 109.674 -0.491 . . . . 3.01 109.674 -174.477 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.2 pp -105.45 -25.05 3.8 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.157 0 CA-C-O 121.641 0.734 . . . . 2.5 110.035 -175.426 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 9.9 t -74.12 7.78 2.51 Favored 'General case' 0 N--CA 1.436 -1.173 0 C-N-CA 126.574 1.95 . . . . 2.86 111.056 -174.486 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.411 ' OD2' ' N ' ' A' ' 1' ' ' MET . 11.1 t70 -168.38 45.84 0.04 OUTLIER 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 126.54 1.936 . . . . 3.62 105.804 -158.493 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -148.13 -50.83 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.529 0.152 0 CA-C-N 115.38 -0.827 . . . . 3.08 110.879 179.849 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 177.98 -56.1 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 105.945 -1.872 . . . . 2.19 105.945 -172.81 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 8.4 m -44.39 -32.92 1.49 Allowed 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 126.243 1.817 . . . . 1.63 115.393 -172.344 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -49.53 -43.9 46.02 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 119.489 1.041 . . . . 1.84 112.941 175.349 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 42.9 t0 -72.34 -39.24 68.28 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 122.725 1.25 . . . . 2.04 109.751 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 43.9 m-20 -62.16 -44.99 95.38 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 123.581 0.752 . . . . 2.51 110.276 -178.213 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 39.0 pt -62.83 -40.94 90.65 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.196 0 CA-C-O 118.231 -0.89 . . . . 1.99 110.13 177.479 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -52.36 -47.74 65.96 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 119.291 0.95 . . . . 1.83 111.043 174.538 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -54.17 -60.78 2.88 Favored 'General case' 0 CA--C 1.529 0.162 0 O-C-N 122.334 -0.229 . . . . 1.8 111.083 173.173 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -50.98 -48.63 61.15 Favored 'General case' 0 C--O 1.233 0.222 0 C-N-CA 123.269 0.628 . . . . 1.86 112.09 -177.77 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -48.73 -50.03 35.48 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 125.203 1.401 . . . . 5.02 110.053 178.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -79.23 -46.96 16.81 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 120.033 -0.667 . . . . 3.06 109.484 -174.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 43.9 tp10 -45.81 -50.4 14.16 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 124.507 1.123 . . . . 4.27 110.662 178.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 76.2 m -105.94 46.91 0.9 Allowed 'General case' 0 C--O 1.236 0.361 0 C-N-CA 123.053 0.541 . . . . 2.21 110.242 -178.078 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.24 -43.28 82.32 Favored 'General case' 0 C--N 1.343 0.322 0 CA-C-O 121.798 0.809 . . . . 7.99 109.078 -179.699 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -67.35 134.92 93.19 Favored Pre-proline 0 N--CA 1.442 -0.846 0 C-N-CA 125.885 1.674 . . . . 2.32 109.404 -173.223 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -63.76 148.31 92.09 Favored 'Trans proline' 0 N--CA 1.456 -0.705 0 C-N-CA 122.835 2.356 . . . . 1.29 112.01 -171.35 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 9.5 t70 69.27 -0.15 2.63 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 127.608 2.363 . . . . 3.68 113.639 179.172 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 14.9 m -77.55 -21.03 53.21 Favored 'General case' 0 C--N 1.341 0.215 0 N-CA-C 114.099 1.148 . . . . 2.22 114.099 -175.45 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -75.27 90.9 2.62 Favored 'General case' 0 CA--C 1.539 0.538 0 O-C-N 121.42 -0.8 . . . . 5.18 111.61 -165.063 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -77.48 155.11 81.61 Favored Pre-proline 0 CA--C 1.535 0.396 0 O-C-N 121.717 -0.614 . . . . 2.75 110.453 175.264 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -71.57 -67.23 0.03 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.108 0 C-N-CA 122.987 2.458 . . . . 0.92 111.804 -176.271 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 71.5 mt-30 -53.54 -44.6 69.34 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 118.565 0.62 . . . . 2.55 110.487 179.503 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 25.3 tptt -43.84 -62.29 1.16 Allowed 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.429 1.091 . . . . 3.72 110.062 169.105 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 16.0 t80 -53.6 -51.54 62.7 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.13 0.572 . . . . 4.23 111.406 179.025 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 7.4 m-30 -58.08 -34.69 70.42 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 121.593 -0.692 . . . . 6.34 111.576 -176.8 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 12.9 tt0 -73.58 -57.57 3.9 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 108.616 -0.883 . . . . 3.61 108.616 175.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -54.51 -38.03 66.03 Favored 'General case' 0 N--CA 1.444 -0.76 0 C-N-CA 124.829 1.252 . . . . 1.76 110.631 -172.605 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 69.2 m -88.6 1.78 54.34 Favored 'General case' 0 N--CA 1.445 -0.72 0 N-CA-C 112.926 0.713 . . . . 3.06 112.926 -177.165 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 76.83 -15.35 6.27 Favored Glycine 0 CA--C 1.532 1.147 0 O-C-N 119.951 -1.718 . . . . 1.48 112.836 172.295 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 94.2 mt -45.01 -35.24 2.82 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 127.445 2.298 . . . . 2.48 112.434 170.527 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 9.1 t -60.57 -37.99 83.11 Favored 'General case' 0 CA--C 1.529 0.157 0 O-C-N 121.683 -0.636 . . . . 2.59 110.57 176.281 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 29.1 tttp -89.45 -30.38 18.35 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-O 118.857 -0.592 . . . . 5.55 111.235 -174.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -31.73 -67.31 0.1 Allowed 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 125.852 1.661 . . . . 3.33 113.303 -174.545 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 26.1 m 135.34 143.97 0.0 OUTLIER 'General case' 0 C--O 1.234 0.242 0 C-N-CA 130.433 3.493 . . . . 2.44 106.719 -177.442 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -42.61 -41.9 3.23 Favored 'General case' 0 C--O 1.226 -0.179 0 C-N-CA 124.668 1.187 . . . . 1.66 111.393 175.485 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 50.2 m-20 -58.94 -57.74 11.73 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 123.616 0.766 . . . . 2.24 110.006 -176.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 3.4 mm-40 -62.42 -53.88 48.43 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 109.328 -0.619 . . . . 2.98 109.328 -178.353 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 70.0 t -49.62 -46.2 20.88 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.724 0 CA-C-O 121.664 0.745 . . . . 2.17 111.192 177.737 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -63.17 -46.22 88.14 Favored 'General case' 0 N--CA 1.452 -0.37 0 O-C-N 120.61 -1.306 . . . . 4.68 111.419 177.927 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -55.69 -52.03 65.27 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 118.191 0.451 . . . . 2.99 110.878 175.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 3.4 m -56.21 -42.94 74.98 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 C-N-CA 120.516 -0.474 . . . . 1.94 109.885 177.687 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 25.3 m-85 -60.49 -39.37 87.47 Favored 'General case' 0 C--N 1.342 0.253 0 CA-C-N 119.055 0.843 . . . . 8.07 112.35 176.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 43.5 mtp180 -58.49 -43.02 88.85 Favored 'General case' 0 C--N 1.339 0.111 0 CA-C-N 119.287 0.949 . . . . 4.21 110.918 171.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 27.3 t80 -58.98 -44.62 91.59 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 118.197 0.453 . . . . 5.47 110.249 177.619 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.6 mp -58.68 -49.34 82.98 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 CA-C-O 118.088 -0.958 . . . . 2.93 112.061 174.461 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 45.1 t0 -69.91 70.02 0.33 Allowed 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.275 1.03 . . . . 1.79 109.567 -175.259 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 20.3 t30 -61.81 -38.43 88.1 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 126.849 2.06 . . . . 1.8 111.958 -165.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -69.74 -25.48 63.85 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 125.471 1.509 . . . . 2.32 111.559 171.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 4.9 mt-30 65.2 36.08 7.37 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 125.693 1.597 . . . . 2.81 113.036 -179.703 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 70.9 p -57.8 -31.88 67.0 Favored 'General case' 0 CA--C 1.534 0.341 0 O-C-N 121.373 -0.829 . . . . 2.3 112.3 169.421 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 88.51 37.43 7.53 Favored Glycine 0 CA--C 1.526 0.772 0 N-CA-C 109.011 -1.636 . . . . 1.41 109.011 -164.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 11.8 m-85 -164.74 135.83 4.18 Favored 'General case' 0 CA--C 1.516 -0.356 0 C-N-CA 125.273 1.429 . . . . 4.01 108.796 -177.269 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -86.19 78.01 9.45 Favored 'General case' 0 N--CA 1.443 -0.786 0 N-CA-C 107.511 -1.292 . . . . 3.23 107.511 167.358 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -69.55 157.66 36.74 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 114.336 -1.302 . . . . 1.65 110.199 177.093 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -53.14 -51.51 61.71 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.422 1.089 . . . . 4.56 112.969 -168.281 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.9 tm-20 -59.92 -47.89 83.92 Favored 'General case' 0 CA--C 1.531 0.228 0 N-CA-C 109.719 -0.474 . . . . 4.04 109.719 -173.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -56.69 -36.26 69.41 Favored 'General case' 0 C--N 1.332 -0.18 0 C-N-CA 123.399 0.679 . . . . 2.38 111.219 177.611 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 7.0 tp -55.74 -34.68 65.4 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 122.496 0.318 . . . . 3.67 110.546 176.719 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 31.1 ttpt -62.73 -10.82 14.07 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.881 1.272 . . . . 2.86 112.761 174.252 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -124.85 18.99 8.56 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 126.089 1.756 . . . . 6.31 110.561 175.21 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 83.3 t80 -52.2 -70.99 0.07 Allowed 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.391 1.077 . . . . 3.44 111.689 -172.797 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.56 -19.24 62.18 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.495 0.718 . . . . 4.49 109.53 -176.597 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . 0.405 HE21 ' CD ' ' A' ' 77' ' ' GLU . 1.3 tt0 -71.31 1.52 6.06 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 126.608 1.963 . . . . 3.06 113.09 178.459 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.75 -32.06 59.83 Favored 'General case' 0 CA--C 1.529 0.156 0 O-C-N 121.308 -0.87 . . . . 4.1 110.496 159.817 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 4.4 m-30 -93.43 -58.74 2.2 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 124.289 1.036 . . . . 4.52 108.845 -174.228 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -96.01 -170.95 2.21 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 124.804 1.242 . . . . 2.92 107.898 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 23.8 m -136.35 48.68 2.13 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 123.603 0.761 . . . . 3.16 110.271 175.516 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 141.61 60.88 0.03 OUTLIER Glycine 0 C--N 1.336 0.554 0 N-CA-C 109.92 -1.272 . . . . 1.99 109.92 -178.594 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -89.17 -98.82 0.09 Allowed 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.038 0.535 . . . . 2.01 109.994 179.674 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -144.07 24.53 1.63 Allowed 'General case' 0 CA--C 1.528 0.12 0 CA-C-O 121.682 0.753 . . . . 4.58 111.51 -179.396 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.405 ' CD ' HE21 ' A' ' 69' ' ' GLN . 5.2 mp0 -72.29 -36.07 68.85 Favored 'General case' 0 N--CA 1.445 -0.717 0 C-N-CA 125.229 1.412 . . . . 4.69 108.7 -172.052 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -51.77 -56.48 13.6 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 126.305 1.842 . . . . 1.81 111.434 178.74 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 58.9 m -59.89 114.44 2.81 Favored 'General case' 0 C--N 1.341 0.231 0 N-CA-C 110.021 -0.363 . . . . 2.1 110.021 -173.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -64.97 -44.68 88.53 Favored 'General case' 0 N--CA 1.447 -0.609 0 N-CA-C 109.825 -0.435 . . . . 3.39 109.825 -176.149 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.5 m -50.9 -59.69 3.86 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 123.815 0.846 . . . . 1.74 110.374 177.058 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.93 -49.38 71.47 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 123.8 0.84 . . . . 2.8 110.737 178.98 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -58.83 -39.19 80.51 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 120.125 -0.63 . . . . 1.83 109.594 179.757 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 90.3 mttt -69.42 -27.61 65.42 Favored 'General case' 0 C--O 1.219 -0.51 0 C-N-CA 124.054 0.942 . . . . 5.5 111.388 177.81 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 14.6 m -58.36 -46.15 86.85 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 120.183 1.356 . . . . 1.67 109.907 169.806 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.3 mp -61.01 -59.79 4.82 Favored 'General case' 0 C--O 1.233 0.226 0 N-CA-C 109.829 -0.434 . . . . 4.19 109.829 170.077 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 29.8 ttp -46.09 -53.8 9.67 Favored 'General case' 0 C--O 1.221 -0.431 0 C-N-CA 123.06 0.544 . . . . 3.62 111.592 -175.209 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -47.41 -64.11 0.87 Allowed 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 127.456 2.302 . . . . 1.79 110.741 -174.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -65.07 -53.11 50.71 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 116.348 -0.387 . . . . 1.38 110.037 179.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -50.41 -39.29 46.78 Favored 'General case' 0 C--O 1.226 -0.143 0 N-CA-C 111.769 0.285 . . . . 1.72 111.769 -176.131 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -72.28 -58.33 3.49 Favored 'General case' 0 N--CA 1.445 -0.719 0 C-N-CA 124.124 0.97 . . . . 2.42 110.333 178.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 46.31 25.61 0.38 Allowed 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.344 1.458 . . . . 4.14 114.837 -175.039 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 69.2 m-20 -112.23 -45.16 3.31 Favored 'General case' 0 N--CA 1.463 0.192 0 C-N-CA 123.752 0.821 . . . . 1.85 109.452 177.178 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 97.68 39.81 3.79 Favored Glycine 0 CA--C 1.53 0.971 0 C-N-CA 125.681 1.61 . . . . 1.39 109.48 -161.792 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -127.39 -47.29 1.45 Allowed 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 118.386 1.093 . . . . 1.77 111.856 174.505 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 109.27 -27.89 11.87 Favored Glycine 0 CA--C 1.527 0.841 0 C-N-CA 124.175 0.893 . . . . 0.73 112.347 172.089 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 23.7 mttt -78.9 131.43 36.4 Favored 'General case' 0 C--O 1.241 0.642 0 N-CA-C 107.986 -1.116 . . . . 4.98 107.986 174.08 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 10.6 mt -123.8 106.14 16.62 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.457 0 C-N-CA 124.659 1.183 . . . . 1.96 108.426 -166.416 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -62.68 161.0 32.45 Favored Glycine 0 CA--C 1.53 0.981 0 N-CA-C 110.159 -1.176 . . . . 0.89 110.159 168.082 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -58.88 -37.08 75.75 Favored 'General case' 0 N--CA 1.453 -0.284 0 O-C-N 121.604 -0.939 . . . . 2.08 109.81 177.068 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 61.5 mt-10 -66.13 -47.89 72.6 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 122.947 0.499 . . . . 3.79 111.431 -179.594 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -47.88 -53.51 15.52 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 121.853 0.835 . . . . 1.95 109.632 170.495 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -66.92 -44.38 80.89 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 116.113 -0.494 . . . . 4.33 111.201 -173.285 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 10.1 tt0 -51.96 -54.38 30.28 Favored 'General case' 0 C--O 1.221 -0.439 0 C-N-CA 125.157 1.383 . . . . 3.2 109.515 172.356 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -48.36 -52.42 21.8 Favored 'General case' 0 C--O 1.231 0.097 0 CA-C-N 119.071 0.85 . . . . 4.0 110.212 177.231 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -61.88 -46.26 90.18 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 119.921 -0.712 . . . . 3.79 110.879 -176.937 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 44.0 t -59.97 -38.03 74.83 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.23 0 CA-C-O 119.196 -0.431 . . . . 1.98 111.828 175.181 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 2.0 t60 -64.66 -19.79 65.92 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 125.512 1.525 . . . . 3.31 109.997 -171.397 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 34.8 t . . . . . 0 C--O 1.254 1.296 0 CA-C-O 115.077 -2.392 . . . . 2.71 113.148 175.742 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.472 0.644 0 N-CA-C 105.792 -1.929 . . . . 9.96 105.792 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 28.2 t -156.62 176.46 12.69 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 106.272 -1.751 . . . . 3.35 106.272 172.65 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.3 pp -58.93 -27.32 35.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 C-N-CA 124.527 1.131 . . . . 2.15 110.784 -175.398 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -68.21 -10.76 56.77 Favored 'General case' 0 N--CA 1.439 -0.989 0 C-N-CA 126.082 1.753 . . . . 2.88 112.014 179.013 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.0 t0 -135.83 32.5 2.97 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.096 1.359 . . . . 2.56 109.948 -174.238 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 11.2 m -125.34 -56.33 2.04 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 N-CA-C 112.576 0.584 . . . . 3.81 112.576 172.643 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 22.3 tp -171.55 -59.2 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.135 0 N-CA-C 106.131 -1.803 . . . . 2.55 106.131 -172.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 28.5 m -42.06 -35.78 0.98 Allowed 'General case' 0 C--O 1.217 -0.656 0 C-N-CA 125.501 1.52 . . . . 2.15 113.698 -175.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -40.68 -45.63 2.42 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 114.094 1.146 . . . . 2.11 114.094 172.245 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -70.9 -43.63 67.94 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 122.261 1.029 . . . . 1.78 109.597 179.352 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -62.83 -46.55 87.38 Favored 'General case' 0 N--CA 1.449 -0.518 0 C-N-CA 123.963 0.905 . . . . 2.55 109.966 -175.654 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 35.9 pt -58.94 -41.67 83.76 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.767 0 C-N-CA 123.752 0.821 . . . . 1.97 110.354 178.362 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.8 -46.76 84.19 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 110.267 -0.272 . . . . 2.25 110.267 176.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.49 -52.28 66.27 Favored 'General case' 0 CA--C 1.529 0.15 0 O-C-N 121.781 -0.574 . . . . 1.82 110.715 173.458 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -53.11 -43.82 67.15 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 124.769 1.227 . . . . 1.73 111.537 -176.259 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -55.36 -43.24 74.91 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 124.225 1.01 . . . . 4.55 109.017 176.455 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 21.7 mt-30 -77.23 -39.17 49.45 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-O 119.164 -0.446 . . . . 4.14 111.663 -176.513 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.34 -44.58 82.9 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 108.99 -0.744 . . . . 3.38 108.99 179.25 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 76.4 m -85.49 41.58 0.9 Allowed 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.219 1.008 . . . . 2.43 111.195 175.873 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 15.1 mtt180 -77.69 -55.58 5.23 Favored 'General case' 0 CA--C 1.518 -0.285 0 O-C-N 121.142 -0.974 . . . . 5.65 108.605 178.813 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -69.46 140.52 90.0 Favored Pre-proline 0 N--CA 1.448 -0.55 0 CA-C-N 115.83 -0.623 . . . . 2.72 109.509 -175.036 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -63.63 142.65 84.66 Favored 'Trans proline' 0 N--CA 1.449 -1.108 0 C-N-CA 122.208 1.939 . . . . 1.24 111.207 -175.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 17.8 t70 57.62 36.92 27.24 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 127.009 2.124 . . . . 3.62 112.179 178.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 24.4 m -102.31 -29.57 11.59 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.872 1.269 . . . . 1.8 111.281 177.085 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -53.87 125.44 18.64 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 125.688 1.595 . . . . 3.32 109.155 -177.488 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -119.64 152.06 52.79 Favored Pre-proline 0 C--O 1.232 0.134 0 C-N-CA 124.686 1.194 . . . . 2.18 108.294 172.537 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -64.94 -66.47 0.04 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.217 0 C-N-CA 122.707 2.271 . . . . 0.68 110.52 178.428 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 35.0 mt-30 -60.61 -36.53 78.82 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 122.978 0.511 . . . . 3.5 111.297 -175.103 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -58.5 -64.85 0.78 Allowed 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 109.316 -0.624 . . . . 5.96 109.316 173.108 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 55.9 t80 -56.6 -45.55 81.37 Favored 'General case' 0 C--O 1.221 -0.42 0 CA-C-O 121.427 0.632 . . . . 3.57 110.593 -174.717 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -41.29 -57.24 2.19 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 126.784 2.034 . . . . 5.92 111.047 176.422 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 12.0 mt-30 -70.96 -45.36 64.26 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 109.933 -0.395 . . . . 2.96 109.933 178.698 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -55.99 -29.06 59.74 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 123.11 0.564 . . . . 1.54 112.439 -179.001 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 14.7 t -88.5 -8.74 54.34 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 126.489 1.916 . . . . 2.33 110.429 -175.505 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 81.05 -1.99 82.7 Favored Glycine 0 C--N 1.34 0.795 0 O-C-N 121.322 -0.861 . . . . 0.86 111.04 174.047 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 85.0 mt -63.36 -28.85 70.27 Favored 'General case' 0 N--CA 1.441 -0.896 0 C-N-CA 124.737 1.215 . . . . 2.32 110.217 -176.246 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 60.4 p -63.02 -35.52 80.5 Favored 'General case' 0 C--N 1.338 0.102 0 C-N-CA 123.711 0.805 . . . . 3.46 111.62 171.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 7.5 tttt -82.79 -32.08 27.88 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 108.945 -0.761 . . . . 6.02 108.945 -176.158 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 21.5 mtt -57.62 124.66 19.84 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-O 121.088 0.471 . . . . 3.92 110.342 174.273 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 6.9 m -61.2 157.09 16.89 Favored 'General case' 0 N--CA 1.452 -0.368 0 O-C-N 121.525 -0.734 . . . . 2.18 110.15 172.171 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -43.33 -40.26 3.51 Favored 'General case' 0 C--O 1.225 -0.22 0 C-N-CA 124.031 0.932 . . . . 1.73 111.414 175.399 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 49.9 m-20 -47.02 -60.07 2.7 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 124.351 1.061 . . . . 2.44 110.381 174.559 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 30.6 mm100 -69.32 -43.56 73.47 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 115.778 -0.646 . . . . 3.25 109.547 -175.696 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 95.2 t -56.91 -45.89 83.6 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 CA-C-N 119.166 0.894 . . . . 1.65 110.087 -179.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 14.2 tttt -63.03 -43.15 99.49 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 109.598 -0.519 . . . . 4.43 109.598 176.206 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 27.0 t0 -61.75 -54.99 34.94 Favored 'General case' 0 CA--C 1.535 0.38 0 O-C-N 121.947 -0.471 . . . . 2.45 110.964 -179.098 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 15.0 m -55.19 -43.65 71.43 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.202 0 C-N-CA 123.045 0.538 . . . . 1.87 110.364 176.694 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -44.8 -48.25 10.95 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 118.679 0.672 . . . . 6.75 111.221 171.733 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 83.6 mtm180 -60.27 -30.91 69.75 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 118.807 0.731 . . . . 7.47 112.479 177.857 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 14.0 m-85 -70.46 -34.59 72.59 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 118.963 0.801 . . . . 5.22 111.105 172.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.421 ' CG2' ' H ' ' A' ' 52' ' ' ASP . 18.0 mm -77.83 -171.82 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.84 0 CA-C-N 118.994 0.816 . . . . 2.39 109.692 177.95 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.421 ' H ' ' CG2' ' A' ' 51' ' ' ILE . 41.8 t0 75.55 -55.8 0.62 Allowed 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 127.331 2.253 . . . . 4.11 110.216 -178.472 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 11.3 t30 96.52 -54.41 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.187 0 C-N-CA 127.935 2.494 . . . . 2.13 108.437 -179.787 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -56.06 -35.23 66.72 Favored 'General case' 0 CA--C 1.529 0.14 0 C-N-CA 124.371 1.069 . . . . 2.37 111.642 170.937 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 75.8 mt-30 55.8 49.96 15.09 Favored 'General case' 0 CA--C 1.539 0.523 0 N-CA-C 109.19 -0.67 . . . . 5.47 109.19 -159.768 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 51.0 p -90.47 -44.25 9.73 Favored 'General case' 0 C--N 1.339 0.13 0 C-N-CA 123.422 0.689 . . . . 2.12 110.045 174.508 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 117.44 -37.88 3.16 Favored Glycine 0 C--N 1.336 0.573 0 N-CA-C 111.241 -0.743 . . . . 2.27 111.241 -177.411 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 11.2 m-85 -70.73 110.12 5.35 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 106.453 -1.684 . . . . 3.74 106.453 167.744 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -84.71 81.49 8.85 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 106.117 -1.808 . . . . 2.81 106.117 166.034 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -69.65 150.62 46.83 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 114.122 -1.399 . . . . 1.46 109.161 -179.628 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -47.76 -46.5 30.24 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.768 1.227 . . . . 3.9 112.112 -171.642 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -57.39 -39.99 77.28 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 123.143 0.577 . . . . 3.68 111.089 -178.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -71.54 -28.34 63.81 Favored 'General case' 0 CA--C 1.517 -0.289 0 O-C-N 120.959 -1.088 . . . . 2.53 110.399 -178.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.27 -30.36 59.96 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 119.285 -0.388 . . . . 3.33 110.375 170.137 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 31.5 ttpt -60.71 -9.92 4.63 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.093 0.957 . . . . 2.71 113.222 172.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 30.4 m-85 -132.39 23.12 4.41 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.299 1.039 . . . . 6.24 111.244 172.217 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 44.2 t80 -55.02 -65.54 0.56 Allowed 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 118.827 0.739 . . . . 3.84 110.742 -178.624 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 14.3 tp -84.35 -13.65 51.73 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.399 0.68 . . . . 3.6 111.598 -176.065 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 83.5 mm-40 -52.56 -57.02 11.31 Favored 'General case' 0 C--N 1.344 0.343 0 N-CA-C 109.006 -0.739 . . . . 2.13 109.006 173.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.78 42.31 0.37 Allowed 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 112.296 0.48 . . . . 3.14 112.296 -179.658 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -147.04 -56.87 0.26 Allowed 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 127.384 2.273 . . . . 4.45 106.404 -179.258 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -104.8 -46.34 4.34 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.516 1.126 . . . . 3.89 111.657 -178.295 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 19.9 m 81.4 109.13 0.07 Allowed 'General case' 0 C--N 1.34 0.182 0 C-N-CA 126.687 1.995 . . . . 3.9 110.358 -170.684 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 86.64 40.73 7.11 Favored Glycine 0 CA--C 1.525 0.711 0 N-CA-C 110.594 -1.002 . . . . 2.3 110.594 -179.597 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -85.88 -154.77 0.22 Allowed 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.041 0.937 . . . . 1.69 110.886 177.739 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 1.6 tpt85 -102.28 -9.26 20.55 Favored 'General case' 0 N--CA 1.463 0.182 0 C-N-CA 123.524 0.729 . . . . 5.37 112.684 -161.744 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -43.89 -39.75 4.12 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 129.253 3.021 . . . . 3.38 113.038 -167.004 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -50.55 -41.48 54.07 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 124.669 1.188 . . . . 2.23 111.991 176.128 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 63.7 m -65.33 109.47 2.28 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 108.63 -0.878 . . . . 1.65 108.63 171.722 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 16.5 pt-20 -54.95 -46.62 75.03 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-N 115.457 -0.792 . . . . 3.17 110.525 176.199 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.1 m -50.13 -58.08 6.31 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 119.457 1.026 . . . . 1.47 112.393 176.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -64.82 -40.52 95.34 Favored 'General case' 0 N--CA 1.453 -0.325 0 N-CA-C 109.836 -0.431 . . . . 2.7 109.836 -173.402 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -61.85 -44.92 95.86 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 122.515 1.15 . . . . 1.91 109.563 174.224 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -62.65 -31.62 72.52 Favored 'General case' 0 N--CA 1.444 -0.743 0 C-N-CA 124.898 1.279 . . . . 7.73 109.91 -176.406 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 50.6 m -53.82 -43.21 69.21 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 119.529 1.059 . . . . 1.91 111.284 171.087 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 8.0 mt -64.92 -56.61 12.27 Favored 'General case' 0 C--O 1.233 0.228 0 N-CA-C 109.184 -0.673 . . . . 3.08 109.184 170.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 7.7 ttm -43.59 -47.55 7.48 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 124.077 0.861 . . . . 3.93 112.056 -177.592 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -54.5 -46.86 73.55 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 127.661 2.384 . . . . 1.81 112.392 -173.47 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -87.08 -41.53 13.75 Favored 'General case' 0 CA--C 1.522 -0.111 0 CA-C-N 117.821 0.282 . . . . 2.19 110.783 179.18 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -54.83 -46.85 74.66 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 116.554 -0.294 . . . . 1.59 110.212 -179.252 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -73.7 77.97 1.54 Allowed 'General case' 0 N--CA 1.447 -0.589 0 CA-C-O 121.625 0.726 . . . . 0.98 109.7 178.669 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 51.4 p30 -77.07 41.58 0.29 Allowed 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.61 -0.681 . . . . 2.65 111.793 177.794 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 26.4 m-20 -128.14 -59.72 1.17 Allowed 'General case' 0 C--N 1.34 0.158 0 C-N-CA 126.614 1.966 . . . . 1.23 108.527 179.3 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 103.78 45.41 1.52 Allowed Glycine 0 CA--C 1.531 1.083 0 C-N-CA 125.19 1.376 . . . . 0.78 110.096 -164.129 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -125.1 -63.89 1.13 Allowed 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.58 1.552 . . . . 1.88 110.194 173.754 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 128.08 -30.8 3.82 Favored Glycine 0 CA--C 1.531 1.079 0 C-N-CA 124.885 1.231 . . . . 0.79 111.794 -179.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 37.9 mttp -73.17 108.4 6.03 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 108.153 -1.055 . . . . 5.48 108.153 169.439 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 18.1 mt -97.6 115.25 36.98 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.353 0 C-N-CA 123.952 0.901 . . . . 1.85 108.855 -174.393 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -69.93 164.9 51.34 Favored Glycine 0 CA--C 1.537 1.446 0 CA-C-N 118.73 0.696 . . . . 1.1 112.527 172.534 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -59.08 -39.56 82.5 Favored 'General case' 0 N--CA 1.456 -0.163 0 O-C-N 121.518 -0.989 . . . . 2.37 108.525 171.613 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -51.22 -57.94 7.48 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 124.344 1.057 . . . . 4.62 111.288 170.216 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -51.13 -48.1 61.86 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.133 0.973 . . . . 1.99 110.406 176.637 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -56.54 -60.3 3.74 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 112.349 0.5 . . . . 4.93 112.349 176.267 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -59.82 -35.69 75.23 Favored 'General case' 0 C--O 1.22 -0.467 0 CA-C-O 118.587 -0.721 . . . . 4.25 110.19 -178.286 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 17.8 mm-40 -57.5 -59.86 4.52 Favored 'General case' 0 N--CA 1.456 -0.128 0 CA-C-N 119.686 1.13 . . . . 3.21 109.654 174.068 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -56.14 -50.7 70.38 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-O 121.719 0.771 . . . . 4.8 109.119 -177.349 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 96.6 t -72.49 -30.6 34.96 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.761 0 CA-C-N 115.604 -0.726 . . . . 1.87 112.58 -172.528 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 15.2 t60 -95.16 15.36 19.31 Favored 'General case' 0 CA--C 1.532 0.286 0 O-C-N 120.117 -1.614 . . . . 4.18 110.952 178.367 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 5.8 t . . . . . 0 C--O 1.253 1.239 0 CA-C-O 116.868 -1.539 . . . . 3.56 109.142 179.661 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 94.5 mtp . . . . . 0 N--CA 1.472 0.653 0 N-CA-C 107.595 -1.261 . . . . 11.46 107.595 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 18.7 t -173.26 48.68 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 124.493 1.117 . . . . 3.74 108.17 176.553 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . 0.311 0.6 OUTLIER 69.41 -48.35 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.882 0 C-N-CA 126.76 2.024 . . . . 2.62 112.858 -177.022 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 5.7 t -38.77 -29.94 0.04 OUTLIER 'General case' 0 N--CA 1.442 -0.83 1 C-N-CA 133.036 4.535 . . . . 2.6 115.5 176.59 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 39.5 t0 -145.22 57.25 1.25 Allowed 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 121.822 0.82 . . . . 3.59 109.08 170.176 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 97.0 t -116.83 -59.47 3.1 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.17 0 CA-C-N 115.226 -0.897 . . . . 2.77 109.366 173.813 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 13.6 tp -169.67 -60.55 0.02 OUTLIER 'General case' 0 CA--C 1.519 -0.213 0 N-CA-C 106.075 -1.824 . . . . 2.7 106.075 -178.354 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -53.18 -20.42 3.94 Favored 'General case' 0 N--CA 1.446 -0.666 0 C-N-CA 125.507 1.523 . . . . 1.97 113.152 -172.012 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -50.13 -40.97 47.92 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 113.516 0.932 . . . . 1.93 113.516 169.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -70.87 -42.45 70.05 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 122.4 1.095 . . . . 1.85 109.264 176.013 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -65.29 -44.12 88.97 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 115.489 -0.778 . . . . 2.48 109.659 -172.538 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 36.3 pt -58.67 -39.15 75.37 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.671 0 O-C-N 120.855 -1.153 . . . . 1.94 111.066 175.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.63 -43.2 93.92 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 109.689 -0.486 . . . . 1.95 109.689 176.394 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.43 -56.66 19.24 Favored 'General case' 0 CA--C 1.535 0.397 0 O-C-N 122.115 -0.366 . . . . 1.6 110.419 172.699 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -50.34 -46.79 55.93 Favored 'General case' 0 C--O 1.231 0.116 0 C-N-CA 125.224 1.41 . . . . 1.5 111.448 -176.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.1 mt -50.01 -44.88 51.46 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.056 -0.975 . . . . 4.19 109.712 178.386 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.38 -46.5 17.48 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 109.763 -0.458 . . . . 5.88 109.763 -175.945 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.74 -28.26 66.65 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 121.207 -0.197 . . . . 2.74 111.416 -169.867 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 62.5 m -112.78 49.59 0.93 Allowed 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.887 1.275 . . . . 1.87 109.054 171.199 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -73.49 -33.65 64.91 Favored 'General case' 0 C--O 1.236 0.351 0 O-C-N 121.25 -0.906 . . . . 6.74 109.716 177.521 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -83.97 141.27 40.57 Favored Pre-proline 0 N--CA 1.449 -0.499 0 C-N-CA 125.456 1.502 . . . . 1.96 109.46 -171.205 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -59.96 148.94 86.85 Favored 'Trans proline' 0 N--CA 1.451 -0.98 0 C-N-CA 122.342 2.028 . . . . 1.21 110.441 -170.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 50.81 42.24 27.49 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 126.243 1.817 . . . . 2.65 111.333 173.525 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 10.4 m -109.65 -24.49 10.9 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 125.089 1.356 . . . . 1.88 112.869 179.451 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -53.38 112.51 0.91 Allowed 'General case' 0 N--CA 1.445 -0.718 0 C-N-CA 123.417 0.687 . . . . 4.22 112.141 -177.04 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -102.78 156.16 35.64 Favored Pre-proline 0 CA--C 1.539 0.531 0 C-N-CA 124.531 1.132 . . . . 2.63 109.836 173.663 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_endo -68.4 -78.42 0.01 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.883 0 C-N-CA 123.563 2.842 . . . . 1.31 112.187 -176.481 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 46.3 mt-30 -50.1 -43.91 51.78 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.991 0.916 . . . . 2.88 110.892 -178.562 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -44.59 -63.55 0.88 Allowed 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 124.266 1.026 . . . . 4.21 110.163 169.863 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 5.3 t80 -60.76 -42.47 97.52 Favored 'General case' 0 C--O 1.224 -0.266 0 CA-C-N 118.21 0.459 . . . . 3.46 110.915 -179.071 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 8.3 m-30 -56.08 -37.77 69.79 Favored 'General case' 0 CA--C 1.532 0.272 0 O-C-N 121.21 -0.931 . . . . 5.86 110.93 -179.242 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 12.6 tt0 -76.31 -53.27 8.44 Favored 'General case' 0 N--CA 1.456 -0.134 0 O-C-N 121.921 -0.487 . . . . 3.0 110.101 174.119 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -66.3 -17.39 64.73 Favored 'General case' 0 N--CA 1.447 -0.608 0 C-N-CA 123.557 0.743 . . . . 1.91 112.618 -171.931 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 2.6 t -96.41 -3.82 42.87 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 125.747 1.619 . . . . 2.27 111.154 176.236 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 80.43 -21.78 5.02 Favored Glycine 0 CA--C 1.532 1.144 0 O-C-N 120.662 -1.274 . . . . 0.94 112.308 178.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -40.75 -48.02 2.94 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 126.968 2.107 . . . . 3.97 114.018 178.32 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 43.6 p -68.47 -26.15 65.34 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 118.873 0.761 . . . . 3.24 112.016 -179.731 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 22.2 tttt -78.89 -38.0 38.66 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 107.903 -1.147 . . . . 5.12 107.903 178.345 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 9.8 mmt -62.64 139.47 58.64 Favored 'General case' 0 N--CA 1.44 -0.95 0 CA-C-O 121.575 0.703 . . . . 4.75 109.541 176.006 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 44.5 p -74.97 162.07 28.92 Favored 'General case' 0 N--CA 1.449 -0.48 0 O-C-N 121.759 -0.588 . . . . 2.73 109.889 -179.164 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -45.7 -35.99 4.61 Favored 'General case' 0 C--O 1.225 -0.223 0 C-N-CA 124.235 1.014 . . . . 1.85 112.239 176.738 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -49.9 -60.34 3.01 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 123.331 0.652 . . . . 2.77 110.681 172.334 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 5.8 mm100 -69.38 -42.38 75.23 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-O 119.134 -0.46 . . . . 2.77 109.948 -176.776 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 60.7 t -59.55 -38.41 75.22 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-N 119.148 0.885 . . . . 1.78 110.051 179.363 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 54.8 tttp -63.62 -48.92 75.35 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 118.719 0.69 . . . . 3.65 110.245 174.079 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -55.65 -57.55 11.51 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 120.626 0.251 . . . . 3.12 110.709 -179.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 5.5 m -57.91 -46.94 87.45 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.214 0 N-CA-C 109.579 -0.526 . . . . 1.87 109.579 177.776 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 13.8 t80 -46.15 -48.46 17.39 Favored 'General case' 0 C--O 1.224 -0.285 0 CA-C-O 118.454 -0.784 . . . . 5.36 110.663 177.243 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 76.2 mtp180 -54.74 -40.59 69.46 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-N 119.302 0.956 . . . . 4.58 111.493 177.169 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -63.78 -41.26 97.98 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 110.242 -0.281 . . . . 5.2 110.242 176.487 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.3 mp -65.42 -42.09 92.63 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.687 0 O-C-N 121.623 -0.673 . . . . 2.99 110.716 176.396 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 54.3 t0 -75.76 63.09 1.59 Allowed 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 124.933 1.293 . . . . 1.95 110.073 179.311 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -47.11 144.11 2.79 Favored 'General case' 0 C--O 1.232 0.175 0 N-CA-C 107.715 -1.217 . . . . 3.64 107.715 168.008 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 75.91 -33.82 0.23 Allowed 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 125.048 1.339 . . . . 3.4 112.209 -173.86 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 56.75 41.08 28.71 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 124.7 1.2 . . . . 4.59 111.532 -175.275 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 11.8 p -48.22 -32.15 6.75 Favored 'General case' 0 C--N 1.341 0.238 0 C-N-CA 126.36 1.864 . . . . 2.13 112.196 176.02 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 113.34 -17.79 21.22 Favored Glycine 0 CA--C 1.525 0.673 0 N-CA-C 109.365 -1.494 . . . . 2.34 109.365 -164.229 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 84.7 m-85 -135.39 159.44 41.57 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-O 123.041 1.4 . . . . 3.35 112.005 179.727 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -98.21 73.8 2.2 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 105.426 -2.064 . . . . 3.23 105.426 164.731 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -55.17 146.22 19.27 Favored 'General case' 0 CA--C 1.545 0.765 0 CA-C-N 113.807 -1.542 . . . . 1.61 108.815 172.376 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -50.15 -54.45 20.67 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 113.952 1.093 . . . . 3.34 113.952 -160.937 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 64.5 mt-10 -55.34 -31.69 61.92 Favored 'General case' 0 CA--C 1.535 0.368 0 O-C-N 121.589 -0.695 . . . . 3.59 111.982 177.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -71.14 -43.09 68.24 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 123.149 0.58 . . . . 2.38 109.614 176.767 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -51.6 -36.01 43.87 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.471 1.108 . . . . 3.75 110.398 173.225 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 10.8 ttmt -46.82 -60.84 2.16 Favored 'General case' 0 N--CA 1.464 0.272 0 O-C-N 121.879 -0.513 . . . . 3.31 110.309 169.752 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -73.38 60.48 0.62 Allowed 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.91 0.884 . . . . 6.01 109.981 177.62 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -89.03 -69.38 0.71 Allowed 'General case' 0 C--N 1.331 -0.223 0 O-C-N 120.533 -1.354 . . . . 4.16 108.193 175.592 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 5.8 mp -68.18 -26.24 65.64 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 122.718 0.407 . . . . 4.39 111.368 -173.424 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -72.95 0.61 10.74 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 123.999 0.92 . . . . 3.55 113.132 -176.25 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 7.1 mptt -70.83 -32.2 69.18 Favored 'General case' 0 N--CA 1.455 -0.215 0 O-C-N 121.405 -0.809 . . . . 5.01 109.823 161.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -92.4 -58.17 2.46 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 123.335 0.654 . . . . 4.51 109.322 -172.087 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -98.31 175.97 5.87 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 123.597 0.759 . . . . 3.04 109.095 -178.055 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 15.9 p -109.51 -9.68 14.9 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 124.01 0.924 . . . . 3.3 112.29 171.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -137.95 41.27 1.39 Allowed Glycine 0 CA--C 1.527 0.802 0 N-CA-C 111.079 -0.809 . . . . 1.75 111.079 179.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -83.67 -177.5 6.72 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-O 121.948 0.88 . . . . 2.08 111.422 176.544 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 2.2 tpt180 -89.04 24.2 2.18 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.121 1.369 . . . . 4.01 113.409 -162.596 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -53.52 -55.58 24.28 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-O 122.54 1.162 . . . . 6.74 111.344 -176.006 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -49.85 -35.53 23.56 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 126.87 2.068 . . . . 2.39 112.678 -177.857 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 19.3 m -70.68 102.4 2.28 Favored 'General case' 0 CA--C 1.514 -0.41 0 C-N-CA 118.558 -1.257 . . . . 1.68 109.172 176.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -62.24 -40.15 95.21 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 113.153 -1.839 . . . . 3.65 109.371 -177.559 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 18.4 m -49.73 -51.82 36.06 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 120.391 1.45 . . . . 1.4 112.585 171.671 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -69.93 -46.78 64.62 Favored 'General case' 0 C--O 1.234 0.261 0 N-CA-C 108.903 -0.777 . . . . 2.65 108.903 -172.216 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -54.1 -48.88 70.24 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-O 122.059 0.933 . . . . 1.62 109.362 174.852 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 8.0 tmtt? -74.3 -29.61 61.71 Favored 'General case' 0 N--CA 1.442 -0.829 0 C-N-CA 124.869 1.268 . . . . 6.49 110.245 -170.707 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 23.2 t -57.57 -51.12 70.78 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 119.232 0.924 . . . . 2.26 108.642 170.317 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -60.39 -51.66 68.53 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-O 119.296 -0.383 . . . . 4.65 110.125 176.25 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 37.1 ttp -50.19 -44.33 52.94 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 117.798 0.272 . . . . 3.36 111.675 175.712 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -55.3 -45.49 76.25 Favored 'General case' 0 C--O 1.226 -0.172 0 C-N-CA 125.117 1.367 . . . . 1.89 111.226 -171.577 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -88.46 -43.99 11.05 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 116.345 -0.389 . . . . 2.06 110.702 -178.331 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -54.95 -41.94 71.71 Favored 'General case' 0 C--N 1.339 0.142 0 CA-C-N 117.809 0.277 . . . . 1.72 110.694 178.722 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -74.39 104.34 5.09 Favored 'General case' 0 N--CA 1.442 -0.841 0 N-CA-C 108.264 -1.013 . . . . 1.21 108.264 175.145 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 24.1 p30 -99.1 5.87 46.76 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-O 119.525 -0.274 . . . . 2.87 111.599 -177.832 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 45.7 m-20 -79.88 -52.22 8.15 Favored 'General case' 0 C--N 1.341 0.198 0 N-CA-C 108.944 -0.761 . . . . 1.4 108.944 167.472 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 91.64 44.75 4.17 Favored Glycine 0 CA--C 1.529 0.929 0 N-CA-C 109.275 -1.53 . . . . 0.89 109.275 -157.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -126.26 -48.66 1.57 Allowed 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 124.641 1.176 . . . . 2.46 110.533 177.47 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 126.52 -46.1 1.11 Allowed Glycine 0 C--N 1.337 0.585 0 C-N-CA 124.606 1.098 . . . . 0.75 110.372 171.111 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -60.12 114.89 3.1 Favored 'General case' 0 C--O 1.237 0.446 0 N-CA-C 108.915 -0.772 . . . . 4.25 108.915 174.099 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 7.2 mt -97.94 153.71 3.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 C-N-CA 124.781 1.233 . . . . 2.07 108.693 177.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -126.62 178.85 16.6 Favored Glycine 0 CA--C 1.526 0.747 0 N-CA-C 109.062 -1.615 . . . . 1.51 109.062 174.398 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -61.41 -47.25 86.63 Favored 'General case' 0 CA--C 1.516 -0.335 0 O-C-N 122.437 -0.449 . . . . 2.27 109.822 -175.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -55.33 -68.27 0.21 Allowed 'General case' 0 N--CA 1.447 -0.588 0 O-C-N 124.573 1.171 . . . . 3.68 109.179 176.043 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -38.28 -49.72 1.41 Allowed 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.82 0.848 . . . . 1.66 112.153 176.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 63.0 t80 -61.69 -56.76 16.21 Favored 'General case' 0 CA--C 1.537 0.451 0 O-C-N 122.399 -0.188 . . . . 4.97 111.111 179.652 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 33.4 tp60 -57.55 -47.55 81.74 Favored 'General case' 0 C--O 1.218 -0.6 0 CA-C-O 117.281 -1.342 . . . . 5.9 110.727 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -44.95 -56.59 4.45 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 120.793 1.633 . . . . 3.79 110.528 176.286 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -64.57 -47.55 78.28 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 120.18 -0.608 . . . . 4.34 110.465 -177.301 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 42.8 t -56.22 -35.42 42.41 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.462 0 C-N-CA 123.058 0.543 . . . . 2.02 112.379 176.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 52.3 t60 -73.38 -22.08 60.35 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 125.958 1.703 . . . . 3.62 110.934 -174.395 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 23.2 t . . . . . 0 C--O 1.253 1.285 0 CA-C-O 115.066 -2.397 . . . . 2.63 112.866 -176.181 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.8 ptt? . . . . . 0 N--CA 1.48 1.051 0 N-CA-C 111.353 0.131 . . . . 10.71 111.353 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 58.8 m -156.77 -91.25 0.03 OUTLIER 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 106.787 -1.56 . . . . 3.13 106.787 173.81 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.2 pp -76.93 -32.1 19.49 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 CA-C-O 121.306 0.574 . . . . 2.07 111.349 -171.789 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -60.76 -29.4 69.39 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 123.731 0.813 . . . . 2.69 111.684 -175.189 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 48.0 t0 -122.18 55.84 1.12 Allowed 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 107.937 -1.134 . . . . 2.55 107.937 -176.531 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -135.72 -52.67 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.222 0 CA-C-N 115.739 -0.664 . . . . 3.37 111.498 176.345 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 179.85 -60.8 0.01 OUTLIER 'General case' 0 N--CA 1.456 -0.135 0 N-CA-C 106.368 -1.716 . . . . 2.06 106.368 -173.386 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 25.5 m -49.94 -17.5 0.39 Allowed 'General case' 0 C--O 1.219 -0.53 0 N-CA-C 115.659 1.726 . . . . 2.94 115.659 -169.36 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -49.33 -46.13 46.4 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 121.157 1.799 . . . . 2.07 112.151 168.381 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -66.17 -42.47 88.91 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 122.534 1.159 . . . . 2.08 109.845 179.0 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -69.1 -41.08 77.93 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 115.341 -0.845 . . . . 2.71 109.247 -172.454 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 29.0 pt -63.52 -39.76 86.51 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.748 0 O-C-N 120.477 -1.39 . . . . 1.61 110.78 173.37 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.57 -45.38 77.35 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 118.784 0.72 . . . . 1.62 110.19 174.289 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -55.91 -57.34 12.5 Favored 'General case' 0 CA--C 1.531 0.241 0 O-C-N 122.18 -0.325 . . . . 1.9 110.975 171.131 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -48.45 -48.22 37.73 Favored 'General case' 0 C--O 1.231 0.098 0 C-N-CA 124.101 0.96 . . . . 1.64 111.394 -177.421 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -52.23 -41.85 63.11 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 125.219 1.408 . . . . 3.81 109.741 -177.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 38.4 tt0 -87.61 -49.36 7.22 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 117.747 0.248 . . . . 4.73 110.835 -176.466 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 24.7 tp10 -47.49 -49.75 24.94 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 125.203 1.401 . . . . 3.7 110.301 178.214 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 79.3 m -111.02 55.81 0.65 Allowed 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 108.007 -1.108 . . . . 2.34 108.007 178.169 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 71.2 ttt180 -77.95 -55.0 5.66 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 119.73 1.15 . . . . 4.77 108.695 178.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -52.12 140.21 32.89 Favored Pre-proline 0 N--CA 1.446 -0.652 0 C-N-CA 124.795 1.238 . . . . 2.29 110.922 -178.163 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -57.8 151.53 55.68 Favored 'Trans proline' 0 N--CA 1.453 -0.873 0 C-N-CA 123.377 2.718 . . . . 1.21 110.441 -176.075 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 13.2 t70 69.52 -22.66 0.15 Allowed 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 127.472 2.309 . . . . 3.53 114.941 -179.801 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 2.0 m -73.88 24.37 0.08 Allowed 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.837 1.655 . . . . 2.15 113.439 -164.497 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -105.29 80.59 1.61 Allowed 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 119.374 0.988 . . . . 4.88 111.037 -163.385 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -71.0 145.04 91.04 Favored Pre-proline 0 C--O 1.234 0.26 0 C-N-CA 123.174 0.59 . . . . 2.99 110.451 -177.597 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -66.01 -65.69 0.04 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.347 0 C-N-CA 122.193 1.928 . . . . 0.85 111.151 179.768 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.73 -42.14 67.79 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 123.829 0.851 . . . . 3.07 110.822 -176.533 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 6.4 ttpt -58.74 -59.87 4.72 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 119.228 -0.415 . . . . 4.51 109.955 174.678 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 11.3 t80 -53.76 -49.71 67.6 Favored 'General case' 0 C--O 1.224 -0.241 0 CA-C-N 118.261 0.482 . . . . 3.27 110.289 -176.632 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -41.32 -56.25 2.5 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 126.764 2.026 . . . . 6.03 111.889 174.599 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 22.5 tt0 -68.58 -50.54 50.95 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 109.04 -0.726 . . . . 2.9 109.04 -179.655 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -64.75 -20.63 66.46 Favored 'General case' 0 N--CA 1.441 -0.898 0 C-N-CA 124.207 1.003 . . . . 1.64 112.265 -171.366 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 67.6 p -89.08 -9.19 52.07 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.482 1.513 . . . . 3.12 112.004 177.007 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 83.17 6.19 88.29 Favored Glycine 0 C--N 1.337 0.591 0 N-CA-C 111.558 -0.617 . . . . 0.86 111.558 172.803 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 83.0 mt -66.94 -28.96 68.72 Favored 'General case' 0 N--CA 1.443 -0.802 0 O-C-N 122.182 -0.599 . . . . 2.26 109.998 179.173 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 19.5 p -58.5 -38.11 76.96 Favored 'General case' 0 N--CA 1.464 0.243 0 C-N-CA 123.395 0.678 . . . . 3.5 111.912 165.85 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -83.66 -26.72 29.62 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 125.321 1.448 . . . . 7.19 108.991 -166.93 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 18.2 mtt -54.26 -65.03 0.64 Allowed 'General case' 0 N--CA 1.447 -0.624 0 N-CA-C 113.85 1.056 . . . . 4.71 113.85 -177.306 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 30.8 t 117.27 147.22 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 129.031 2.933 . . . . 2.42 108.352 -168.397 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -42.47 -37.79 1.72 Allowed 'General case' 0 C--N 1.34 0.155 0 C-N-CA 123.826 0.85 . . . . 1.91 111.644 169.825 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 73.8 m-20 -59.5 -63.12 1.42 Allowed 'General case' 0 CA--C 1.529 0.16 0 CA-C-O 121.683 0.754 . . . . 2.34 109.502 -178.796 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 20.8 mm100 -60.7 -40.3 91.72 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 115.755 -0.657 . . . . 3.02 110.479 -179.241 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 97.1 t -62.77 -42.54 96.63 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 CA-C-N 118.548 0.613 . . . . 1.88 109.879 -179.762 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 21.7 ttmm -59.74 -41.47 90.99 Favored 'General case' 0 CA--C 1.533 0.299 0 O-C-N 121.426 -0.796 . . . . 4.13 110.064 174.063 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -59.49 -58.89 6.61 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 117.729 0.24 . . . . 3.06 111.135 174.989 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 4.1 m -56.6 -40.78 71.09 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 O-C-N 121.631 -0.668 . . . . 1.6 110.955 -177.631 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 5.9 t80 -44.11 -44.8 7.83 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.942 0.897 . . . . 6.28 111.884 172.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.54 -38.49 77.9 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 118.816 0.735 . . . . 5.42 110.868 178.253 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -72.41 -34.54 67.94 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.027 0.531 . . . . 4.82 110.173 178.221 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 5.1 mm -65.61 -54.45 27.97 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.166 0 C-N-CA 122.742 0.417 . . . . 2.65 110.325 177.753 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -75.85 67.45 2.25 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 108.478 -0.934 . . . . 2.0 108.478 -178.594 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 5.4 t30 -50.64 -40.36 52.95 Favored 'General case' 0 C--N 1.333 -0.14 0 C-N-CA 126.6 1.96 . . . . 1.92 111.99 -172.821 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -78.79 -22.65 46.02 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 126.781 2.032 . . . . 2.33 112.348 178.394 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 7.5 mt-30 62.4 31.53 17.19 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 126.183 1.793 . . . . 3.06 113.473 -177.783 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 97.0 p -60.29 -35.85 76.51 Favored 'General case' 0 C--N 1.339 0.135 0 O-C-N 120.907 -1.121 . . . . 1.94 111.236 167.555 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 88.61 -4.3 85.1 Favored Glycine 0 CA--C 1.531 1.085 0 CA-C-O 119.128 -0.818 . . . . 1.32 111.787 -167.6 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 46.1 m-85 -109.77 140.94 43.09 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 124.012 0.925 . . . . 4.0 109.084 168.764 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.3 mt -118.23 76.61 1.09 Allowed 'General case' 0 N--CA 1.44 -0.934 0 C-N-CA 127.649 2.38 . . . . 3.93 106.949 177.091 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -66.06 157.35 31.26 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 126.272 1.829 . . . . 2.7 111.203 170.549 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -52.15 -44.02 64.35 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 123.524 0.73 . . . . 3.76 112.813 -176.297 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -59.59 -37.01 77.4 Favored 'General case' 0 CA--C 1.535 0.386 0 O-C-N 121.537 -0.727 . . . . 3.47 111.971 176.753 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 64.6 mt-10 -66.09 -42.87 88.74 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 118.922 0.783 . . . . 2.74 109.901 172.022 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 8.9 mp -57.01 -31.64 65.32 Favored 'General case' 0 CA--C 1.533 0.305 0 O-C-N 121.523 -0.736 . . . . 3.85 111.207 173.816 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 14.4 ttpt -73.62 0.73 11.86 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 113.046 0.758 . . . . 3.88 113.046 175.808 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 66.7 t80 -150.91 68.88 0.95 Allowed 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 107.97 -1.122 . . . . 6.62 107.97 167.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -117.01 -61.33 1.73 Allowed 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 128.529 2.732 . . . . 3.38 108.463 -177.806 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -65.95 -21.4 66.42 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 123.858 0.863 . . . . 4.64 111.488 -178.182 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 77.8 mm-40 -62.58 -10.3 11.68 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 119.615 1.098 . . . . 2.24 111.688 177.775 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.6 mptp? -67.98 -46.57 70.97 Favored 'General case' 0 C--N 1.342 0.247 0 O-C-N 120.51 -1.369 . . . . 3.69 110.395 165.218 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 8.3 m-30 -74.37 -42.64 58.98 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 123.503 0.721 . . . . 4.31 110.535 -169.239 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -142.73 -178.17 5.67 Favored 'General case' 0 C--O 1.226 -0.177 0 C-N-CA 124.561 1.145 . . . . 4.75 108.601 -176.704 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 10.2 m -116.92 22.7 12.42 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 123.079 0.552 . . . . 3.04 111.957 -178.111 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -168.19 45.3 0.23 Allowed Glycine 0 C--N 1.336 0.536 0 N-CA-C 111.157 -0.777 . . . . 1.56 111.157 -177.579 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -76.67 -150.27 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 121.292 0.568 . . . . 2.09 111.073 -179.463 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -115.74 -6.77 12.13 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 123.997 0.919 . . . . 4.25 112.801 -174.729 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -49.18 -33.92 13.4 Favored 'General case' 0 C--O 1.226 -0.181 0 N-CA-C 113.348 0.869 . . . . 4.06 113.348 -175.407 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -39.26 -53.02 1.96 Allowed 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 125.307 1.443 . . . . 2.04 111.168 169.503 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 6.0 m -77.95 120.61 23.04 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-O 122.706 1.241 . . . . 2.48 110.752 -176.375 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 56.4 mp0 -66.85 -33.42 75.57 Favored 'General case' 0 N--CA 1.441 -0.899 0 CA-C-N 114.025 -1.443 . . . . 3.92 111.25 -174.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 5.9 t -57.75 -59.08 5.76 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 119.644 1.111 . . . . 2.19 110.891 178.761 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 15.5 mp0 -56.28 -45.59 80.1 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 123.621 0.768 . . . . 3.45 111.217 177.273 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -55.36 -48.67 73.91 Favored 'General case' 0 N--CA 1.457 -0.096 0 N-CA-C 109.298 -0.63 . . . . 1.72 109.298 176.861 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 7.8 tmtt? -67.8 -32.79 73.6 Favored 'General case' 0 N--CA 1.443 -0.803 0 C-N-CA 123.661 0.785 . . . . 6.37 110.611 -174.71 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 20.3 m -58.08 -44.83 87.8 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 124.025 0.93 . . . . 2.42 110.183 171.223 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -63.32 -54.99 28.33 Favored 'General case' 0 C--O 1.236 0.374 0 O-C-N 122.065 -0.397 . . . . 4.47 110.646 172.43 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 3.7 ttp -45.62 -45.14 13.66 Favored 'General case' 0 C--O 1.223 -0.332 0 C-N-CA 123.361 0.664 . . . . 4.31 111.486 177.458 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -55.58 -44.77 77.23 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 125.646 1.578 . . . . 1.66 112.058 -173.405 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -84.8 -43.03 14.58 Favored 'General case' 0 N--CA 1.461 0.088 0 CA-C-O 120.626 0.25 . . . . 1.54 110.822 179.405 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -58.3 -42.33 86.41 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 123.027 0.531 . . . . 1.49 111.07 -178.404 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -74.34 87.0 2.0 Allowed 'General case' 0 N--CA 1.445 -0.714 0 N-CA-C 109.131 -0.692 . . . . 0.84 109.131 178.497 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 9.3 m-80 -82.2 39.8 0.6 Allowed 'General case' 0 CA--C 1.535 0.379 0 O-C-N 121.18 -0.95 . . . . 3.61 109.99 -177.233 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 45.8 m-20 -127.98 -58.23 1.22 Allowed 'General case' 0 C--N 1.339 0.119 0 C-N-CA 124.829 1.252 . . . . 1.37 109.039 -178.146 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 100.78 44.98 2.0 Allowed Glycine 0 CA--C 1.53 1.028 0 N-CA-C 109.61 -1.396 . . . . 0.95 109.61 -162.197 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -127.54 -51.9 1.37 Allowed 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.669 1.188 . . . . 1.94 110.041 174.872 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 124.17 -36.73 2.86 Favored Glycine 0 CA--C 1.525 0.699 0 C-N-CA 124.527 1.06 . . . . 0.69 111.543 175.224 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 51.7 mttm -70.29 116.28 10.46 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 107.806 -1.183 . . . . 5.6 107.806 175.608 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 4.0 mt -89.18 166.4 1.86 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.334 0 N-CA-C 107.459 -1.312 . . . . 1.71 107.459 173.71 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -144.58 178.79 22.24 Favored Glycine 0 N--CA 1.446 -0.663 0 N-CA-C 107.177 -2.369 . . . . 1.45 107.177 172.08 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -55.01 -46.04 75.17 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 109.62 -0.511 . . . . 1.91 109.62 -176.575 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 22.9 tt0 -58.86 -63.25 1.37 Allowed 'General case' 0 N--CA 1.444 -0.766 0 O-C-N 124.24 0.962 . . . . 2.58 109.538 -176.613 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -46.21 -47.54 17.82 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 123.455 0.702 . . . . 1.27 112.205 174.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -61.61 -53.76 51.91 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-O 121.405 0.621 . . . . 4.25 109.858 -176.771 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -62.28 -32.64 73.38 Favored 'General case' 0 C--O 1.218 -0.594 0 C-N-CA 124.066 0.947 . . . . 2.55 110.717 178.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 30.5 mm-40 -64.22 -54.02 39.97 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-N 120.07 1.304 . . . . 3.48 109.931 175.646 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.05 -52.6 62.68 Favored 'General case' 0 CA--C 1.531 0.237 0 N-CA-C 108.029 -1.101 . . . . 3.82 108.029 -179.938 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 71.7 t -70.0 -34.07 58.12 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.607 0 CA-C-N 115.594 -0.73 . . . . 1.61 112.821 -174.19 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 6.7 t-80 -86.66 8.12 23.71 Favored 'General case' 0 CA--C 1.534 0.356 0 O-C-N 119.734 -1.853 . . . . 4.61 111.269 -178.037 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 32.2 t . . . . . 0 C--O 1.254 1.311 0 CA-C-O 115.518 -2.182 . . . . 2.39 111.386 178.55 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.0 mmt . . . . . 0 N--CA 1.471 0.583 0 N-CA-C 108.819 -0.808 . . . . 6.88 108.819 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.8 m -147.62 174.23 11.96 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 106.154 -1.795 . . . . 4.82 106.154 177.369 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -49.89 -28.11 4.02 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.404 0 C-N-CA 125.153 1.381 . . . . 3.14 112.899 177.404 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -44.06 -50.27 8.49 Favored 'General case' 0 N--CA 1.442 -0.84 0 C-N-CA 125.697 1.599 . . . . 2.89 110.106 170.982 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -86.02 46.41 1.32 Allowed 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.462 1.105 . . . . 3.38 110.418 -173.273 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 25.3 t -142.01 -58.96 0.21 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.1 0 C-N-CA 123.905 0.882 . . . . 2.59 108.936 177.248 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 9.8 tp -171.41 -51.82 0.02 OUTLIER 'General case' 0 C--O 1.232 0.159 0 N-CA-C 106.943 -1.502 . . . . 2.33 106.943 -174.201 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 18.7 m -48.67 -21.14 0.55 Allowed 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 116.052 1.871 . . . . 2.0 116.052 -166.527 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -50.47 -49.09 56.15 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 120.286 1.403 . . . . 1.67 111.46 171.461 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -65.45 -42.94 91.81 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-O 122.086 0.946 . . . . 1.84 109.596 -177.694 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 27.7 m-20 -62.06 -51.1 69.34 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 115.187 -0.915 . . . . 2.53 109.046 -176.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 16.9 pt -63.27 -39.58 85.79 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.916 0 O-C-N 121.683 -0.636 . . . . 1.83 111.601 178.661 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -54.66 -44.94 73.73 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 118.356 0.525 . . . . 1.43 110.774 173.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.41 -56.61 16.57 Favored 'General case' 0 CA--C 1.535 0.378 0 O-C-N 122.014 -0.429 . . . . 1.76 110.855 173.485 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -47.59 -48.35 28.18 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 125.89 1.676 . . . . 1.7 111.369 -177.052 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 14.3 tp -50.21 -42.29 51.31 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 126.166 1.786 . . . . 3.19 110.532 177.868 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 4.9 tm0? -86.44 -45.52 11.07 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 123.884 0.874 . . . . 4.63 109.163 -171.176 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -61.79 -44.44 96.87 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 120.737 0.303 . . . . 3.45 110.421 -178.804 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 69.5 m -104.83 67.16 0.79 Allowed 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 107.153 -1.425 . . . . 2.2 107.153 175.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 19.2 ttt-85 -102.89 -2.8 27.19 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 119.473 1.033 . . . . 6.16 113.27 178.545 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -103.11 155.18 36.97 Favored Pre-proline 0 CA--C 1.533 0.322 0 C-N-CA 124.277 1.031 . . . . 2.28 110.626 -173.577 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -66.07 126.88 16.56 Favored 'Trans proline' 0 N--CA 1.453 -0.876 0 C-N-CA 122.423 2.082 . . . . 1.41 111.121 -176.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 42.6 m-20 63.19 53.28 2.29 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 127.907 2.483 . . . . 2.51 110.107 175.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.5 m -118.73 -18.44 8.96 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 124.326 1.05 . . . . 2.07 112.828 179.738 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 19.4 t80 -60.74 106.05 0.52 Allowed 'General case' 0 N--CA 1.446 -0.655 0 C-N-CA 124.326 1.05 . . . . 4.26 109.856 -174.686 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -86.99 142.78 34.22 Favored Pre-proline 0 CA--C 1.534 0.354 0 N-CA-C 108.572 -0.899 . . . . 2.69 108.572 165.637 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -65.34 -67.97 0.04 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.107 0 C-N-CA 123.169 2.579 . . . . 0.71 110.476 -179.337 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 40.5 mt-30 -55.39 -41.86 73.22 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.302 0.641 . . . . 2.27 110.73 -176.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 12.4 tptp -51.87 -69.71 0.11 Allowed 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 109.629 -0.508 . . . . 4.0 109.629 172.716 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 40.2 t80 -55.72 -37.09 67.95 Favored 'General case' 0 C--O 1.221 -0.44 0 C-N-CA 123.329 0.652 . . . . 4.18 111.043 -173.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.434 ' CE1' ' HA ' ' A' ' 107' ' ' VAL . 0.7 OUTLIER -55.82 -59.14 5.3 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 126.138 1.775 . . . . 5.94 110.297 177.459 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 42.1 mt-30 -61.1 -44.24 97.65 Favored 'General case' 0 CA--C 1.517 -0.312 0 N-CA-C 108.697 -0.853 . . . . 3.03 108.697 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -65.21 -30.56 71.46 Favored 'General case' 0 N--CA 1.434 -1.274 0 N-CA-C 113.094 0.776 . . . . 1.68 113.094 -175.228 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 34.9 t -74.54 -0.73 18.61 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 123.712 0.805 . . . . 2.66 109.773 174.559 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 75.32 5.45 77.19 Favored Glycine 0 C--N 1.339 0.743 0 N-CA-C 111.039 -0.824 . . . . 0.86 111.039 178.381 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 5.0 mt -70.45 -25.12 63.04 Favored 'General case' 0 N--CA 1.447 -0.618 0 O-C-N 121.387 -1.067 . . . . 3.38 110.822 -170.7 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.414 ' HB3' ' CZ ' ' A' ' 31' ' ' PHE . 25.4 p -65.72 -27.96 68.71 Favored 'General case' 0 CA--C 1.529 0.139 0 C-N-CA 123.644 0.778 . . . . 3.63 110.775 171.413 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 12.5 tptt -86.86 -33.64 19.73 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 108.428 -0.952 . . . . 4.51 108.428 -178.582 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 30.0 mtt -58.54 131.39 50.62 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 118.789 -1.164 . . . . 3.94 111.044 172.63 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 82.2 p -70.6 158.15 36.68 Favored 'General case' 0 CA--C 1.533 0.298 0 O-C-N 121.675 -0.64 . . . . 3.68 110.11 178.29 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -43.59 -36.84 2.26 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.78 1.232 . . . . 2.08 113.082 177.337 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 9.3 m-80 -56.56 -61.8 2.17 Favored 'General case' 0 CA--C 1.527 0.091 0 C-N-CA 124.128 0.971 . . . . 2.12 109.21 175.045 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 23.5 mm100 -59.54 -45.61 91.29 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 115.804 -0.634 . . . . 2.88 110.076 -179.506 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 73.1 t -57.13 -46.15 84.51 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 CA-C-N 118.975 0.807 . . . . 1.9 110.0 -177.452 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 3.2 ttpm? -72.59 -29.64 63.69 Favored 'General case' 0 N--CA 1.448 -0.554 0 O-C-N 121.798 -0.564 . . . . 4.71 111.519 179.896 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -62.74 -58.51 7.22 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 118.939 0.791 . . . . 2.84 110.67 170.365 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 12.0 m -53.02 -44.67 51.13 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.174 0 O-C-N 121.8 -0.563 . . . . 1.71 110.224 -179.209 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 13.5 t80 -42.3 -50.83 4.97 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 123.262 0.625 . . . . 5.81 111.827 171.111 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 65.4 mtp85 -65.8 -34.39 78.06 Favored 'General case' 0 CA--C 1.529 0.173 0 C-N-CA 122.895 0.478 . . . . 4.19 110.926 179.183 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -61.89 -40.55 95.8 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 109.802 -0.444 . . . . 5.2 109.802 175.445 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 25.5 mm -84.06 -47.49 17.65 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 CA-C-O 118.088 -0.958 . . . . 2.56 113.233 -173.648 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -72.46 71.47 0.94 Allowed 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 106.536 -1.653 . . . . 1.94 106.536 170.876 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -57.2 -36.74 71.21 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 126.842 2.057 . . . . 2.2 111.521 -173.476 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 12.0 p-10 -58.18 -27.24 63.67 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 126.748 2.019 . . . . 3.03 112.23 170.224 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 22.7 mt-30 49.95 57.89 6.06 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 126.047 1.739 . . . . 3.26 110.145 -172.795 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 78.3 p -80.1 -42.8 22.89 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 114.137 -1.392 . . . . 2.31 109.769 171.67 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 117.38 -26.98 7.89 Favored Glycine 0 CA--C 1.53 1.005 0 CA-C-O 119.343 -0.698 . . . . 1.55 111.718 -169.622 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 37.3 m-85 -118.96 138.76 52.57 Favored 'General case' 0 C--N 1.34 0.171 0 C-N-CA 123.898 0.879 . . . . 4.28 110.344 -178.24 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -84.7 76.07 10.25 Favored 'General case' 0 N--CA 1.456 -0.146 0 N-CA-C 107.036 -1.468 . . . . 2.87 107.036 167.725 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -54.83 155.77 4.13 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.718 1.207 . . . . 1.53 109.727 171.461 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -44.48 -54.35 6.06 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 123.647 0.779 . . . . 3.3 111.874 -177.73 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -56.09 -35.46 67.05 Favored 'General case' 0 CA--C 1.534 0.327 0 N-CA-C 114.132 1.16 . . . . 3.63 114.132 176.802 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -65.39 -37.47 87.07 Favored 'General case' 0 N--CA 1.462 0.127 0 CA-C-N 120.543 1.519 . . . . 3.25 109.622 174.608 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 60.1 mt -73.2 14.27 0.33 Allowed 'General case' 0 C--O 1.222 -0.393 0 CA-C-O 118.523 -0.751 . . . . 3.3 112.408 170.193 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 27.2 ttpt -97.31 0.04 47.35 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 120.084 1.311 . . . . 2.61 109.716 162.163 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 92.1 m-85 -149.11 32.77 0.74 Allowed 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.567 0.747 . . . . 5.77 111.795 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 46.0 t80 -64.77 -72.22 0.16 Allowed 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 119.625 1.102 . . . . 3.69 109.82 -179.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 15.7 mt -65.98 -16.92 64.31 Favored 'General case' 0 CA--C 1.534 0.33 0 O-C-N 120.494 -1.379 . . . . 3.41 113.205 177.48 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 74.1 mm-40 -57.25 -33.18 67.31 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 121.032 -1.042 . . . . 1.98 111.347 176.395 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 1.6 mptp? -83.47 -13.56 54.43 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 118.792 0.723 . . . . 4.71 112.227 174.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 24.5 m-85 -75.29 -56.48 4.68 Favored 'General case' 0 C--N 1.338 0.104 0 N-CA-C 108.702 -0.851 . . . . 4.4 108.702 171.309 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 28.2 tp10 -118.06 -63.76 1.38 Allowed 'General case' 0 CA--C 1.531 0.248 0 O-C-N 124.148 0.905 . . . . 3.82 110.416 -169.824 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 8.7 t 104.3 117.68 0.01 OUTLIER 'General case' 0 C--N 1.341 0.236 0 C-N-CA 127.68 2.392 . . . . 3.36 107.546 -170.014 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 90.36 24.9 27.54 Favored Glycine 0 CA--C 1.529 0.958 0 C-N-CA 124.59 1.09 . . . . 2.8 111.943 -176.853 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -87.19 173.42 9.24 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.742 0.817 . . . . 1.88 110.744 176.673 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.76 -13.84 1.96 Allowed 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 126.913 2.085 . . . . 4.86 115.765 -167.048 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 73.8 mm-40 -37.71 -41.66 0.51 Allowed 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 126.494 1.917 . . . . 3.61 114.424 -173.251 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -48.86 -41.65 33.92 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 123.584 0.753 . . . . 2.08 112.522 177.368 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 31.5 m -71.59 110.09 5.94 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 121.836 0.827 . . . . 1.56 110.585 178.602 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 24.6 mp0 -59.55 -42.99 93.64 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 114.786 -1.097 . . . . 3.6 110.09 -178.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 2.6 m -52.32 -55.18 23.2 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.836 0.854 . . . . 1.76 112.278 177.168 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -67.39 -41.65 84.63 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 108.505 -0.924 . . . . 2.78 108.505 -173.089 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -53.01 -52.16 59.34 Favored 'General case' 0 CA--C 1.517 -0.307 0 C-N-CA 123.496 0.718 . . . . 1.66 109.151 171.718 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 12.5 tttt -73.56 -23.14 59.93 Favored 'General case' 0 N--CA 1.438 -1.039 0 CA-C-N 116.05 -0.523 . . . . 5.48 110.465 -171.209 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 21.9 m -63.49 -43.64 96.68 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.599 0.76 . . . . 2.57 110.22 167.232 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.6 tt -59.33 -61.77 2.38 Favored 'General case' 0 CA--C 1.533 0.3 0 N-CA-C 108.6 -0.889 . . . . 3.34 108.6 169.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 35.3 ttp -47.18 -49.27 22.99 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 112.412 0.523 . . . . 3.42 112.412 -177.616 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -52.42 -40.7 62.49 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 125.851 1.66 . . . . 1.82 112.274 -173.604 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -90.83 -36.98 13.9 Favored 'General case' 0 C--O 1.226 -0.155 0 C-N-CA 122.355 0.262 . . . . 1.28 111.351 179.52 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -57.7 -44.44 85.88 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 122.319 0.248 . . . . 1.71 111.044 177.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 8.8 t0 -66.45 120.6 13.64 Favored 'General case' 0 N--CA 1.442 -0.845 0 N-CA-C 108.292 -1.003 . . . . 1.75 108.292 174.461 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 49.1 p30 -104.35 11.13 35.05 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 112.63 0.604 . . . . 3.34 112.63 176.022 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -95.01 -52.89 4.03 Favored 'General case' 0 C--N 1.342 0.279 0 CA-C-N 118.731 0.696 . . . . 1.39 110.414 173.626 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 97.38 47.94 2.1 Favored Glycine 0 CA--C 1.53 1.025 0 N-CA-C 108.676 -1.77 . . . . 0.9 108.676 -156.383 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 36.2 p30 -128.29 -64.78 0.93 Allowed 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 126.355 1.862 . . . . 1.94 110.055 175.036 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 140.13 -49.39 0.8 Allowed Glycine 0 CA--C 1.522 0.516 0 C-N-CA 125.31 1.433 . . . . 0.86 109.52 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 23.2 pttm -53.22 128.39 27.84 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 109.473 -0.565 . . . . 6.12 109.473 174.455 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 5.6 mt -118.6 107.94 22.94 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.325 0 C-N-CA 125.518 1.527 . . . . 1.78 108.233 -175.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -66.97 163.8 44.3 Favored Glycine 0 CA--C 1.532 1.102 0 N-CA-C 110.993 -0.843 . . . . 0.87 110.993 172.477 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -51.93 -38.78 57.65 Favored 'General case' 0 C--N 1.339 0.13 0 O-C-N 122.104 -0.645 . . . . 1.77 109.631 168.215 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -59.59 -55.63 32.03 Favored 'General case' 0 N--CA 1.444 -0.758 0 CA-C-N 115.142 -0.935 . . . . 2.51 109.91 178.788 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -52.66 -46.37 67.16 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.616 0.766 . . . . 2.23 110.679 175.357 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 85.4 t80 -56.51 -57.64 11.46 Favored 'General case' 0 CA--C 1.536 0.406 0 O-C-N 121.816 -0.553 . . . . 5.66 111.349 177.548 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 30.8 tt0 -55.97 -37.81 69.56 Favored 'General case' 0 CA--C 1.533 0.299 0 O-C-N 121.748 -0.595 . . . . 2.55 110.294 177.183 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -56.8 -60.8 3.04 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 123.42 0.688 . . . . 4.58 109.872 178.531 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 12.0 ptm -57.47 -43.41 84.02 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 119.822 -0.751 . . . . 6.49 109.65 178.543 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . 0.434 ' HA ' ' CE1' ' A' ' 31' ' ' PHE . 57.1 t -69.65 -16.88 20.88 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 N-CA-C 112.126 0.417 . . . . 1.98 112.126 -175.297 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -76.01 -23.52 55.22 Favored 'General case' 0 CA--C 1.538 0.483 0 O-C-N 120.123 -1.61 . . . . 3.49 110.903 175.981 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 15.5 t . . . . . 0 C--O 1.252 1.216 0 CA-C-O 116.36 -1.781 . . . . 2.46 114.017 -164.456 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.8 mpt? . . . . . 0 N--CA 1.474 0.743 0 N-CA-C 107.62 -1.252 . . . . 9.31 107.62 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 30.7 t -148.79 -179.3 6.89 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 104.746 -2.316 . . . . 3.96 104.746 159.485 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 2.3 pp -54.5 -31.51 23.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 C-N-CA 124.987 1.315 . . . . 1.88 111.392 -174.441 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 2.3 t -51.88 -44.03 63.56 Favored 'General case' 0 N--CA 1.436 -1.142 0 C-N-CA 125.401 1.48 . . . . 2.51 111.14 174.319 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 23.3 t0 -98.18 42.25 1.1 Allowed 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 126.538 1.935 . . . . 3.41 109.423 -173.132 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 97.4 t -136.73 -59.95 0.44 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.101 0 C-N-CA 124.997 1.319 . . . . 2.62 108.611 177.646 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -170.87 -47.24 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.116 0 N-CA-C 107.395 -1.335 . . . . 2.45 107.395 -177.432 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 20.3 m -49.08 -22.84 1.01 Allowed 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 116.639 2.088 . . . . 2.05 116.639 -166.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -49.35 -42.16 40.99 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 119.823 1.192 . . . . 1.88 112.291 169.107 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -68.42 -40.05 81.35 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 121.829 0.823 . . . . 2.07 110.41 176.593 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -61.28 -47.19 87.15 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 115.797 -0.638 . . . . 4.96 109.834 -177.788 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 34.6 pt -65.57 -38.22 81.87 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.11 0 CA-C-O 119.163 -0.446 . . . . 2.48 109.797 -177.711 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.93 -46.46 78.46 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 118.341 0.519 . . . . 1.55 111.274 173.378 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.95 -61.04 2.93 Favored 'General case' 0 C--O 1.234 0.262 0 O-C-N 121.961 -0.462 . . . . 1.82 111.012 174.273 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -51.27 -44.79 61.89 Favored 'General case' 0 CA--C 1.528 0.099 0 C-N-CA 123.56 0.744 . . . . 1.56 111.167 -176.892 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -48.72 -44.41 38.23 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 125.54 1.536 . . . . 4.28 111.903 177.907 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.9 mm100 -86.67 -49.39 7.53 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 119.222 0.919 . . . . 3.44 110.946 178.616 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 55.3 tp10 -50.63 -47.45 58.37 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.978 0.911 . . . . 3.9 110.803 -177.682 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 74.6 m -112.52 58.86 0.64 Allowed 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 124.757 1.223 . . . . 2.25 108.031 177.262 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 56.8 ttt180 -82.82 -54.17 5.31 Favored 'General case' 0 CA--C 1.52 -0.176 0 O-C-N 121.522 -0.736 . . . . 4.63 109.701 178.257 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 36.6 m-20 -58.73 143.41 82.37 Favored Pre-proline 0 N--CA 1.449 -0.476 0 CA-C-N 115.171 -0.922 . . . . 2.14 110.285 -173.5 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -64.57 134.89 43.11 Favored 'Trans proline' 0 N--CA 1.449 -1.137 0 C-N-CA 122.406 2.07 . . . . 1.2 110.402 -173.817 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 69.5 m-20 63.15 36.87 11.8 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 127.643 2.377 . . . . 2.67 111.699 178.457 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 6.1 m -102.64 0.35 33.08 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 123.907 0.883 . . . . 1.64 110.88 173.51 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -70.89 138.12 49.89 Favored 'General case' 0 N--CA 1.449 -0.487 0 O-C-N 121.35 -0.844 . . . . 3.26 110.582 -174.482 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -131.84 148.49 70.11 Favored Pre-proline 0 N--CA 1.452 -0.328 0 C-N-CA 123.965 0.906 . . . . 2.51 109.395 170.731 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_endo -65.67 -71.64 0.02 OUTLIER 'Trans proline' 0 N--CA 1.451 -0.973 0 C-N-CA 123.741 2.961 . . . . 0.72 111.007 -178.856 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 53.7 mt-30 -51.8 -46.22 64.15 Favored 'General case' 0 C--O 1.233 0.205 0 C-N-CA 123.879 0.872 . . . . 2.19 110.982 -178.725 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 16.9 tptt -47.75 -60.33 2.65 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 123.418 0.687 . . . . 3.47 110.007 171.689 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 82.3 t80 -56.34 -47.06 79.57 Favored 'General case' 0 C--O 1.222 -0.362 0 C-N-CA 122.805 0.442 . . . . 3.45 110.846 -179.425 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 9.0 m-30 -54.34 -40.54 68.13 Favored 'General case' 0 CA--C 1.531 0.233 0 O-C-N 121.166 -0.959 . . . . 6.15 111.411 -178.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 33.4 mt-30 -73.1 -54.75 7.73 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 110.331 -0.248 . . . . 3.16 110.331 176.263 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -57.85 -39.07 76.87 Favored 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 123.15 0.58 . . . . 1.6 110.332 -172.213 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 10.9 m -86.1 6.72 27.81 Favored 'General case' 0 N--CA 1.444 -0.744 0 C-N-CA 124.815 1.246 . . . . 2.72 111.558 -177.748 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 75.23 -16.53 3.58 Favored Glycine 0 CA--C 1.531 1.063 0 O-C-N 119.366 -2.084 . . . . 0.86 113.093 169.186 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 12.7 mt -56.15 -29.55 60.92 Favored 'General case' 0 N--CA 1.441 -0.89 0 C-N-CA 126.425 1.89 . . . . 2.68 112.995 178.615 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 8.1 t -70.34 -32.96 70.91 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 123.521 0.728 . . . . 2.4 111.41 170.523 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 2.4 tptt -74.79 -36.7 62.5 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 108.397 -0.964 . . . . 6.23 108.397 178.76 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 41.2 mtt -66.5 119.86 12.39 Favored 'General case' 0 N--CA 1.443 -0.788 0 N-CA-C 109.223 -0.658 . . . . 3.21 109.223 173.512 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 16.4 t -63.46 161.97 13.44 Favored 'General case' 0 N--CA 1.453 -0.293 0 O-C-N 121.804 -0.56 . . . . 3.64 109.651 174.454 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -37.7 -44.14 0.69 Allowed 'General case' 0 CA--C 1.527 0.091 0 C-N-CA 126.095 1.758 . . . . 1.93 112.055 178.427 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 39.5 m-20 -39.92 -56.87 1.72 Allowed 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 125.937 1.695 . . . . 2.35 111.565 174.761 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 9.1 mm100 -75.98 -36.68 59.15 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 122.991 0.516 . . . . 2.52 110.177 -176.589 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 4.2 t -61.17 -35.31 64.91 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.584 0 N-CA-C 108.721 -0.844 . . . . 1.99 108.721 179.029 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 80.4 tttt -56.56 -50.03 73.11 Favored 'General case' 0 CA--C 1.531 0.235 0 O-C-N 121.157 -0.964 . . . . 4.57 111.589 172.843 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -55.08 -52.51 62.98 Favored 'General case' 0 C--O 1.233 0.206 0 N-CA-C 110.072 -0.344 . . . . 2.62 110.072 176.92 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 2.4 m -59.53 -45.3 94.05 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 C-N-CA 119.151 -1.019 . . . . 2.01 110.803 179.688 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 10.9 m-85 -47.43 -48.96 26.22 Favored 'General case' 0 C--N 1.34 0.165 0 C-N-CA 124.072 0.949 . . . . 5.77 111.912 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 4.4 mtt180 -61.01 -28.41 69.02 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 120.199 -0.601 . . . . 3.96 111.877 179.638 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 7.6 t80 -72.18 -40.81 67.64 Favored 'General case' 0 N--CA 1.452 -0.343 0 O-C-N 121.955 -0.465 . . . . 5.42 110.067 170.568 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 5.0 mm -66.82 -51.55 54.35 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-O 118.356 -0.831 . . . . 2.46 111.654 -176.047 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -66.4 76.36 0.1 Allowed 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 107.361 -1.348 . . . . 2.26 107.361 171.312 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -66.95 -30.25 70.33 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 123.665 0.786 . . . . 2.15 109.621 178.819 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 38.5 p-10 -65.63 -44.01 87.78 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 123.545 0.738 . . . . 2.5 110.689 169.69 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . 0.297 0.0 OUTLIER 101.54 10.76 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 130.031 3.332 . . . . 4.88 112.809 173.74 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 7.7 p -71.7 -39.77 69.97 Favored 'General case' 0 CA--C 1.528 0.133 0 N-CA-C 112.488 0.551 . . . . 1.91 112.488 -170.68 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 113.37 -26.39 10.34 Favored Glycine 0 CA--C 1.527 0.81 0 N-CA-C 111.61 -0.596 . . . . 1.81 111.61 -179.444 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 86.5 m-85 -79.58 134.81 36.48 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 107.734 -1.209 . . . . 4.6 107.734 166.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -92.62 71.94 5.01 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 105.526 -2.027 . . . . 3.86 105.526 172.367 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.42 157.23 11.52 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-N 113.981 -1.463 . . . . 1.61 108.979 179.544 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -45.0 -51.18 10.14 Favored 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 123.642 0.777 . . . . 4.24 111.578 -172.976 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 20.2 mp0 -59.06 -30.6 68.18 Favored 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 114.427 1.269 . . . . 4.32 114.427 178.708 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -59.35 -41.66 89.72 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 121.354 1.888 . . . . 3.53 109.013 169.865 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -74.45 12.12 0.84 Allowed 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 123.632 0.773 . . . . 3.3 112.44 174.905 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 32.2 ttpt -104.08 2.7 32.37 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 125.298 1.439 . . . . 3.57 109.644 166.344 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 34.4 p90 -151.17 27.78 0.68 Allowed 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 119.126 0.875 . . . . 6.94 113.342 171.881 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -56.54 -64.24 0.93 Allowed 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 119.209 0.913 . . . . 3.9 109.962 -179.585 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 7.1 mp -81.3 -17.02 50.74 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 112.873 0.694 . . . . 3.22 112.873 -179.657 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 68.3 mm-40 -54.62 -33.17 60.08 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 119.653 1.115 . . . . 2.18 110.31 174.856 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.2 mtpt -62.85 -23.43 67.3 Favored 'General case' 0 CA--C 1.535 0.383 0 O-C-N 121.962 -0.461 . . . . 4.35 112.239 176.317 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 2.1 m-30 -98.31 -49.31 4.74 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 125.144 1.378 . . . . 4.43 110.162 -174.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -137.47 135.71 37.07 Favored 'General case' 0 C--N 1.341 0.202 0 C-N-CA 125.12 1.368 . . . . 4.23 108.769 -169.76 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 2.1 p -61.86 -32.95 73.34 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 124.805 1.242 . . . . 4.23 113.978 -165.849 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -119.88 27.15 6.9 Favored Glycine 0 CA--C 1.524 0.599 0 C-N-CA 125.114 1.34 . . . . 1.99 110.761 -173.392 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.37 153.53 38.23 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 117.408 0.604 . . . . 2.0 110.77 179.182 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.48 17.14 0.07 Allowed 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 115.823 1.786 . . . . 4.5 115.823 -161.349 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 68.5 mm-40 -55.47 -35.38 65.44 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-O 122.271 1.034 . . . . 3.71 111.623 -176.603 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.75 -37.56 71.21 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 115.11 -0.95 . . . . 1.8 111.507 177.242 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 54.2 m -74.57 107.63 6.82 Favored 'General case' 0 C--N 1.344 0.338 0 CA-C-N 118.994 0.815 . . . . 1.57 109.295 -178.804 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 15.9 pt-20 -56.68 -41.48 77.37 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 114.513 -1.222 . . . . 2.87 110.834 -178.221 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 66.1 m -59.39 -54.36 47.55 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 122.976 0.51 . . . . 2.36 112.096 177.404 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 -59.48 -45.51 91.46 Favored 'General case' 0 C--O 1.232 0.171 0 O-C-N 121.423 -0.798 . . . . 3.03 110.631 178.509 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -53.94 -47.86 70.84 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 121.696 0.76 . . . . 1.69 109.71 174.529 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 14.8 mmtp -65.4 -29.71 70.45 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 123.892 0.877 . . . . 5.84 111.357 -177.078 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.2 t -56.47 -46.61 80.32 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 119.285 0.948 . . . . 2.4 110.314 170.449 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 28.3 mt -64.2 -57.41 9.59 Favored 'General case' 0 C--O 1.235 0.319 0 O-C-N 121.761 -0.587 . . . . 3.68 109.914 174.798 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 2.0 tpt -40.82 -52.89 2.97 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 123.675 0.79 . . . . 4.2 111.39 176.811 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -53.6 -48.4 69.3 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 126.792 2.037 . . . . 1.7 111.875 -170.634 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -80.25 -47.44 14.59 Favored 'General case' 0 N--CA 1.457 -0.108 0 C-N-CA 121.186 -0.206 . . . . 1.89 110.752 178.206 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -54.66 -38.38 66.87 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 120.664 0.269 . . . . 1.61 110.996 -176.1 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -78.27 103.79 8.44 Favored 'General case' 0 N--CA 1.442 -0.842 0 CA-C-N 116.436 -0.347 . . . . 1.09 110.197 178.191 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 9.4 m-80 -95.71 27.66 3.38 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 123.558 0.743 . . . . 3.11 110.339 -177.664 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 45.2 m-20 -119.49 -51.07 2.3 Favored 'General case' 0 N--CA 1.46 0.041 0 C-N-CA 124.558 1.143 . . . . 1.44 109.332 178.095 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 91.84 42.28 4.78 Favored Glycine 0 CA--C 1.527 0.829 0 N-CA-C 108.771 -1.732 . . . . 0.97 108.771 -158.343 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 33.5 p30 -121.36 -63.21 1.35 Allowed 'General case' 0 C--N 1.342 0.253 0 C-N-CA 124.035 0.934 . . . . 2.26 110.586 172.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 126.79 -31.91 3.8 Favored Glycine 0 CA--C 1.521 0.46 0 N-CA-C 111.261 -0.735 . . . . 1.0 111.261 177.745 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 25.7 pttm -58.29 101.11 0.07 Allowed 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 107.92 -1.141 . . . . 5.94 107.92 162.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 26.7 mt -94.57 147.99 5.3 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 N-CA-C 107.106 -1.442 . . . . 1.87 107.106 176.102 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -117.01 170.33 13.38 Favored Glycine 0 CA--C 1.523 0.572 0 N-CA-C 109.683 -1.367 . . . . 0.84 109.683 175.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -59.59 -48.93 79.73 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 108.691 -0.855 . . . . 1.79 108.691 178.783 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -54.22 -54.73 36.01 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 111.86 0.319 . . . . 3.6 111.86 177.201 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -47.65 -53.99 13.27 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.525 1.13 . . . . 1.68 110.439 175.931 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -70.67 -38.83 73.82 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 119.37 -0.932 . . . . 5.09 111.305 -177.548 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -57.53 -49.79 75.2 Favored 'General case' 0 C--O 1.221 -0.404 0 C-N-CA 124.133 0.973 . . . . 3.46 108.652 -179.154 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -50.53 -54.19 24.36 Favored 'General case' 0 CA--C 1.528 0.129 0 CA-C-N 118.819 0.736 . . . . 3.89 110.367 176.887 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.12 -56.89 16.12 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 116.529 -0.305 . . . . 4.38 111.013 -178.018 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 42.5 t -50.23 -45.71 24.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 C-N-CA 124.299 1.04 . . . . 1.92 111.359 177.878 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 10.9 t-160 -72.44 -11.12 60.55 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 125.053 1.341 . . . . 4.56 111.016 -172.295 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 30.0 t . . . . . 0 C--O 1.252 1.188 0 C-N-CA 122.986 0.514 . . . . 3.33 112.035 178.394 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 18.3 mmt . . . . . 0 N--CA 1.471 0.576 0 N-CA-C 108.414 -0.958 . . . . 10.08 108.414 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 32.5 m -133.12 -178.11 4.82 Favored 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 106.329 -1.73 . . . . 4.0 106.329 172.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 2.6 pp -45.27 -42.97 3.13 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.384 0 C-N-CA 124.536 1.134 . . . . 3.51 111.947 -179.794 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -81.22 57.69 3.28 Favored 'General case' 0 N--CA 1.439 -1.015 0 C-N-CA 126.322 1.849 . . . . 2.82 107.099 178.227 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 174.42 -48.92 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 126.324 1.85 . . . . 3.82 108.952 176.161 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -46.13 -41.89 4.37 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.307 0 C-N-CA 125.766 1.626 . . . . 2.75 112.224 -170.642 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -175.71 -60.11 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 105.867 -1.901 . . . . 2.99 105.867 -171.556 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 2.6 m -50.83 -29.18 11.07 Favored 'General case' 0 N--CA 1.445 -0.694 0 C-N-CA 124.736 1.214 . . . . 1.75 113.617 -170.12 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -49.73 -46.44 50.35 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 119.547 1.067 . . . . 1.95 113.14 171.415 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 42.5 t0 -66.18 -43.39 87.0 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-O 122.707 1.241 . . . . 1.87 108.911 179.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -64.38 -50.21 68.57 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 115.399 -0.819 . . . . 2.28 109.581 -175.486 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 9.5 pt -60.18 -41.17 85.79 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.677 0 O-C-N 121.249 -0.907 . . . . 2.22 111.341 176.477 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -54.74 -42.27 71.4 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 118.999 0.818 . . . . 2.52 111.014 174.181 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.84 -54.08 44.41 Favored 'General case' 0 CA--C 1.533 0.299 0 O-C-N 121.61 -0.681 . . . . 2.19 111.064 171.373 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -51.9 -44.64 63.86 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 124.89 1.276 . . . . 2.07 111.379 -174.855 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.9 tp -48.12 -48.37 34.04 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 125.483 1.513 . . . . 3.59 109.958 174.557 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 23.7 mt-30 -82.46 -28.01 31.51 Favored 'General case' 0 CA--C 1.528 0.125 0 N-CA-C 113.381 0.882 . . . . 3.89 113.381 -178.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . 0.275 0.2 OUTLIER -71.82 -37.65 70.29 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 119.942 1.246 . . . . 3.69 109.386 176.865 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 44.4 m -92.36 38.22 1.01 Allowed 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.184 1.394 . . . . 2.5 112.407 174.153 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.93 -37.39 67.2 Favored 'General case' 0 N--CA 1.47 0.534 0 O-C-N 120.444 -1.41 . . . . 9.4 109.78 172.41 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -83.92 142.05 41.48 Favored Pre-proline 0 N--CA 1.447 -0.592 0 C-N-CA 124.092 0.957 . . . . 2.03 108.889 -176.27 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -69.46 150.73 70.41 Favored 'Trans proline' 0 N--CA 1.46 -0.498 0 C-N-CA 123.489 2.792 . . . . 1.54 112.008 -176.747 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 55.68 19.35 3.31 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.923 1.689 . . . . 2.29 112.945 178.57 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 55.5 m -91.82 -25.67 18.88 Favored 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 124.639 1.176 . . . . 2.07 111.087 -173.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 3.8 t80 -49.29 122.81 6.49 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 123.769 0.828 . . . . 4.51 109.731 178.002 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -114.79 152.52 46.46 Favored Pre-proline 0 CA--C 1.536 0.422 0 C-N-CA 124.354 1.062 . . . . 2.73 108.984 168.692 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_endo -66.42 -70.61 0.02 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.819 0 C-N-CA 123.434 2.756 . . . . 1.3 111.545 -175.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 -54.07 -45.72 71.81 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 123.574 0.75 . . . . 2.82 110.492 -179.196 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 22.3 tptt -45.77 -64.46 0.73 Allowed 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 123.666 0.786 . . . . 3.59 109.15 172.455 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 75.4 t80 -59.32 -44.32 92.61 Favored 'General case' 0 N--CA 1.447 -0.616 0 C-N-CA 122.485 0.314 . . . . 3.48 111.455 -175.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 34.3 m-85 -57.17 -38.81 74.15 Favored 'General case' 0 N--CA 1.453 -0.29 0 O-C-N 121.394 -0.816 . . . . 6.18 111.054 -178.741 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 4.3 mt-30 -71.37 -51.55 23.56 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 118.643 0.656 . . . . 2.7 110.607 170.64 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -58.67 -31.43 68.19 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 123.94 0.896 . . . . 2.07 111.804 -172.069 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.6 t -91.29 1.65 56.95 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 126.485 1.914 . . . . 2.92 110.497 -176.876 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 90.37 -36.78 3.48 Favored Glycine 0 C--N 1.335 0.523 0 O-C-N 120.682 -1.262 . . . . 1.75 110.192 170.477 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 3.3 mp -33.57 -52.57 0.4 Allowed 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 126.537 1.935 . . . . 3.93 114.865 179.158 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 10.3 t -69.39 -27.31 65.19 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 119.523 1.056 . . . . 3.1 111.49 -176.3 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 5.6 tmtp? -79.7 -39.27 31.61 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 108.994 -0.743 . . . . 3.89 108.994 176.419 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 9.6 mtt -57.67 143.31 42.02 Favored 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 123.532 0.733 . . . . 3.76 110.629 176.684 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 3.8 m -62.09 149.32 41.56 Favored 'General case' 0 N--CA 1.446 -0.627 0 O-C-N 121.873 -0.517 . . . . 2.19 109.878 172.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -37.89 -43.51 0.7 Allowed 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 125.054 1.342 . . . . 1.63 111.913 171.076 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -53.29 -60.99 2.59 Favored 'General case' 0 C--O 1.227 -0.087 0 C-N-CA 124.249 1.02 . . . . 3.36 110.061 178.038 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 28.7 mm100 -60.81 -39.08 87.63 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 123.092 0.557 . . . . 3.14 109.893 -178.313 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 60.1 t -60.85 -44.63 98.09 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.29 0 CA-C-N 118.823 0.738 . . . . 1.79 109.855 177.668 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 62.0 tttt -68.84 -39.64 79.85 Favored 'General case' 0 N--CA 1.451 -0.4 0 O-C-N 121.642 -0.661 . . . . 3.87 110.692 -178.061 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -59.71 -58.2 9.6 Favored 'General case' 0 C--O 1.232 0.153 0 C-N-CA 122.749 0.419 . . . . 3.22 110.2 173.211 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 14.0 m -55.63 -44.92 78.5 Favored 'Isoleucine or valine' 0 C--N 1.34 0.195 0 N-CA-C 109.59 -0.522 . . . . 1.73 109.59 -179.189 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.401 ' CZ ' HD22 ' A' ' 59' ' ' LEU . 43.3 t80 -46.43 -64.23 0.81 Allowed 'General case' 0 C--N 1.341 0.229 0 N-CA-C 109.449 -0.574 . . . . 5.14 109.449 171.723 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 63.8 mtt180 -54.67 -37.04 65.28 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 114.005 1.113 . . . . 5.36 114.005 -178.711 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 27.1 m-85 -64.08 -52.97 56.72 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 119.282 0.946 . . . . 6.36 109.981 175.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 35.8 mm -76.2 -20.63 15.29 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.691 0 O-C-N 121.816 -0.552 . . . . 3.83 111.773 -171.409 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 43.7 t0 -48.53 -28.64 3.51 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 128.759 2.824 . . . . 2.6 113.015 173.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 11.2 t-20 79.14 -56.09 0.43 Allowed 'General case' 0 C--N 1.339 0.144 0 C-N-CA 126.318 1.847 . . . . 3.55 112.65 162.624 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 29.4 p30 -69.57 -39.14 77.54 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.966 0.907 . . . . 3.02 110.08 168.086 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . 0.278 1.2 pt20 83.95 24.09 0.12 Allowed 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 129.641 3.176 . . . . 3.84 111.021 -171.922 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 89.0 p -77.14 -27.2 53.8 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 113.607 0.966 . . . . 2.46 113.607 -174.069 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 98.44 24.47 11.15 Favored Glycine 0 CA--C 1.534 1.247 0 C-N-CA 125.28 1.419 . . . . 2.3 112.397 -173.175 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 44.7 m-85 -143.22 128.05 18.3 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 118.338 1.069 . . . . 4.33 111.112 -177.543 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.401 HD22 ' CZ ' ' A' ' 48' ' ' PHE . 1.6 mm? -109.19 70.19 0.73 Allowed 'General case' 0 C--N 1.339 0.125 0 C-N-CA 127.148 2.179 . . . . 2.98 108.588 -179.685 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -54.28 159.05 2.08 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.563 1.545 . . . . 1.61 111.076 173.268 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -36.55 -54.53 0.87 Allowed 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 125.852 1.661 . . . . 4.32 112.082 176.19 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 -63.81 -45.48 89.47 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 115.957 -0.565 . . . . 3.21 110.337 -173.345 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 81.7 mt-10 -62.89 -40.23 96.9 Favored 'General case' 0 N--CA 1.449 -0.517 0 O-C-N 121.506 -0.746 . . . . 2.57 110.513 178.547 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 6.2 mt -57.18 -50.57 72.43 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 120.921 0.391 . . . . 3.22 110.294 171.122 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 14.7 ttpt -60.76 -16.06 36.21 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 126.04 1.736 . . . . 5.07 112.441 178.694 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 69.6 m-85 -130.97 49.28 2.34 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.009 0.924 . . . . 7.63 110.354 170.089 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 68.3 t80 -85.77 -76.88 0.32 Allowed 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 124.419 1.088 . . . . 4.82 110.716 -178.214 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 90.9 mt -61.15 -9.09 4.14 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 113.171 0.804 . . . . 3.69 113.171 -176.643 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 80.8 mm-40 -47.96 -61.97 1.7 Allowed 'General case' 0 N--CA 1.452 -0.353 0 O-C-N 121.492 -0.755 . . . . 2.07 110.346 168.617 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -83.79 48.01 1.38 Allowed 'General case' 0 CA--C 1.537 0.448 0 O-C-N 121.22 -0.925 . . . . 4.87 110.252 -177.267 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -153.12 -58.21 0.13 Allowed 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.165 0.986 . . . . 4.42 108.352 -167.712 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -108.55 -37.24 5.99 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 126.176 1.79 . . . . 3.76 109.904 175.291 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 1.4 p 78.81 107.8 0.07 Allowed 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 125.154 1.381 . . . . 3.27 108.734 -172.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 72.81 48.83 19.97 Favored Glycine 0 CA--C 1.527 0.8 0 N-CA-C 110.323 -1.111 . . . . 2.32 110.323 -176.118 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -79.11 -146.9 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.758 0.823 . . . . 1.65 109.795 173.68 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 7.2 tpt180 -102.7 -30.91 10.61 Favored 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 113.317 0.858 . . . . 4.21 113.317 -171.249 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -31.02 -33.19 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 129.717 3.207 . . . . 3.75 115.907 -175.302 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -39.94 -46.05 1.98 Allowed 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.727 1.211 . . . . 2.54 110.856 171.636 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 7.3 m -72.17 125.64 27.81 Favored 'General case' 0 C--N 1.343 0.311 0 C-N-CA 119.541 -0.864 . . . . 1.64 110.936 176.136 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -69.33 -38.52 78.23 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-O 118.086 -0.959 . . . . 2.9 111.738 177.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 19.1 m -48.47 -69.73 0.11 Allowed 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 119.768 1.167 . . . . 1.47 111.365 168.458 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -48.84 -45.46 40.69 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 123.757 0.823 . . . . 3.29 110.524 -176.514 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 1.2 m -60.31 -49.88 75.86 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 121.693 0.759 . . . . 2.45 110.276 177.043 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 24.2 ttpp -64.76 -29.8 70.78 Favored 'General case' 0 N--CA 1.439 -0.997 0 CA-C-N 115.966 -0.561 . . . . 5.62 110.696 -173.432 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 9.5 m -56.7 -33.75 66.77 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 119.476 1.034 . . . . 1.91 112.083 169.615 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.2 tt -71.68 -61.76 1.66 Allowed 'General case' 0 C--O 1.236 0.356 0 N-CA-C 108.25 -1.018 . . . . 3.38 108.25 169.832 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 2.1 ttm -46.11 -53.71 9.85 Favored 'General case' 0 C--O 1.221 -0.414 0 C-N-CA 123.335 0.654 . . . . 3.81 111.105 -174.003 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -42.96 -37.85 2.02 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 127.579 2.351 . . . . 1.45 113.34 179.92 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -97.62 -44.78 6.64 Favored 'General case' 0 C--O 1.227 -0.103 0 CA-C-O 120.897 0.38 . . . . 1.47 110.676 -175.746 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -53.9 -43.09 69.41 Favored 'General case' 0 N--CA 1.456 -0.15 0 C-N-CA 123.863 0.865 . . . . 1.5 110.926 176.792 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -73.72 72.84 1.51 Allowed 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 124.772 1.229 . . . . 1.18 109.541 -178.749 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 48.8 p-10 -77.17 51.83 0.86 Allowed 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.752 1.221 . . . . 2.87 112.313 -172.68 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 31.9 p30 -163.29 -46.26 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 126.281 1.833 . . . . 3.7 109.847 -175.017 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 99.98 55.05 1.01 Allowed Glycine 0 CA--C 1.525 0.699 0 N-CA-C 110.183 -1.167 . . . . 0.83 110.183 173.739 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -123.84 -46.97 1.95 Allowed 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 126.33 1.852 . . . . 2.35 109.918 175.01 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 123.5 -36.64 2.97 Favored Glycine 0 CA--C 1.529 0.953 0 C-N-CA 125.436 1.493 . . . . 0.66 111.342 178.042 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 39.9 mmtt -71.8 128.86 37.11 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 108.501 -0.926 . . . . 7.04 108.501 177.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 23.0 mt -119.39 116.31 50.4 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.253 0 C-N-CA 124.256 1.022 . . . . 1.87 108.644 -173.916 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -81.28 167.45 49.19 Favored Glycine 0 CA--C 1.528 0.878 0 N-CA-C 110.863 -0.895 . . . . 0.71 110.863 174.072 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -57.99 -37.81 74.94 Favored 'General case' 0 C--O 1.224 -0.28 0 N-CA-C 109.572 -0.529 . . . . 1.76 109.572 172.737 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 60.2 mt-10 -56.65 -67.08 0.34 Allowed 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 124.064 0.946 . . . . 2.94 109.49 175.013 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -40.04 -50.07 2.56 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.142 0.977 . . . . 1.38 111.393 175.551 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -66.89 -55.45 14.66 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 112.01 0.374 . . . . 4.23 112.01 -176.371 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 10.8 tt0 -53.58 -44.43 69.33 Favored 'General case' 0 C--O 1.221 -0.41 0 C-N-CA 124.212 1.005 . . . . 2.45 109.28 178.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -50.86 -62.46 1.59 Allowed 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 119.266 0.939 . . . . 3.98 110.426 173.721 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.03 -42.6 94.72 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 120.726 -0.389 . . . . 3.95 110.9 -173.67 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 57.2 t -58.85 -48.63 85.68 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.327 0 C-N-CA 124.103 0.961 . . . . 1.94 111.3 176.171 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 50.5 t-80 -72.81 -18.19 61.49 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 125.445 1.498 . . . . 3.77 110.834 -170.761 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 22.9 t . . . . . 0 C--O 1.254 1.332 0 CA-C-O 114.989 -2.434 . . . . 2.58 113.41 -179.856 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 52.6 mtt . . . . . 0 N--CA 1.472 0.654 0 N-CA-C 107.504 -1.295 . . . . 8.62 107.504 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.0 m 149.23 -86.05 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 130.055 3.342 . . . . 2.93 105.889 -175.187 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.5 pp -75.31 -33.34 27.78 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 CA-C-O 121.803 0.811 . . . . 2.53 111.514 -171.038 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 10.2 t -69.03 -7.03 31.8 Favored 'General case' 0 N--CA 1.426 -1.653 0 C-N-CA 126.284 1.834 . . . . 2.54 111.662 -175.242 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 52.1 t0 -148.08 60.63 1.11 Allowed 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 108.026 -1.102 . . . . 2.64 108.026 -179.474 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 3.1 p -145.38 -48.71 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.192 0 C-N-CA 123.842 0.857 . . . . 3.08 110.477 174.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -178.78 -48.83 0.01 OUTLIER 'General case' 0 CA--C 1.528 0.12 0 C-N-CA 126.121 1.768 . . . . 2.48 106.536 -175.267 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 2.3 m -50.94 -24.02 3.31 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 115.67 1.729 . . . . 1.57 115.67 -170.858 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -53.98 -41.51 67.96 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 119.543 1.065 . . . . 1.63 112.273 172.124 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -74.4 -36.89 63.52 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 121.391 0.615 . . . . 1.97 109.931 178.546 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -56.26 -52.84 63.0 Favored 'General case' 0 C--O 1.234 0.263 0 C-N-CA 124.253 1.021 . . . . 2.84 108.277 179.18 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 34.0 pt -63.14 -39.99 87.35 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.401 0 CA-C-N 115.087 -0.96 . . . . 1.77 110.153 -177.278 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -52.43 -45.8 66.14 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 118.999 0.818 . . . . 1.83 110.971 175.645 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.58 -59.6 5.19 Favored 'General case' 0 CA--C 1.533 0.322 0 O-C-N 122.144 -0.347 . . . . 1.76 110.949 174.06 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -47.83 -44.3 28.77 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 124.055 0.942 . . . . 1.58 111.933 -179.488 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -55.23 -37.04 66.66 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 125.058 1.343 . . . . 4.46 110.831 -179.146 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.55 -42.73 12.54 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 122.478 0.311 . . . . 6.31 110.368 -178.869 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -68.36 -36.99 80.03 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 118.073 0.397 . . . . 2.5 110.878 -174.189 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 39.5 m -116.83 69.05 0.75 Allowed 'General case' 0 C--N 1.339 0.119 0 C-N-CA 124.573 1.149 . . . . 1.93 108.445 172.634 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 48.8 ttt180 -88.71 -55.19 3.81 Favored 'General case' 0 N--CA 1.456 -0.151 0 N-CA-C 109.352 -0.611 . . . . 6.1 109.352 -179.247 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -60.53 138.03 92.59 Favored Pre-proline 0 C--O 1.224 -0.253 0 C-N-CA 124.43 1.092 . . . . 3.25 110.167 175.935 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -71.81 148.44 52.19 Favored 'Trans proline' 0 N--CA 1.458 -0.608 0 C-N-CA 123.462 2.775 . . . . 2.73 111.294 -176.683 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.4 t70 82.83 4.14 1.01 Allowed 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 127.396 2.278 . . . . 2.45 111.27 179.176 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 18.2 m -87.13 -7.28 58.17 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.621 1.168 . . . . 1.73 112.935 -177.89 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -86.09 82.97 7.88 Favored 'General case' 0 CA--C 1.534 0.356 0 O-C-N 120.041 -1.662 . . . . 4.24 113.196 -155.594 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.402 ' OE1' ' NZ ' ' A' ' 29' ' ' LYS . 6.6 mt-10 -65.31 139.93 97.62 Favored Pre-proline 0 CA--C 1.534 0.364 0 O-C-N 121.64 -0.662 . . . . 2.19 110.364 175.0 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -68.06 -63.18 0.05 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.17 0 C-N-CA 122.605 2.204 . . . . 1.0 111.53 -176.263 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -53.94 -42.63 69.04 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 124.21 1.004 . . . . 2.7 110.88 179.446 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.402 ' NZ ' ' OE1' ' A' ' 26' ' ' GLU . 0.3 OUTLIER -54.32 -61.56 2.23 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 123.052 0.541 . . . . 5.33 109.714 174.858 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 8.4 t80 -53.72 -53.88 45.85 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-O 122.252 1.025 . . . . 3.54 110.839 -177.238 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.462 ' CE1' ' HA ' ' A' ' 107' ' ' VAL . 2.7 t80 -40.0 -56.32 1.87 Allowed 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.275 1.43 . . . . 5.99 111.81 175.2 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -70.55 -41.51 72.37 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 123.55 0.74 . . . . 3.26 110.27 -179.457 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.2 t -63.86 -38.38 90.88 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 118.403 0.547 . . . . 1.55 110.926 -170.512 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 38.5 m -60.33 -57.09 14.26 Favored 'General case' 0 N--CA 1.443 -0.789 0 N-CA-C 107.656 -1.239 . . . . 3.33 107.656 170.777 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 116.92 21.13 4.67 Favored Glycine 0 CA--C 1.525 0.708 0 N-CA-C 110.266 -1.134 . . . . 2.02 110.266 -172.896 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 1.8 mt -65.72 -24.6 67.02 Favored 'General case' 0 N--CA 1.451 -0.4 0 O-C-N 121.199 -1.177 . . . . 3.14 109.587 176.203 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 21.5 t -63.49 -18.6 63.97 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.196 0.598 . . . . 2.84 110.4 173.07 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.24 -27.41 16.17 Favored 'General case' 0 N--CA 1.447 -0.585 0 O-C-N 121.665 -0.647 . . . . 6.41 110.0 176.814 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 27.4 mmt -69.11 134.23 49.06 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 121.425 0.631 . . . . 4.69 111.231 176.189 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 73.8 m -65.6 151.28 46.84 Favored 'General case' 0 N--CA 1.452 -0.326 0 O-C-N 121.876 -0.515 . . . . 1.99 110.715 175.892 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -39.25 -41.2 0.85 Allowed 'General case' 0 C--O 1.224 -0.241 0 C-N-CA 125.595 1.558 . . . . 1.68 111.998 172.488 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 65.6 m-20 -50.13 -59.83 3.54 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 124.049 0.94 . . . . 2.01 110.744 175.864 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -72.11 -35.03 69.06 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 109.181 -0.674 . . . . 3.51 109.181 -173.357 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 79.0 t -59.64 -43.04 90.3 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 O-C-N 121.584 -0.698 . . . . 1.61 109.869 174.084 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 60.6 tttt -69.5 -42.02 75.29 Favored 'General case' 0 CA--C 1.536 0.417 0 O-C-N 120.809 -1.182 . . . . 3.48 110.573 178.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -50.82 -61.41 2.23 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.33 0.652 . . . . 3.22 110.349 171.475 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 18.0 m -54.85 -46.99 75.67 Favored 'Isoleucine or valine' 0 C--N 1.34 0.178 0 CA-C-O 118.214 -0.898 . . . . 1.61 110.821 178.499 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 25.6 t80 -43.99 -52.72 6.81 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 119.127 0.876 . . . . 5.7 111.175 174.704 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 78.2 mtp180 -60.55 -37.38 81.04 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 120.499 -0.481 . . . . 3.93 111.451 179.569 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 11.5 t80 -64.64 -34.19 77.71 Favored 'General case' 0 CA--C 1.534 0.348 0 O-C-N 122.274 -0.266 . . . . 5.4 110.479 175.837 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 6.4 mm -68.58 -53.4 27.87 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 N-CA-C 109.909 -0.404 . . . . 2.32 109.909 175.503 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -78.06 60.6 2.43 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.754 0.822 . . . . 2.15 111.507 -172.026 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -52.05 -32.32 33.95 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 126.916 2.086 . . . . 1.97 113.334 -172.466 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 11.3 p-10 -72.25 -33.46 67.51 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.813 1.245 . . . . 2.57 111.728 178.278 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . 0.279 0.8 OUTLIER 75.33 22.18 1.73 Allowed 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 127.166 2.187 . . . . 5.54 114.698 -179.616 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 99.3 p -50.2 -29.13 8.7 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 120.039 1.291 . . . . 2.32 112.467 173.851 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 107.59 -24.99 22.66 Favored Glycine 0 C--N 1.338 0.681 0 N-CA-C 109.335 -1.506 . . . . 1.5 109.335 -172.595 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 96.8 m-85 -115.35 135.04 54.55 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 124.274 1.03 . . . . 3.61 108.813 -179.63 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 6.6 mt -71.72 75.7 0.84 Allowed 'General case' 0 N--CA 1.448 -0.552 0 N-CA-C 106.896 -1.52 . . . . 3.72 106.896 160.318 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -66.02 160.77 23.0 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 108.635 -0.876 . . . . 2.86 108.635 172.63 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -52.38 -39.01 60.28 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.91 0.884 . . . . 3.8 113.269 -170.199 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -66.2 -49.8 66.06 Favored 'General case' 0 N--CA 1.453 -0.31 0 O-C-N 121.714 -0.616 . . . . 3.49 110.293 -175.517 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -61.25 -31.76 71.56 Favored 'General case' 0 C--N 1.329 -0.317 0 O-C-N 121.25 -0.907 . . . . 3.02 110.816 174.08 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -53.78 -36.58 62.57 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 117.867 0.303 . . . . 3.62 111.558 168.996 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 33.0 ttpt -61.53 -9.18 5.28 Favored 'General case' 0 CA--C 1.54 0.564 0 O-C-N 121.292 -0.88 . . . . 3.11 112.487 173.612 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 76.8 m-85 -128.56 28.63 5.39 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 124.301 1.04 . . . . 5.65 111.424 171.43 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -59.08 -62.85 1.58 Allowed 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 118.652 0.66 . . . . 4.79 109.856 -177.031 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 47.1 mt -92.44 -9.42 41.64 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.442 0.697 . . . . 4.24 112.14 -178.249 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 43.9 mm-40 -54.19 -33.42 58.12 Favored 'General case' 0 N--CA 1.463 0.193 0 O-C-N 121.514 -0.741 . . . . 2.49 110.989 171.423 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.45 -28.69 63.56 Favored 'General case' 0 CA--C 1.533 0.311 0 O-C-N 122.155 -0.341 . . . . 4.02 111.294 176.376 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 4.4 m-30 -85.82 -58.59 2.59 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 108.501 -0.925 . . . . 4.27 108.501 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -140.73 127.85 20.87 Favored 'General case' 0 C--N 1.34 0.174 0 N-CA-C 109.141 -0.688 . . . . 3.34 109.141 -171.302 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 5.9 p -55.33 -27.1 44.84 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 123.973 0.909 . . . . 4.11 112.269 -179.096 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -106.1 22.84 30.47 Favored Glycine 0 CA--C 1.526 0.722 0 CA-C-O 118.54 -1.144 . . . . 2.05 112.04 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -54.48 -68.29 0.2 Allowed 'General case' 0 C--N 1.343 0.289 0 CA-C-N 118.805 1.303 . . . . 3.44 111.819 -174.12 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 1.2 tpt180 -173.52 -47.73 0.01 OUTLIER 'General case' 0 C--N 1.339 0.136 0 N-CA-C 112.735 0.643 . . . . 3.94 112.735 178.7 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -39.71 -31.31 0.1 Allowed 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 129.191 2.996 . . . . 3.7 114.598 -163.135 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -31.03 -51.95 0.17 Allowed 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 126.353 1.861 . . . . 2.51 112.158 165.322 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -82.89 121.78 27.4 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 122.91 0.484 . . . . 3.63 110.304 178.576 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -55.62 -31.03 61.93 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 116.215 -0.448 . . . . 3.17 111.617 176.414 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 7.9 t -58.58 -60.58 3.59 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 108.711 -0.848 . . . . 2.04 108.711 -176.659 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -65.42 -41.88 93.11 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 122.799 0.44 . . . . 2.92 110.216 -174.315 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 1.2 m -49.01 -52.1 27.04 Favored 'General case' 0 C--N 1.344 0.333 0 N-CA-C 109.709 -0.478 . . . . 2.06 109.709 169.816 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 51.5 mtmt -70.37 -29.1 65.67 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-O 118.311 -0.852 . . . . 5.52 112.729 -178.779 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 10.8 m -57.6 -46.41 84.1 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 120.783 1.628 . . . . 2.55 110.085 168.691 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -60.48 -57.39 12.96 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 109.202 -0.666 . . . . 3.26 109.202 175.271 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 17.0 ttp -47.78 -52.51 18.47 Favored 'General case' 0 C--O 1.225 -0.224 0 C-N-CA 124.026 0.93 . . . . 3.98 111.477 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -51.89 -44.27 63.67 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 126.407 1.883 . . . . 2.07 111.524 -172.01 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -80.58 -52.49 7.54 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-O 119.619 -0.229 . . . . 2.12 110.595 175.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -48.54 -44.6 36.55 Favored 'General case' 0 C--N 1.339 0.122 0 C-N-CA 123.876 0.87 . . . . 1.81 111.858 -175.682 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -72.72 80.39 1.12 Allowed 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 109.286 -0.635 . . . . 0.93 109.286 177.624 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 45.3 p-10 -76.97 50.4 0.72 Allowed 'General case' 0 CA--C 1.537 0.457 0 O-C-N 121.399 -0.813 . . . . 2.73 110.972 176.095 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 37.5 m-20 -137.01 -61.63 0.66 Allowed 'General case' 0 C--N 1.341 0.214 0 C-N-CA 126.381 1.872 . . . . 1.46 109.412 178.398 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 105.04 45.8 1.33 Allowed Glycine 0 CA--C 1.534 1.247 0 C-N-CA 125.263 1.411 . . . . 1.01 110.339 -161.618 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -127.18 -57.69 1.3 Allowed 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 125.359 1.464 . . . . 2.16 110.554 172.696 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 123.5 -25.19 6.32 Favored Glycine 0 CA--C 1.531 1.056 0 C-N-CA 124.83 1.205 . . . . 0.66 111.734 176.505 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 19.1 mtpp -78.98 112.83 16.57 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 106.459 -1.682 . . . . 5.01 106.459 175.824 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 5.9 mt -100.15 140.76 18.52 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.292 0 N-CA-C 107.95 -1.13 . . . . 1.72 107.95 -175.723 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -114.45 177.41 17.56 Favored Glycine 0 C--N 1.334 0.418 0 N-CA-C 110.82 -0.912 . . . . 0.97 110.82 176.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -61.17 -39.07 88.76 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 109.511 -0.551 . . . . 1.66 109.511 176.564 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -55.91 -63.71 1.09 Allowed 'General case' 0 N--CA 1.449 -0.509 0 O-C-N 123.536 0.523 . . . . 2.3 109.987 173.432 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -49.1 -47.77 44.94 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.012 0.925 . . . . 2.2 110.837 -179.718 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 58.2 t80 -62.16 -55.86 24.55 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 123.114 0.565 . . . . 5.8 111.162 -179.088 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 14.2 tt0 -52.58 -42.42 64.48 Favored 'General case' 0 C--O 1.219 -0.544 0 C-N-CA 123.558 0.743 . . . . 3.4 109.379 175.542 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -53.02 -57.32 10.76 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 124.16 0.984 . . . . 3.96 110.093 178.438 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -55.19 -51.59 66.05 Favored 'General case' 0 C--O 1.23 0.071 0 CA-C-O 121.493 0.663 . . . . 4.14 109.499 175.564 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . 0.462 ' HA ' ' CE1' ' A' ' 31' ' ' PHE . 92.2 t -73.03 -5.97 7.34 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 CA-C-N 115.533 -0.758 . . . . 1.83 112.978 -172.369 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 78.8 t60 -91.41 -8.63 47.35 Favored 'General case' 0 CA--C 1.536 0.436 0 O-C-N 120.721 -1.237 . . . . 4.02 110.421 174.096 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 21.1 t . . . . . 0 C--O 1.252 1.208 0 CA-C-O 114.39 -2.719 . . . . 2.37 113.91 -168.89 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.3 mmt . . . . . 0 N--CA 1.471 0.578 0 CA-C-O 118.425 -0.798 . . . . 8.03 108.873 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 50.6 m -96.24 -169.72 1.97 Allowed 'General case' 0 N--CA 1.454 -0.23 0 O-C-N 124.36 1.037 . . . . 3.33 108.801 175.332 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.6 pp -58.6 -35.97 57.53 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 O-C-N 121.781 -0.574 . . . . 3.13 110.469 -178.414 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 1.5 t -86.41 53.43 2.8 Favored 'General case' 0 N--CA 1.44 -0.942 0 C-N-CA 126.202 1.801 . . . . 4.04 108.094 -168.77 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -174.65 -56.51 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.144 0 N-CA-C 107.494 -1.298 . . . . 4.55 107.494 -170.595 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 13.9 t -46.97 -40.67 5.15 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.236 0 C-N-CA 126.081 1.752 . . . . 2.66 110.942 -175.914 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 4.5 tp -164.62 -55.1 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 105.823 -1.917 . . . . 2.7 105.823 175.381 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -52.09 -15.96 0.68 Allowed 'General case' 0 N--CA 1.445 -0.69 0 N-CA-C 115.482 1.66 . . . . 2.08 115.482 -168.118 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -50.72 -49.39 57.79 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 120.63 1.559 . . . . 1.89 111.36 168.179 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -64.55 -40.33 95.39 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-O 122.462 1.125 . . . . 2.22 109.753 -178.739 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -67.5 -49.57 62.87 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-N 115.395 -0.82 . . . . 2.67 109.247 -175.705 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 19.1 pt -60.1 -40.78 84.33 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.802 0 O-C-N 121.634 -0.666 . . . . 1.92 110.764 174.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -54.28 -47.8 71.94 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 119.179 0.899 . . . . 1.73 111.019 174.302 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.45 -58.49 8.37 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 121.861 -0.524 . . . . 1.81 110.739 174.583 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -46.91 -47.06 21.62 Favored 'General case' 0 C--O 1.232 0.165 0 C-N-CA 126.81 2.044 . . . . 1.95 111.736 -178.322 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -55.75 -41.7 74.33 Favored 'General case' 0 N--CA 1.445 -0.709 0 C-N-CA 125.751 1.621 . . . . 3.97 108.883 -179.121 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 17.1 tt0 -83.06 -50.95 7.98 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 108.991 -0.744 . . . . 3.05 108.991 -175.093 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.9 pp20? -61.88 -34.55 76.22 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 115.835 -0.62 . . . . 2.3 110.937 -170.849 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 96.6 m -121.39 67.04 0.88 Allowed 'General case' 0 C--O 1.235 0.305 0 C-N-CA 123.802 0.841 . . . . 2.31 109.189 168.238 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 16.6 ttp180 -84.23 -3.07 57.95 Favored 'General case' 0 N--CA 1.469 0.491 0 O-C-N 121.102 -0.999 . . . . 5.08 112.908 174.809 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -113.28 152.17 44.94 Favored Pre-proline 0 CA--C 1.537 0.464 0 C-N-CA 123.798 0.839 . . . . 2.69 112.064 -162.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -63.67 123.83 12.66 Favored 'Trans proline' 0 N--CA 1.453 -0.894 0 C-N-CA 122.891 2.394 . . . . 1.28 111.21 -169.549 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.9 t0 67.78 19.0 9.71 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 125.328 1.451 . . . . 3.26 112.336 173.654 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 26.6 m -83.14 -16.62 46.03 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.318 1.047 . . . . 2.15 111.784 176.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -94.53 98.36 10.78 Favored 'General case' 0 CA--C 1.539 0.538 0 O-C-N 121.922 -0.486 . . . . 5.13 111.116 -155.87 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -78.8 155.61 77.94 Favored Pre-proline 0 CA--C 1.535 0.381 0 O-C-N 121.725 -0.61 . . . . 2.81 110.667 -179.073 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -71.28 -61.2 0.05 OUTLIER 'Trans proline' 0 N--CA 1.45 -1.072 0 C-N-CA 122.595 2.197 . . . . 0.95 111.666 -176.632 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 -59.39 -38.06 79.55 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 118.317 0.508 . . . . 2.46 110.646 -179.212 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 1.1 tptp -55.09 -62.55 1.59 Allowed 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 109.635 -0.506 . . . . 4.81 109.635 170.7 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -53.74 -55.25 27.97 Favored 'General case' 0 C--O 1.218 -0.555 0 C-N-CA 124.335 1.054 . . . . 3.76 109.947 -174.845 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 3.4 t80 -33.03 -66.71 0.13 Allowed 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 128.774 2.83 . . . . 5.99 112.4 176.47 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 24.6 mt-30 -61.22 -46.31 90.96 Favored 'General case' 0 C--O 1.226 -0.16 0 N-CA-C 109.574 -0.528 . . . . 3.06 109.574 179.668 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -59.08 -30.5 68.12 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 113.239 0.829 . . . . 1.61 113.239 -178.411 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 23.6 t -84.06 -2.67 57.13 Favored 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 125.082 1.353 . . . . 2.39 109.961 179.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 79.68 2.59 88.33 Favored Glycine 0 C--N 1.337 0.633 0 N-CA-C 110.728 -0.949 . . . . 0.88 110.728 174.726 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 96.0 mt -68.06 -22.08 64.96 Favored 'General case' 0 N--CA 1.442 -0.833 0 O-C-N 121.507 -0.996 . . . . 2.52 110.941 -172.338 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 13.9 t -71.49 -28.03 63.63 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 123.716 0.806 . . . . 2.6 109.871 172.697 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 12.9 tttt -84.56 -36.49 22.09 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 124.012 0.925 . . . . 5.08 108.899 -179.642 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.69 128.51 35.13 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 121.228 0.537 . . . . 3.45 110.139 176.02 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 28.8 t -64.11 154.69 33.78 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 109.152 -0.684 . . . . 2.61 109.152 176.457 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -40.21 -43.45 1.68 Allowed 'General case' 0 C--N 1.34 0.174 0 C-N-CA 124.654 1.182 . . . . 2.31 111.368 173.396 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 50.6 m-80 -45.92 -64.11 0.82 Allowed 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.617 1.167 . . . . 2.35 110.764 172.874 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -64.71 -39.35 93.5 Favored 'General case' 0 C--O 1.219 -0.504 0 C-N-CA 124.028 0.931 . . . . 3.85 110.555 -176.803 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 75.6 t -61.73 -46.45 96.5 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 CA-C-N 119.592 1.087 . . . . 1.7 110.007 179.613 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 12.3 tttt -63.26 -36.48 83.81 Favored 'General case' 0 CA--C 1.535 0.382 0 O-C-N 121.834 -0.541 . . . . 3.96 109.983 177.312 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -62.03 -52.44 63.95 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 122.555 0.342 . . . . 3.12 111.081 174.003 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 1.5 m -57.41 -47.37 84.91 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.306 0 O-C-N 121.563 -0.711 . . . . 2.55 109.275 -179.526 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 40.6 t80 -43.41 -58.86 2.38 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.285 1.034 . . . . 5.61 111.159 171.116 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 67.7 mtp180 -63.99 -36.31 83.57 Favored 'General case' 0 N--CA 1.465 0.312 0 O-C-N 121.558 -0.714 . . . . 3.91 112.867 178.626 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -55.49 -44.8 76.87 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 118.822 0.737 . . . . 4.99 109.556 175.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.1 mp -70.53 -48.07 61.35 Favored 'Isoleucine or valine' 0 C--O 1.236 0.357 0 CA-C-O 117.914 -1.041 . . . . 3.37 112.01 176.791 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 26.4 t0 -70.29 68.4 0.34 Allowed 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 123.537 0.735 . . . . 1.9 110.453 -178.04 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 20.1 t30 -56.53 -41.17 76.33 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 126.794 2.038 . . . . 2.16 110.976 -177.341 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -67.61 -14.65 63.13 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.273 1.029 . . . . 2.29 112.116 175.433 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 8.9 mt-30 49.36 57.44 6.48 Favored 'General case' 0 C--N 1.341 0.205 0 C-N-CA 125.223 1.409 . . . . 2.84 110.342 -179.195 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 95.9 p -89.86 -18.74 25.62 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 115.434 -0.803 . . . . 2.37 110.314 176.242 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 80.96 19.9 66.46 Favored Glycine 0 CA--C 1.529 0.941 0 N-CA-C 110.652 -0.979 . . . . 1.35 110.652 -169.532 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 77.0 m-85 -145.49 131.5 19.26 Favored 'General case' 0 CA--C 1.515 -0.389 0 C-N-CA 123.982 0.913 . . . . 3.36 109.336 179.26 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -77.89 81.04 4.32 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 104.618 -2.364 . . . . 2.75 104.618 160.672 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -67.8 166.86 14.54 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 114.098 -1.41 . . . . 2.63 108.176 168.596 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -53.22 -48.1 68.44 Favored 'General case' 0 N--CA 1.452 -0.338 0 O-C-N 121.286 -0.884 . . . . 3.89 112.332 -172.394 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.58 -39.34 80.07 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 111.646 0.239 . . . . 4.77 111.646 -172.09 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -53.03 -36.96 61.11 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 118.692 0.678 . . . . 2.66 112.386 173.333 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 25.4 mt -67.46 -29.23 68.63 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 118.187 0.449 . . . . 3.49 110.204 176.816 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 27.5 ttpt -69.31 -2.39 10.63 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 118.515 -0.755 . . . . 3.49 111.306 170.172 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 17.1 p90 -148.26 44.01 1.04 Allowed 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 119.96 1.255 . . . . 6.49 113.97 166.59 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 50.8 t80 -71.99 -68.54 0.45 Allowed 'General case' 0 CA--C 1.538 0.499 0 O-C-N 120.894 -1.129 . . . . 3.56 110.393 -172.154 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 3.0 mp -73.38 -9.99 59.27 Favored 'General case' 0 C--O 1.234 0.242 0 C-N-CA 124.437 1.095 . . . . 3.03 112.33 173.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.66 -26.27 61.41 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 119.007 0.821 . . . . 2.84 111.326 178.622 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -92.47 -17.03 25.07 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.473 1.109 . . . . 3.42 111.061 178.631 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 9.9 m-30 -82.05 -69.43 0.62 Allowed 'General case' 0 C--O 1.224 -0.275 0 N-CA-C 107.496 -1.298 . . . . 4.24 107.496 175.256 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 25.9 tp10 -97.79 -49.44 4.82 Favored 'General case' 0 C--O 1.227 -0.094 0 C-N-CA 123.451 0.7 . . . . 3.42 109.148 -173.486 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 82.62 109.12 0.06 Allowed 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 124.751 1.22 . . . . 4.27 110.161 -172.417 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 93.58 32.53 7.62 Favored Glycine 0 CA--C 1.53 0.984 0 C-N-CA 124.541 1.067 . . . . 2.46 111.123 -174.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -85.92 -156.39 0.28 Allowed 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 123.922 0.889 . . . . 1.93 109.34 171.088 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.25 1.07 55.32 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 113.685 0.995 . . . . 4.71 113.685 -164.232 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -42.5 -37.41 1.62 Allowed 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 126.711 2.004 . . . . 2.86 113.443 -168.07 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.439 ' H ' ' CD2' ' A' ' 78' ' ' LEU . 0.2 OUTLIER -57.97 -45.47 86.67 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.24 1.416 . . . . 2.09 112.017 177.094 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 88.2 m -64.0 108.32 1.48 Allowed 'General case' 0 C--O 1.235 0.319 0 C-N-CA 124.064 0.946 . . . . 1.98 110.679 -179.434 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 8.5 mp0 -69.24 -38.83 78.67 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-N 114.644 -1.162 . . . . 3.49 110.572 -173.516 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 16.0 m -51.2 -52.61 42.71 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 119.455 1.025 . . . . 1.44 111.172 176.692 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 18.4 tt0 -67.3 -48.81 66.54 Favored 'General case' 0 N--CA 1.446 -0.643 0 C-N-CA 124.084 0.954 . . . . 4.33 109.709 -176.064 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -52.87 -46.22 67.78 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 122.164 0.983 . . . . 1.99 108.938 178.089 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 17.1 tttt -69.73 -33.6 72.69 Favored 'General case' 0 N--CA 1.444 -0.766 0 C-N-CA 125.55 1.54 . . . . 4.8 111.316 -179.545 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.6 t -58.73 -48.11 82.29 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 119.71 1.141 . . . . 2.42 109.145 172.464 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -57.16 -55.43 34.9 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 108.905 -0.776 . . . . 3.44 108.905 173.984 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 5.9 ttt -47.39 -47.0 26.48 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 112.341 0.497 . . . . 4.9 112.341 177.151 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -60.19 -46.12 90.82 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 125.592 1.557 . . . . 1.84 111.193 -169.912 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -84.84 -33.56 22.86 Favored 'General case' 0 C--O 1.227 -0.11 0 N-CA-C 111.776 0.287 . . . . 1.33 111.776 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -63.63 -39.19 93.72 Favored 'General case' 0 N--CA 1.456 -0.15 0 CA-C-N 117.982 0.356 . . . . 1.58 111.114 176.362 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 24.0 t0 -67.26 117.46 9.29 Favored 'General case' 0 N--CA 1.446 -0.651 0 N-CA-C 108.808 -0.812 . . . . 1.69 108.808 176.806 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 9.7 m-20 -100.1 10.76 40.76 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 118.649 -0.691 . . . . 2.94 111.369 178.51 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 25.9 m-20 -103.62 -56.25 2.24 Favored 'General case' 0 C--N 1.343 0.301 0 CA-C-N 119.017 0.826 . . . . 1.38 111.004 175.089 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 99.57 48.47 1.66 Allowed Glycine 0 CA--C 1.53 1.023 0 N-CA-C 108.751 -1.74 . . . . 0.94 108.751 -156.604 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 58.6 p-10 -128.97 -48.65 1.22 Allowed 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 127.119 2.168 . . . . 2.01 109.815 177.705 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 127.55 -66.01 0.57 Allowed Glycine 0 CA--C 1.523 0.585 0 C-N-CA 126.862 2.172 . . . . 1.27 108.129 -177.791 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 60.6 pttt -48.35 135.24 14.01 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.368 1.067 . . . . 5.34 111.233 -178.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 4.1 mt -117.76 108.28 24.19 Favored 'Isoleucine or valine' 0 C--O 1.232 0.176 0 C-N-CA 124.54 1.136 . . . . 1.87 109.41 -173.351 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -68.7 168.24 43.68 Favored Glycine 0 CA--C 1.534 1.25 0 N-CA-C 111.572 -0.611 . . . . 0.95 111.572 171.025 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -62.39 -38.34 89.25 Favored 'General case' 0 C--N 1.34 0.192 0 O-C-N 121.569 -0.959 . . . . 2.05 109.893 175.375 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -53.48 -54.88 30.77 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 123.25 0.62 . . . . 2.47 110.208 172.751 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -55.46 -50.92 68.6 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.254 0.621 . . . . 1.3 111.011 178.743 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 77.5 t80 -57.12 -57.13 13.91 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.389 -0.369 . . . . 5.39 110.902 -179.704 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -54.78 -44.33 73.62 Favored 'General case' 0 C--O 1.219 -0.504 0 C-N-CA 124.17 0.988 . . . . 2.59 110.122 177.765 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -52.44 -59.32 4.58 Favored 'General case' 0 CA--C 1.523 -0.068 0 CA-C-N 119.761 1.164 . . . . 3.1 110.464 176.733 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.76 -50.66 69.81 Favored 'General case' 0 CA--C 1.531 0.236 0 N-CA-C 108.39 -0.967 . . . . 3.61 108.39 -179.215 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 85.4 t -69.53 -13.09 16.83 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.794 0 N-CA-C 113.001 0.741 . . . . 1.74 113.001 -175.784 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 41.6 t-80 -88.09 -5.12 58.63 Favored 'General case' 0 CA--C 1.539 0.555 0 O-C-N 120.43 -1.419 . . . . 3.87 110.542 175.329 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 23.0 t . . . . . 0 C--O 1.253 1.262 0 CA-C-O 115.307 -2.283 . . . . 2.45 113.275 -175.039 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.0 tpt . . . . . 0 N--CA 1.466 0.336 0 N-CA-C 112.007 0.373 . . . . 7.95 112.007 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 50.3 m -147.04 -67.85 0.26 Allowed 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 107.109 -1.441 . . . . 3.04 107.109 172.396 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.6 pp -69.82 -36.4 69.49 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.285 0 CA-C-O 121.649 0.738 . . . . 2.2 111.068 176.288 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 16.6 p -73.67 -2.68 24.14 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 112.53 0.567 . . . . 4.71 112.53 -173.51 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -104.23 -35.03 8.15 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 118.668 0.667 . . . . 3.72 111.417 177.702 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 17.1 m -71.57 -44.73 70.01 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.246 0 N-CA-C 112.453 0.538 . . . . 3.75 112.453 -169.476 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -175.66 -58.14 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.161 0 N-CA-C 106.16 -1.793 . . . . 2.08 106.16 -172.94 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 4.9 m -44.63 -22.81 0.09 Allowed 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 127.072 2.149 . . . . 2.04 115.84 -168.625 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -47.67 -51.15 22.69 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 120.298 1.408 . . . . 1.66 112.523 168.047 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -64.6 -39.31 93.49 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-O 122.545 1.164 . . . . 1.95 109.514 -177.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -67.97 -45.36 74.4 Favored 'General case' 0 N--CA 1.442 -0.849 0 C-N-CA 124.463 1.105 . . . . 2.26 109.196 -174.291 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 37.7 pt -63.37 -38.06 81.17 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.803 0 O-C-N 121.458 -0.776 . . . . 1.81 110.591 174.845 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.8 -46.32 81.65 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 118.994 0.816 . . . . 1.94 110.487 173.247 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.12 -57.51 12.51 Favored 'General case' 0 CA--C 1.533 0.314 0 O-C-N 122.032 -0.417 . . . . 1.67 110.843 173.785 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -47.48 -49.07 26.53 Favored 'General case' 0 C--O 1.232 0.15 0 C-N-CA 125.577 1.551 . . . . 1.79 110.71 -178.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -53.22 -45.09 68.54 Favored 'General case' 0 N--CA 1.444 -0.762 0 C-N-CA 125.185 1.394 . . . . 3.68 109.731 179.638 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -79.3 -46.84 16.93 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 109.903 -0.406 . . . . 3.67 109.903 -174.187 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -63.56 -38.08 89.76 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 110.435 -0.209 . . . . 3.56 110.435 -175.542 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 85.5 m -101.81 46.54 0.93 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.717 0.807 . . . . 2.32 110.331 175.806 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 19.1 mtp85 -69.83 -52.74 22.37 Favored 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 108.499 -0.926 . . . . 5.22 108.499 173.803 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -61.95 138.26 95.62 Favored Pre-proline 0 N--CA 1.441 -0.899 0 CA-C-N 114.174 -1.375 . . . . 2.08 110.398 -175.88 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -60.46 150.99 78.14 Favored 'Trans proline' 0 N--CA 1.452 -0.955 0 C-N-CA 122.623 2.215 . . . . 1.25 110.498 -176.672 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 16.9 t70 56.85 15.93 2.5 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.502 1.521 . . . . 3.37 114.033 176.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 21.0 m -87.52 -12.52 45.63 Favored 'General case' 0 CA--C 1.534 0.364 0 O-C-N 121.004 -1.06 . . . . 2.19 110.789 177.842 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -73.78 117.41 15.53 Favored 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 123.791 0.836 . . . . 3.47 110.449 -171.758 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -115.21 147.1 37.77 Favored Pre-proline 0 CA--C 1.538 0.507 0 C-N-CA 125.222 1.409 . . . . 3.34 110.943 178.037 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_endo -62.71 -76.97 0.02 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.478 0 C-N-CA 124.669 3.579 . . . . 0.82 112.557 -175.645 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.4 tt0 -50.64 -45.2 57.69 Favored 'General case' 0 N--CA 1.445 -0.703 0 C-N-CA 124.886 1.274 . . . . 3.19 111.092 -175.505 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 40.4 tptt -47.32 -68.51 0.18 Allowed 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 124.023 0.929 . . . . 3.63 108.631 170.381 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -50.41 -41.76 52.78 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.358 1.063 . . . . 3.44 112.501 -177.668 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 14.8 m-30 -54.38 -52.29 62.14 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 118.48 0.582 . . . . 6.22 110.317 179.718 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -74.27 -37.96 63.56 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 120.338 -0.545 . . . . 3.43 110.622 -179.278 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -62.58 -34.63 77.38 Favored 'General case' 0 N--CA 1.442 -0.847 0 C-N-CA 124.052 0.941 . . . . 1.71 112.457 -178.686 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 14.9 m -82.65 -0.99 49.8 Favored 'General case' 0 N--CA 1.451 -0.412 0 O-C-N 123.468 0.48 . . . . 2.62 111.382 174.024 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 76.45 -2.5 57.62 Favored Glycine 0 CA--C 1.527 0.831 0 N-CA-C 111.511 -0.636 . . . . 0.91 111.511 -177.277 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -65.29 -31.46 72.61 Favored 'General case' 0 N--CA 1.445 -0.68 0 O-C-N 121.306 -1.114 . . . . 3.48 111.819 -172.709 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 83.0 p -77.3 -15.19 59.55 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 119.392 0.996 . . . . 2.63 112.368 172.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.93 -35.67 21.94 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 108.804 -0.813 . . . . 6.13 108.804 175.194 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 31.8 mmt -55.94 131.51 47.36 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-O 121.834 0.826 . . . . 4.35 110.646 171.564 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 2.0 m -70.56 159.84 33.59 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 115.398 -0.819 . . . . 2.32 109.676 178.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -41.33 -43.82 2.58 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.363 1.065 . . . . 1.72 112.138 177.543 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 66.8 m-20 -48.52 -61.57 1.95 Allowed 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 123.959 0.904 . . . . 2.1 110.304 175.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 22.5 mm-40 -62.15 -44.52 96.44 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 115.568 -0.742 . . . . 2.69 109.382 -179.169 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 57.8 t -59.55 -35.35 58.66 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.63 0 CA-C-N 119.079 0.854 . . . . 1.69 110.116 -178.237 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 3.8 tttp -67.42 -44.56 78.46 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.646 0.778 . . . . 3.55 111.201 174.196 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 73.5 m-20 -60.61 -54.87 40.17 Favored 'General case' 0 C--O 1.233 0.219 0 O-C-N 121.986 -0.446 . . . . 2.97 110.216 177.902 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 3.9 m -58.15 -46.52 88.39 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.241 0 CA-C-O 118.575 -0.726 . . . . 1.83 109.567 179.237 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 4.2 t80 -41.87 -55.15 3.18 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 123.95 0.9 . . . . 6.43 110.99 170.505 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 35.9 mtt85 -59.29 -37.99 79.09 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 118.177 0.444 . . . . 4.65 111.834 177.822 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 14.5 t80 -63.94 -30.2 71.3 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 122.143 -0.348 . . . . 5.08 110.544 177.292 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.3 mm -79.7 -50.01 18.56 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 CA-C-O 118.43 -0.795 . . . . 2.29 111.212 179.519 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -69.26 72.61 0.3 Allowed 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 123.862 0.865 . . . . 2.27 108.853 -176.212 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -61.4 -31.85 71.78 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 125.684 1.594 . . . . 2.01 111.407 -168.464 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 13.5 p-10 -69.64 -32.52 71.25 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 125.395 1.478 . . . . 2.49 111.815 171.237 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 59.23 80.04 0.21 Allowed 'General case' 0 N--CA 1.445 -0.677 0 CA-C-O 122.228 1.013 . . . . 3.52 109.084 -177.577 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 4.9 p -118.08 -70.25 0.8 Allowed 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 107.844 -1.169 . . . . 2.38 107.844 175.176 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 147.68 35.04 0.05 OUTLIER Glycine 0 CA--C 1.53 1.004 0 C-N-CA 126.781 2.134 . . . . 1.78 111.589 -179.831 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 33.0 m-85 -159.71 129.38 5.38 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 105.451 -2.055 . . . . 3.32 105.451 -178.803 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -86.42 75.58 9.76 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 105.202 -2.148 . . . . 2.9 105.202 166.302 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -55.77 133.3 50.91 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 113.874 -1.512 . . . . 1.62 107.724 175.797 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -48.51 -46.07 38.0 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 119.073 0.851 . . . . 5.59 113.151 -164.411 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -56.12 -31.42 63.3 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 122.705 0.402 . . . . 3.05 111.487 -176.923 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 92.4 mt-10 -66.82 -34.34 77.59 Favored 'General case' 0 N--CA 1.453 -0.3 0 O-C-N 120.964 -1.085 . . . . 2.57 110.954 176.66 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 86.9 mt -62.78 -29.21 70.53 Favored 'General case' 0 N--CA 1.456 -0.17 0 O-C-N 122.05 -0.406 . . . . 3.89 110.459 176.343 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 65.9 tttt -60.9 -7.37 2.35 Favored 'General case' 0 CA--C 1.543 0.675 0 O-C-N 121.75 -0.594 . . . . 5.13 112.426 171.438 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 11.8 t80 -137.96 37.42 2.36 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.145 0.978 . . . . 7.19 110.596 168.214 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -75.84 -79.12 0.1 Allowed 'General case' 0 N--CA 1.464 0.231 0 O-C-N 121.434 -0.791 . . . . 4.22 110.074 178.257 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 3.7 tt -62.75 -20.03 64.55 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.258 1.023 . . . . 3.36 110.427 -169.349 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 93.7 mm-40 -46.71 -37.62 8.69 Favored 'General case' 0 CA--C 1.541 0.632 0 O-C-N 121.051 -1.03 . . . . 2.45 112.013 166.154 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.68 -38.22 69.34 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 118.977 0.808 . . . . 3.54 111.204 173.47 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 9.0 m-30 -79.4 -52.25 8.32 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 123.999 0.92 . . . . 4.35 109.698 -177.386 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -150.79 134.79 16.75 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 123.491 0.716 . . . . 3.33 109.942 -175.325 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 15.5 t -58.86 -30.33 67.65 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.584 1.154 . . . . 4.68 111.607 -179.551 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -87.72 16.29 51.06 Favored Glycine 0 CA--C 1.525 0.678 0 C-N-CA 125.515 1.531 . . . . 3.35 111.446 -174.95 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -59.17 171.32 0.75 Allowed 'General case' 0 N--CA 1.444 -0.767 0 C-N-CA 123.544 0.738 . . . . 2.12 112.178 171.462 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 20.5 mmm180 -89.02 -27.32 20.93 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-O 118.396 -0.811 . . . . 4.87 112.795 -176.554 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -28.15 -43.49 0.02 OUTLIER 'General case' 0 N--CA 1.461 0.088 0 C-N-CA 128.694 2.797 . . . . 3.39 115.799 -166.822 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -40.37 -55.75 2.16 Favored 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 126.491 1.916 . . . . 2.65 110.199 174.513 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.68 133.18 42.12 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-O 122.7 1.238 . . . . 2.93 109.432 176.058 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 48.5 mp0 -74.14 -32.39 63.12 Favored 'General case' 0 N--CA 1.436 -1.131 0 CA-C-N 113.623 -1.626 . . . . 3.49 110.513 -179.021 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 19.8 m -54.27 -66.12 0.45 Allowed 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 119.751 1.16 . . . . 1.84 111.009 176.36 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -49.53 -53.15 25.09 Favored 'General case' 0 N--CA 1.452 -0.342 0 O-C-N 122.151 -0.343 . . . . 3.41 111.375 177.07 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -61.9 -43.5 98.72 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-O 121.813 0.816 . . . . 2.28 110.455 -173.743 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 46.9 mmtt -64.59 -28.03 69.35 Favored 'General case' 0 C--O 1.218 -0.599 0 CA-C-O 118.6 -0.714 . . . . 6.15 110.076 179.329 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -53.72 -44.86 70.22 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 119.467 1.031 . . . . 2.28 110.151 170.411 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.5 tt -64.29 -60.0 3.71 Favored 'General case' 0 C--N 1.342 0.249 0 O-C-N 121.85 -0.531 . . . . 4.13 109.718 172.848 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 8.5 tmm? -48.06 -58.14 4.87 Favored 'General case' 0 CA--C 1.536 0.429 0 O-C-N 123.94 0.775 . . . . 3.77 110.734 -173.772 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -38.64 -49.19 1.53 Allowed 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 128.105 2.562 . . . . 1.86 112.45 179.315 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -82.56 -51.79 7.45 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 110.162 -0.31 . . . . 1.37 110.162 -178.14 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -48.83 -40.12 28.09 Favored 'General case' 0 CA--C 1.528 0.128 0 C-N-CA 124.267 1.027 . . . . 1.55 112.221 -179.528 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -72.97 83.43 1.24 Allowed 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 109.79 -0.448 . . . . 0.91 109.79 179.121 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 46.3 m-80 -74.79 37.39 0.11 Allowed 'General case' 0 CA--C 1.539 0.526 0 O-C-N 121.383 -0.823 . . . . 3.08 111.772 177.761 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 20.5 m-20 -121.92 -55.48 1.89 Allowed 'General case' 0 N--CA 1.458 -0.054 0 C-N-CA 124.872 1.269 . . . . 1.24 108.392 174.398 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 93.2 43.53 4.03 Favored Glycine 0 CA--C 1.531 1.071 0 N-CA-C 109.008 -1.637 . . . . 0.82 109.008 -159.28 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -122.05 -55.73 1.87 Allowed 'General case' 0 C--N 1.34 0.182 0 C-N-CA 125.069 1.347 . . . . 2.44 109.655 174.701 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 135.51 -58.49 0.67 Allowed Glycine 0 CA--C 1.528 0.875 0 N-CA-C 110.901 -0.879 . . . . 0.81 110.901 -174.136 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 18.8 mttt -63.78 113.59 3.49 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 109.089 -0.708 . . . . 4.8 109.089 -176.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 6.7 mt -90.8 150.78 3.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 N-CA-C 107.427 -1.323 . . . . 1.69 107.427 174.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -126.94 -178.35 15.27 Favored Glycine 0 CA--C 1.522 0.495 0 N-CA-C 109.711 -1.355 . . . . 0.92 109.711 171.734 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -62.95 -42.67 99.89 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-N 117.288 0.544 . . . . 2.06 109.976 -174.146 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -58.39 -63.51 1.25 Allowed 'General case' 0 N--CA 1.449 -0.515 0 CA-C-O 118.237 -0.887 . . . . 2.62 110.282 177.37 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -45.48 -50.79 12.43 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 119.126 0.876 . . . . 1.24 111.949 175.399 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 57.6 t80 -60.98 -54.07 49.49 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 109.628 -0.508 . . . . 4.68 109.628 -175.407 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 24.9 tt0 -59.34 -46.13 89.46 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 123.769 0.828 . . . . 2.61 110.68 -179.259 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -49.58 -58.84 4.48 Favored 'General case' 0 C--O 1.23 0.038 0 CA-C-N 119.214 0.916 . . . . 3.74 110.416 175.298 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.61 -50.2 68.09 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 120.669 -0.412 . . . . 3.39 110.589 -176.318 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 55.3 t -54.43 -39.29 44.12 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.304 0 C-N-CA 123.02 0.528 . . . . 2.1 111.227 177.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 13.1 t60 -66.31 -19.93 65.95 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 124.247 1.019 . . . . 3.09 110.536 -178.161 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 4.3 t . . . . . 0 C--O 1.253 1.261 0 CA-C-O 117.506 -1.235 . . . . 3.58 110.406 -179.989 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.3 mmt . . . . . 0 N--CA 1.471 0.623 0 N-CA-C 107.514 -1.291 . . . . 9.11 107.514 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 42.1 t -159.96 -174.2 4.45 Favored 'General case' 0 N--CA 1.448 -0.547 0 N-CA-C 105.451 -2.055 . . . . 3.29 105.451 166.705 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 5.3 pt -44.05 -38.92 1.43 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 C-N-CA 126.155 1.782 . . . . 4.1 112.877 -175.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 8.2 t -51.02 -27.9 8.89 Favored 'General case' 0 N--CA 1.425 -1.687 0 C-N-CA 129.326 3.05 . . . . 3.25 113.734 178.136 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 24.8 t0 -152.72 52.1 0.76 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.662 0.785 . . . . 3.56 110.547 -178.762 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 4.5 t -118.98 -56.46 3.61 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.194 0 C-N-CA 125.139 1.376 . . . . 2.43 109.612 175.856 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 2.4 tp -167.67 -55.92 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 105.703 -1.962 . . . . 2.01 105.703 -177.004 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 70.1 m -51.53 -29.0 15.27 Favored 'General case' 0 N--CA 1.442 -0.871 0 N-CA-C 114.894 1.442 . . . . 1.92 114.894 -167.148 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -50.29 -42.86 53.14 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 121.151 -0.968 . . . . 1.98 112.171 173.132 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -69.09 -38.03 78.75 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-O 121.48 0.657 . . . . 2.07 110.462 176.293 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -58.96 -49.35 78.19 Favored 'General case' 0 C--O 1.234 0.257 0 C-N-CA 122.941 0.497 . . . . 4.94 109.716 -179.914 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 11.5 pt -65.35 -38.88 83.62 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.41 0 N-CA-C 109.277 -0.638 . . . . 2.36 109.277 -176.703 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -53.86 -47.7 70.77 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 118.321 0.509 . . . . 1.91 110.595 175.56 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.66 -59.22 5.73 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-O 120.512 0.196 . . . . 1.86 111.088 175.606 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -50.65 -46.83 58.61 Favored 'General case' 0 CA--C 1.528 0.117 0 C-N-CA 124.111 0.964 . . . . 1.66 111.637 -176.827 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 5.1 mp -51.34 -37.6 48.7 Favored 'General case' 0 C--N 1.333 -0.146 0 C-N-CA 124.417 1.087 . . . . 4.96 111.477 178.722 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -82.39 -46.62 13.31 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 109.519 -0.549 . . . . 6.54 109.519 178.306 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -70.56 -31.16 68.09 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 112.112 0.412 . . . . 2.42 112.112 -167.681 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 65.9 m -118.05 47.97 1.48 Allowed 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 125.572 1.549 . . . . 2.0 108.571 171.345 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 37.9 ttt85 -68.88 -32.22 71.72 Favored 'General case' 0 CA--C 1.534 0.339 0 O-C-N 121.673 -0.642 . . . . 6.21 109.983 173.586 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 91.8 m-20 -80.79 150.12 68.76 Favored Pre-proline 0 CA--C 1.539 0.522 0 C-N-CA 125.591 1.556 . . . . 2.25 110.924 -166.542 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -66.05 141.06 62.38 Favored 'Trans proline' 0 N--CA 1.455 -0.747 0 C-N-CA 123.105 2.537 . . . . 1.49 110.21 -174.89 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 63.97 9.18 4.4 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.583 1.553 . . . . 2.31 113.417 177.034 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 24.2 m -92.6 -9.52 40.74 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 119.568 1.077 . . . . 1.98 113.221 -171.666 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -58.43 115.21 2.84 Favored 'General case' 0 N--CA 1.448 -0.569 0 O-C-N 121.764 -0.585 . . . . 4.05 109.672 176.436 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -102.98 148.19 35.23 Favored Pre-proline 0 CA--C 1.532 0.288 0 N-CA-C 108.859 -0.793 . . . . 3.7 108.859 164.07 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -67.23 -65.94 0.04 OUTLIER 'Trans proline' 0 N--CA 1.451 -0.998 0 C-N-CA 123.254 2.636 . . . . 1.18 111.02 -177.062 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 35.4 mt-30 -58.8 -32.33 69.24 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 124.15 0.98 . . . . 2.33 110.841 -178.478 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 18.6 tptm -61.37 -66.56 0.52 Allowed 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 123.5 0.72 . . . . 3.6 109.943 173.093 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 51.3 t80 -54.38 -47.69 72.38 Favored 'General case' 0 C--O 1.221 -0.402 0 C-N-CA 122.975 0.51 . . . . 3.63 109.896 -176.93 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 3.8 t80 -39.01 -58.47 1.11 Allowed 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 126.514 1.926 . . . . 6.4 112.078 172.566 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 30.8 tt0 -72.09 -47.02 54.44 Favored 'General case' 0 N--CA 1.45 -0.458 0 N-CA-C 109.291 -0.633 . . . . 3.09 109.291 -176.803 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -57.63 -34.42 69.29 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 123.197 0.599 . . . . 1.65 110.977 -177.043 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 26.1 t -81.4 -5.03 57.46 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 125.942 1.697 . . . . 2.05 109.876 -177.862 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 74.69 4.13 69.65 Favored Glycine 0 CA--C 1.527 0.841 0 O-C-N 119.11 -2.244 . . . . 1.06 111.608 171.912 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 89.8 mt -60.78 -33.98 73.8 Favored 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 124.814 1.246 . . . . 2.91 109.16 178.147 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 21.1 t -61.64 -33.97 74.86 Favored 'General case' 0 N--CA 1.462 0.156 0 C-N-CA 123.952 0.901 . . . . 2.79 111.229 172.72 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 25.9 tttt -80.6 -36.86 32.18 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 108.403 -0.962 . . . . 5.29 108.403 -176.747 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 25.8 mmt -69.36 135.45 50.37 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-O 121.689 0.757 . . . . 4.97 111.832 -179.573 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 2.6 m -69.89 154.19 42.29 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 123.356 0.662 . . . . 2.18 110.671 179.593 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -42.27 -40.02 2.29 Favored 'General case' 0 C--O 1.222 -0.359 0 C-N-CA 123.853 0.861 . . . . 1.65 112.099 175.301 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 62.8 m-20 -47.52 -59.46 3.23 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.232 1.013 . . . . 2.13 110.94 175.259 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 2.6 mm100 -69.19 -40.17 78.24 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 109.441 -0.577 . . . . 2.72 109.441 -176.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 89.6 t -62.58 -36.6 75.85 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.525 0 CA-C-N 118.748 0.704 . . . . 1.73 109.53 -178.386 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 48.2 tttm -66.26 -46.09 78.3 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 123.213 0.605 . . . . 3.88 109.824 174.372 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -55.31 -57.83 10.19 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 117.93 0.332 . . . . 3.1 110.935 176.141 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 4.7 m -55.77 -46.08 79.67 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.239 0 CA-C-O 118.858 -0.592 . . . . 1.7 109.929 179.218 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -45.24 -53.69 7.97 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 118.603 0.638 . . . . 6.07 110.677 172.017 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 68.3 mtp180 -61.39 -43.42 98.89 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 119.057 0.844 . . . . 3.78 111.721 -179.868 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 13.6 m-85 -62.52 -38.63 90.69 Favored 'General case' 0 C--O 1.235 0.313 0 O-C-N 121.835 -0.541 . . . . 6.14 110.751 179.678 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 38.6 mm -82.65 -39.93 16.3 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 CA-C-O 118.053 -0.975 . . . . 2.81 112.005 -174.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 60.8 t0 -64.12 74.62 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 125.313 1.445 . . . . 1.98 108.141 169.097 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -54.49 155.38 4.02 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 106.612 -1.625 . . . . 3.21 106.612 164.647 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 76.22 -47.15 0.55 Allowed 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 118.757 0.708 . . . . 3.11 111.97 -173.686 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 8.3 mt-30 61.12 45.83 8.73 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.578 0.751 . . . . 3.63 110.351 -174.087 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 34.3 p -53.6 -33.02 53.51 Favored 'General case' 0 C--N 1.34 0.156 0 C-N-CA 124.703 1.201 . . . . 1.93 111.24 173.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 121.34 -23.78 7.5 Favored Glycine 0 CA--C 1.528 0.872 0 N-CA-C 109.633 -1.387 . . . . 1.81 109.633 -167.152 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 65.9 m-85 -126.38 151.89 47.03 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 123.785 0.834 . . . . 3.72 110.107 -176.165 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 18.6 mt -80.56 82.33 6.6 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 105.316 -2.105 . . . . 3.76 105.316 152.516 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -65.17 146.89 54.39 Favored 'General case' 0 CA--C 1.549 0.909 0 CA-C-N 113.268 -1.787 . . . . 2.38 108.416 173.122 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -45.22 -55.87 5.39 Favored 'General case' 0 C--O 1.234 0.287 0 O-C-N 120.668 -1.27 . . . . 3.89 114.324 -171.34 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -51.35 -30.69 19.52 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.781 0.832 . . . . 3.62 111.547 179.041 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -68.34 -45.82 71.85 Favored 'General case' 0 N--CA 1.444 -0.754 0 O-C-N 121.749 -0.595 . . . . 3.1 110.465 178.532 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.74 -30.21 71.34 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 119.556 -0.858 . . . . 3.9 110.156 178.236 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 12.1 ttpp -57.5 -5.96 0.41 Allowed 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.772 1.229 . . . . 2.98 113.465 171.111 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 36.7 p90 -137.67 27.72 2.73 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 119.864 1.211 . . . . 6.38 112.395 165.476 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 63.8 t80 -53.99 -73.38 0.05 OUTLIER 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 124.543 1.137 . . . . 4.12 112.263 -176.136 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.81 -26.0 65.86 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 108.909 -0.774 . . . . 5.01 108.909 -171.636 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -52.22 -38.43 57.98 Favored 'General case' 0 C--O 1.226 -0.151 0 C-N-CA 126.861 2.065 . . . . 3.59 111.231 174.313 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 20.8 mtpt -63.34 -29.29 70.62 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 117.997 0.362 . . . . 3.89 111.744 176.383 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -79.59 -56.18 4.49 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 124.126 0.97 . . . . 6.95 108.875 -178.5 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -104.24 -123.52 0.21 Allowed 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 108.023 -1.102 . . . . 4.16 108.023 -173.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 21.8 p -157.29 -5.64 0.1 Allowed 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 116.577 2.066 . . . . 3.17 116.577 175.608 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -169.33 66.25 0.17 Allowed Glycine 0 C--N 1.334 0.465 0 N-CA-C 108.222 -1.951 . . . . 2.39 108.222 175.528 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -89.02 -106.46 0.08 Allowed 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 117.385 0.593 . . . . 1.99 109.557 -171.16 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 9.4 tpt180 -151.11 50.49 0.84 Allowed 'General case' 0 N--CA 1.457 -0.109 0 CA-C-O 122.194 0.997 . . . . 5.76 110.474 -174.421 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -95.85 -18.05 20.66 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 126.008 1.723 . . . . 4.77 108.946 178.636 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -71.54 -42.86 67.37 Favored 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 124.375 1.07 . . . . 2.29 110.632 -179.204 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.91 126.5 28.73 Favored 'General case' 0 C--N 1.343 0.308 0 C-N-CA 118.401 -1.32 . . . . 2.26 109.47 179.485 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -61.91 -37.41 84.56 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 114.098 -1.41 . . . . 3.62 109.412 174.514 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -66.75 -60.16 2.93 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 117.994 0.361 . . . . 2.17 111.09 -179.083 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -52.94 -41.57 64.62 Favored 'General case' 0 N--CA 1.454 -0.246 0 O-C-N 121.135 -0.978 . . . . 3.11 110.797 177.071 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 4.4 m -59.44 -60.32 4.03 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 119.355 -0.938 . . . . 2.15 110.911 173.144 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 35.4 pttt -61.37 -27.52 68.58 Favored 'General case' 0 C--O 1.213 -0.848 0 C-N-CA 123.511 0.724 . . . . 7.3 110.603 -168.732 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 34.8 m -48.26 -47.3 36.2 Favored 'General case' 0 C--N 1.326 -0.426 0 O-C-N 121.251 -0.906 . . . . 2.3 110.832 170.822 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 11.6 mt -75.09 -54.42 7.18 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 109.183 -0.673 . . . . 3.46 109.183 171.349 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 1.6 tpt -54.67 -20.09 7.49 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 115.178 1.547 . . . . 6.83 115.178 -175.808 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -83.12 -61.17 1.93 Allowed 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 127.057 2.143 . . . . 1.49 109.457 -179.128 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -80.89 -34.14 33.76 Favored 'General case' 0 N--CA 1.455 -0.213 0 O-C-N 121.903 -0.498 . . . . 2.5 111.917 -171.654 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -60.2 -38.94 84.82 Favored 'General case' 0 C--O 1.227 -0.086 0 CA-C-N 118.418 0.554 . . . . 1.73 109.69 172.256 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -66.18 -62.67 1.36 Allowed 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 109.549 -0.538 . . . . 1.9 109.549 176.842 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 10.1 p30 43.59 23.13 0.04 OUTLIER 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 126.553 1.941 . . . . 4.47 115.038 -173.668 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 52.4 m-20 -95.78 -45.44 6.99 Favored 'General case' 0 C--N 1.338 0.091 0 C-N-CA 124.373 1.069 . . . . 1.93 108.339 171.947 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 97.75 41.49 3.34 Favored Glycine 0 CA--C 1.53 0.97 0 N-CA-C 109.463 -1.455 . . . . 1.31 109.463 -158.604 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . 0.252 1.7 p30 -127.74 -54.81 1.32 Allowed 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 118.416 1.108 . . . . 2.08 111.917 171.604 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 114.49 -34.37 4.94 Favored Glycine 0 CA--C 1.53 1.009 0 C-N-CA 124.611 1.101 . . . . 0.89 112.46 176.868 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 52.8 pttt -70.1 127.85 34.26 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-N 118.858 1.329 . . . . 4.72 108.058 173.105 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 8.7 mt -117.46 107.45 22.24 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.156 0 N-CA-C 108.307 -0.998 . . . . 1.96 108.307 -173.185 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -61.88 163.59 24.22 Favored Glycine 0 CA--C 1.526 0.752 0 N-CA-C 111.04 -0.824 . . . . 0.77 111.04 172.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -51.01 -42.86 60.68 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 109.039 -0.726 . . . . 1.87 109.039 168.359 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 8.8 tt0 -57.64 -56.74 18.01 Favored 'General case' 0 N--CA 1.445 -0.68 0 C-N-CA 124.121 0.968 . . . . 2.73 110.044 179.003 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -50.87 -48.07 60.29 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.68 0.792 . . . . 1.5 110.98 176.22 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 79.5 t80 -58.31 -54.56 45.67 Favored 'General case' 0 CA--C 1.538 0.492 0 O-C-N 121.745 -0.597 . . . . 5.46 110.896 179.052 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 13.0 mt-30 -61.96 -29.0 69.94 Favored 'General case' 0 C--O 1.221 -0.422 0 CA-C-O 118.001 -0.999 . . . . 4.05 112.534 177.519 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 23.5 mm-40 -63.01 -59.37 4.91 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 120.288 1.404 . . . . 3.29 107.778 172.374 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 5.6 tpt -54.99 -41.6 71.42 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 110.231 -0.285 . . . . 4.09 110.231 -176.378 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 52.8 t -78.4 -54.86 11.35 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.51 0 N-CA-C 113.153 0.797 . . . . 2.04 113.153 -177.142 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 4.5 t-80 -72.05 -8.77 56.47 Favored 'General case' 0 C--N 1.326 -0.425 0 O-C-N 119.508 -1.995 . . . . 4.7 111.057 -175.702 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 33.2 t . . . . . 0 C--O 1.254 1.319 0 CA-C-O 115.084 -2.389 . . . . 2.79 113.643 167.14 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 29.6 mtt . . . . . 0 N--CA 1.471 0.579 0 CA-C-O 119.384 -0.341 . . . . 8.3 111.242 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.7 m -86.4 -143.93 0.11 Allowed 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 108.83 -0.804 . . . . 2.77 108.83 -168.304 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.3 pp -45.93 -33.43 1.6 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 C-N-CA 124.76 1.224 . . . . 1.95 112.393 179.083 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 9.1 t -64.87 -8.96 17.49 Favored 'General case' 0 N--CA 1.432 -1.361 0 C-N-CA 127.542 2.337 . . . . 2.59 111.541 -176.087 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 29.8 t0 -132.83 7.35 4.05 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 126.681 1.992 . . . . 2.4 109.477 -175.838 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 77.7 t -90.6 -61.31 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.344 0.347 0 O-C-N 121.574 -0.704 . . . . 2.93 109.827 174.361 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -166.26 -60.32 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.196 0 N-CA-C 107.517 -1.29 . . . . 2.02 107.517 -174.116 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 27.5 m -41.45 -25.89 0.05 Allowed 'General case' 0 C--O 1.221 -0.437 0 C-N-CA 126.959 2.103 . . . . 2.14 115.969 -169.846 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -48.09 -47.33 34.26 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 119.81 1.186 . . . . 1.91 112.387 171.416 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -64.71 -41.32 96.08 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-O 122.477 1.132 . . . . 1.75 109.716 179.838 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -68.88 -45.49 70.82 Favored 'General case' 0 N--CA 1.445 -0.683 0 C-N-CA 124.285 1.034 . . . . 2.39 109.384 -172.674 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 32.4 pt -60.93 -37.46 77.02 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.807 0 O-C-N 121.256 -0.902 . . . . 1.9 111.076 175.564 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.85 -43.95 77.58 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 118.68 0.673 . . . . 1.8 110.626 173.52 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.02 -57.12 14.22 Favored 'General case' 0 CA--C 1.534 0.363 0 O-C-N 121.946 -0.471 . . . . 1.98 110.524 172.803 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -47.31 -43.57 22.75 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.845 1.258 . . . . 1.95 111.222 -179.596 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.62 -36.99 77.43 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 126.16 1.784 . . . . 4.25 110.9 -177.614 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -91.38 -42.98 10.02 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 122.818 0.447 . . . . 3.43 110.005 -175.047 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.437 ' OE1' ' NZ ' ' A' ' 29' ' ' LYS . 10.8 pt-20 -69.58 -32.9 71.94 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-O 119.792 -0.146 . . . . 3.54 110.973 -176.531 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 62.1 m -109.15 55.83 0.63 Allowed 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.927 0.891 . . . . 2.21 108.615 175.312 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.88 -53.67 12.48 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 121.608 0.718 . . . . 6.45 109.977 -168.156 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -69.66 140.28 89.32 Favored Pre-proline 0 N--CA 1.445 -0.709 0 CA-C-N 114.266 -1.334 . . . . 3.18 107.592 176.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -51.16 -70.92 0.05 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.659 0 C-N-CA 124.386 3.391 . . . . 4.12 112.089 -164.225 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 12.3 p-10 -77.08 49.35 0.66 Allowed 'General case' 0 CA--C 1.543 0.675 0 O-C-N 121.493 -0.754 . . . . 3.32 112.582 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 2.8 m -122.13 27.76 7.85 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 124.367 1.067 . . . . 2.03 110.151 174.851 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 12.0 t80 -109.1 135.91 49.46 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 124.695 1.198 . . . . 6.04 108.704 -179.869 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 -122.13 142.86 37.61 Favored Pre-proline 0 N--CA 1.451 -0.422 0 N-CA-C 107.696 -1.224 . . . . 3.82 107.696 169.639 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -64.86 -59.03 0.18 Allowed 'Trans proline' 0 N--CA 1.452 -0.963 0 C-N-CA 123.601 2.868 . . . . 1.02 111.296 -177.054 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -52.44 -50.66 62.18 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.307 0.643 . . . . 3.74 110.818 -179.179 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.437 ' NZ ' ' OE1' ' A' ' 18' ' ' GLU . 12.6 tptp -45.53 -65.14 0.58 Allowed 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.433 1.093 . . . . 3.63 108.852 170.105 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -50.49 -44.36 55.86 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 124.879 1.272 . . . . 4.36 112.873 -176.957 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 13.5 m-85 -56.35 -46.54 79.92 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-N 120.036 1.289 . . . . 5.88 111.006 -178.189 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 -70.32 -46.53 64.03 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 109.454 -0.573 . . . . 2.89 109.454 178.019 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -63.8 -33.39 75.56 Favored 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 124.764 1.226 . . . . 1.57 113.137 -174.073 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.4 t -85.67 -1.32 57.04 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 125.319 1.448 . . . . 2.24 109.669 178.843 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 76.95 -11.83 13.61 Favored Glycine 0 CA--C 1.531 1.054 0 O-C-N 121.396 -0.815 . . . . 0.92 112.238 179.309 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 32.6 mt -55.93 -33.84 65.07 Favored 'General case' 0 N--CA 1.444 -0.728 0 C-N-CA 126.518 1.927 . . . . 2.4 112.525 -177.654 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 46.9 t -69.23 -32.95 72.52 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 118.803 0.729 . . . . 2.48 111.301 173.292 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 10.6 tttt -75.43 -34.79 61.02 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 108.563 -0.903 . . . . 4.98 108.563 -179.078 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 36.3 mtt -57.34 124.69 19.75 Favored 'General case' 0 N--CA 1.442 -0.848 0 N-CA-C 109.601 -0.518 . . . . 3.83 109.601 171.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 6.0 m -63.34 160.48 15.89 Favored 'General case' 0 N--CA 1.452 -0.337 0 O-C-N 121.537 -0.727 . . . . 2.24 110.73 176.46 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -41.6 -41.99 2.34 Favored 'General case' 0 C--O 1.224 -0.253 0 C-N-CA 125.005 1.322 . . . . 1.74 112.332 176.22 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 75.8 m-20 -48.69 -61.13 2.19 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.223 0.609 . . . . 2.13 109.886 175.514 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 9.0 mm-40 -62.84 -46.43 87.95 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 115.83 -0.623 . . . . 2.66 109.682 -178.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 62.6 t -58.82 -39.07 76.19 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 CA-C-N 119.789 1.177 . . . . 1.8 110.77 -176.836 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 6.7 ttmt -64.27 -48.43 75.77 Favored 'General case' 0 CA--C 1.536 0.432 0 O-C-N 121.366 -0.834 . . . . 5.76 110.707 172.861 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 78.1 m-20 -61.19 -51.1 70.45 Favored 'General case' 0 CA--C 1.535 0.387 0 O-C-N 121.807 -0.558 . . . . 3.41 110.06 -176.178 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 9.0 m -58.8 -46.65 90.8 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.27 0 CA-C-O 118.412 -0.804 . . . . 1.83 110.105 174.485 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 11.8 t80 -45.65 -48.71 14.82 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 119.291 0.951 . . . . 5.76 111.233 173.257 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 86.3 mtt-85 -61.19 -36.28 79.44 Favored 'General case' 0 CA--C 1.532 0.277 0 O-C-N 121.608 -0.682 . . . . 5.15 112.169 176.377 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 25.1 t80 -64.89 -33.76 76.78 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 118.805 0.729 . . . . 4.95 110.071 173.158 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 14.1 mm -67.25 -58.0 7.83 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.284 0 CA-C-O 117.895 -1.05 . . . . 2.45 111.721 176.583 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -73.18 70.97 1.15 Allowed 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 119.21 0.914 . . . . 2.37 109.457 -173.663 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 15.5 t30 -59.9 -32.63 70.93 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 125.967 1.707 . . . . 2.01 111.887 -170.791 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 17.2 p-10 -74.3 -21.05 59.91 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.473 1.109 . . . . 2.34 111.607 174.494 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 8.1 mt-30 49.92 63.07 2.33 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 126.496 1.919 . . . . 3.15 111.389 -178.103 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.2 p -93.71 -38.82 11.11 Favored 'General case' 0 CA--C 1.521 -0.149 0 CA-C-N 115.698 -0.683 . . . . 1.98 109.978 167.572 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 99.72 18.49 22.82 Favored Glycine 0 CA--C 1.53 0.971 0 CA-C-O 119.71 -0.494 . . . . 1.6 111.925 -169.329 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 36.7 m-85 -135.14 137.64 42.96 Favored 'General case' 0 C--O 1.238 0.454 0 N-CA-C 108.717 -0.846 . . . . 3.93 108.717 163.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -90.91 70.79 6.48 Favored 'General case' 0 C--O 1.231 0.099 0 C-N-CA 126.067 1.747 . . . . 2.78 107.87 168.89 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -63.56 165.64 7.78 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 123.314 0.646 . . . . 1.77 110.59 177.411 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -48.93 -47.38 43.64 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.147 0.979 . . . . 4.32 111.601 -176.837 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -73.74 -18.8 60.94 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 115.679 -0.691 . . . . 3.09 112.56 -177.03 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -70.51 -48.79 53.88 Favored 'General case' 0 CA--C 1.522 -0.105 0 N-CA-C 108.58 -0.896 . . . . 2.67 108.58 165.445 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -49.37 -41.96 40.65 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 115.642 -0.708 . . . . 3.72 110.208 176.861 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 30.3 ttpt -55.02 -8.15 0.25 Allowed 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 114.5 1.296 . . . . 2.86 114.5 176.636 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 32.2 p90 -136.46 18.94 3.12 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 120.584 1.538 . . . . 7.01 113.564 168.37 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 2.7 t80 -42.48 -75.92 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.042 1.337 . . . . 3.86 114.107 -172.562 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 1.5 mt -73.89 -0.2 15.3 Favored 'General case' 0 CA--C 1.532 0.267 0 O-C-N 121.251 -0.905 . . . . 3.34 111.529 178.223 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -72.34 -19.17 61.69 Favored 'General case' 0 CA--C 1.532 0.257 0 O-C-N 120.599 -1.313 . . . . 3.0 110.714 -176.552 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.0 -29.6 68.58 Favored 'General case' 0 CA--C 1.534 0.332 0 O-C-N 122.006 -0.434 . . . . 3.88 111.321 163.654 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 2.5 m-30 -90.56 -65.02 1.05 Allowed 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 108.576 -0.898 . . . . 4.55 108.576 -176.479 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -117.33 119.47 35.25 Favored 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 107.922 -1.14 . . . . 3.08 107.922 -172.79 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 4.2 p -49.22 -34.45 14.91 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 123.73 0.812 . . . . 3.05 112.324 179.536 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -111.81 36.69 4.04 Favored Glycine 0 CA--C 1.524 0.643 0 C-N-CA 124.903 1.239 . . . . 1.68 110.925 -178.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.77 175.68 1.08 Allowed 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 117.617 0.708 . . . . 1.95 110.602 169.397 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.63 3.63 28.1 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 114.523 1.305 . . . . 6.56 114.523 -164.989 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -55.26 -26.51 40.42 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.092 0.957 . . . . 3.05 112.639 -162.702 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.73 -41.81 99.36 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.324 1.45 . . . . 1.94 112.155 173.86 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 53.9 m -64.06 106.29 1.03 Allowed 'General case' 0 C--O 1.236 0.36 0 N-CA-C 108.862 -0.792 . . . . 2.89 108.862 175.059 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -56.54 -37.33 70.35 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-N 115.611 -0.722 . . . . 3.39 110.478 174.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -49.85 -69.72 0.11 Allowed 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 119.394 0.997 . . . . 2.45 112.153 176.129 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 21.6 mt-10 -53.95 -48.18 70.56 Favored 'General case' 0 C--N 1.343 0.285 0 CA-C-N 119.357 0.981 . . . . 4.66 110.611 178.557 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -54.76 -51.82 64.49 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-O 121.658 0.742 . . . . 1.92 109.392 -175.036 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.93 -34.64 73.72 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 124.624 1.17 . . . . 6.2 110.29 -176.268 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 73.4 m -61.07 -48.73 80.34 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 120.14 1.336 . . . . 1.58 110.82 174.039 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 6.3 tp -54.02 -59.26 4.88 Favored 'General case' 0 C--N 1.342 0.271 0 N-CA-C 108.254 -1.017 . . . . 4.19 108.254 172.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 1.7 ttt -47.99 -50.47 27.39 Favored 'General case' 0 CA--C 1.538 0.501 0 O-C-N 123.771 0.669 . . . . 4.72 111.818 -179.014 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -54.92 -51.79 64.98 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 126.141 1.777 . . . . 1.39 111.275 -173.031 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -73.58 -49.08 28.1 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 120.112 -0.635 . . . . 1.37 110.29 177.43 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -48.99 -33.97 12.11 Favored 'General case' 0 C--N 1.339 0.14 0 C-N-CA 123.537 0.735 . . . . 1.66 111.598 -178.781 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 17.3 t0 -79.75 112.13 16.73 Favored 'General case' 0 N--CA 1.439 -0.995 0 C-N-CA 124.41 1.084 . . . . 1.18 112.483 -179.574 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 10.0 m120 -80.41 35.4 0.34 Allowed 'General case' 0 CA--C 1.539 0.534 0 O-C-N 120.958 -1.089 . . . . 3.13 112.312 176.85 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -142.92 -55.04 0.41 Allowed 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 119.727 1.148 . . . . 1.94 111.783 -174.465 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 88.25 40.4 6.52 Favored Glycine 0 CA--C 1.533 1.206 0 N-CA-C 109.283 -1.527 . . . . 1.52 109.283 -152.066 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 20.5 p30 -113.63 -65.03 1.23 Allowed 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 126.087 1.755 . . . . 1.9 109.227 169.254 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 129.45 -32.61 3.18 Favored Glycine 0 CA--C 1.524 0.598 0 C-N-CA 124.751 1.167 . . . . 0.84 111.001 -177.575 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 19.2 pttm -63.03 121.71 14.25 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 107.549 -1.278 . . . . 6.55 107.549 173.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 14.4 mt -123.57 118.56 54.73 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 C-N-CA 124.996 1.318 . . . . 1.82 107.726 -172.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -86.31 174.0 46.69 Favored Glycine 0 CA--C 1.531 1.041 0 N-CA-C 110.9 -0.88 . . . . 0.81 110.9 172.607 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -60.51 -42.22 95.94 Favored 'General case' 0 C--O 1.224 -0.271 0 O-C-N 122.222 -0.575 . . . . 2.07 109.643 175.915 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 -57.08 -57.46 12.48 Favored 'General case' 0 N--CA 1.447 -0.575 0 C-N-CA 123.39 0.676 . . . . 2.5 109.726 177.031 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 -48.36 -51.25 27.24 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 121.669 0.747 . . . . 1.31 110.213 177.017 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 12.5 t80 -61.24 -54.31 45.77 Favored 'General case' 0 CA--C 1.534 0.334 0 O-C-N 121.944 -0.473 . . . . 4.13 111.632 -176.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 23.9 tt0 -58.59 -45.27 89.45 Favored 'General case' 0 C--O 1.225 -0.185 0 C-N-CA 125.487 1.515 . . . . 2.64 110.885 -178.085 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 55.1 mt-10 -49.2 -54.21 17.64 Favored 'General case' 0 C--N 1.34 0.168 0 CA-C-N 119.219 0.918 . . . . 3.16 110.154 175.042 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 2.5 tpp -64.61 -52.84 55.39 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 116.088 -0.506 . . . . 5.41 110.117 -177.649 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 50.1 t -53.62 -37.72 32.07 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.225 0 C-N-CA 123.493 0.717 . . . . 1.6 111.647 -179.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 10.4 t-80 -63.9 -21.35 66.42 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 124.967 1.307 . . . . 4.5 110.487 -178.904 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 18.4 t . . . . . 0 C--O 1.252 1.193 0 N-CA-C 112.564 0.579 . . . . 3.7 112.564 -177.96 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 39.6 mtt . . . . . 0 N--CA 1.478 0.947 0 CA-C-O 119.344 -0.36 . . . . 9.22 111.246 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 44.0 t -142.98 -150.06 0.3 Allowed 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 105.463 -2.051 . . . . 3.51 105.463 -177.127 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -50.68 -27.46 4.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 C-N-CA 124.285 1.034 . . . . 3.15 112.932 178.055 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -56.04 -40.16 73.08 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-O 122.04 0.924 . . . . 3.08 108.985 178.49 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 41.9 t0 -89.7 42.46 1.09 Allowed 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 128.04 2.536 . . . . 3.34 109.248 -172.793 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 40.3 t -144.94 -63.96 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.341 0.21 0 C-N-CA 125.075 1.35 . . . . 2.8 109.319 -176.926 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 10.8 tp -166.52 -57.16 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.131 0 N-CA-C 107.074 -1.454 . . . . 2.36 107.074 -174.858 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 1.6 m -42.01 -29.27 0.21 Allowed 'General case' 0 N--CA 1.446 -0.638 0 C-N-CA 128.553 2.741 . . . . 1.89 115.465 -165.3 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -45.89 -49.08 15.94 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.925 0.89 . . . . 1.66 112.139 173.798 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -61.52 -45.16 95.38 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 122.419 1.104 . . . . 1.79 109.283 -179.076 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -67.04 -47.28 71.85 Favored 'General case' 0 N--CA 1.445 -0.708 0 C-N-CA 124.608 1.163 . . . . 2.3 109.044 -171.768 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 19.2 pt -63.62 -39.59 85.92 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.801 0 O-C-N 121.774 -0.578 . . . . 2.23 111.175 176.221 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.44 -46.54 83.48 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 118.733 0.697 . . . . 2.04 110.779 173.852 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.59 -53.16 61.5 Favored 'General case' 0 CA--C 1.531 0.232 0 O-C-N 121.752 -0.593 . . . . 1.82 110.642 173.744 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -51.81 -43.92 63.28 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 124.683 1.193 . . . . 1.58 111.172 -178.818 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -54.6 -35.74 63.7 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 124.539 1.136 . . . . 3.83 111.079 176.972 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 4.7 mt-30 -86.43 -43.89 12.45 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 118.238 0.472 . . . . 3.69 111.383 179.326 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.12 -45.5 92.79 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-O 121.689 0.757 . . . . 3.48 109.608 179.94 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 4.2 t -99.01 36.91 1.61 Allowed 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 126.216 1.806 . . . . 2.53 110.035 -175.229 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 57.7 ttp180 -74.14 -45.98 45.39 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 108.895 -0.78 . . . . 6.8 108.895 -178.719 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -81.56 147.88 60.68 Favored Pre-proline 0 N--CA 1.446 -0.665 0 N-CA-C 108.008 -1.108 . . . . 2.28 108.008 -163.111 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -65.1 146.7 87.63 Favored 'Trans proline' 0 N--CA 1.452 -0.951 0 C-N-CA 121.803 1.669 . . . . 1.35 110.923 -168.053 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 53.02 46.08 27.49 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 126.102 1.761 . . . . 2.6 112.203 177.043 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 3.0 m -118.01 6.5 12.14 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.147 1.379 . . . . 1.61 112.79 -179.172 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 2.8 t80 -81.7 83.98 6.95 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 119.86 -1.775 . . . . 3.53 110.358 -172.748 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -69.77 138.31 88.07 Favored Pre-proline 0 CA--C 1.539 0.522 0 N-CA-C 109.051 -0.722 . . . . 2.71 109.051 166.798 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -64.54 -60.97 0.12 Allowed 'Trans proline' 0 N--CA 1.45 -1.042 0 C-N-CA 122.674 2.249 . . . . 0.72 111.21 -179.393 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -59.6 -45.74 91.03 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 122.914 0.486 . . . . 3.25 110.456 -177.425 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -49.36 -60.44 2.82 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 109.769 -0.456 . . . . 5.27 109.769 174.389 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 7.6 t80 -63.25 -41.53 99.08 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-O 120.783 0.325 . . . . 5.37 111.176 -173.068 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -46.0 -54.81 7.75 Favored 'General case' 0 C--O 1.235 0.297 0 C-N-CA 125.243 1.417 . . . . 6.56 110.257 173.388 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -72.2 -49.29 36.57 Favored 'General case' 0 N--CA 1.443 -0.811 0 N-CA-C 108.426 -0.953 . . . . 2.52 108.426 -173.348 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -54.99 -36.23 65.19 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 124.193 0.997 . . . . 1.89 111.164 -179.5 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 22.3 t -85.17 -2.33 57.91 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 123.577 0.751 . . . . 2.39 111.932 -176.143 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 82.79 0.8 90.41 Favored Glycine 0 C--N 1.339 0.736 0 CA-C-N 119.216 0.916 . . . . 0.94 112.253 168.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -59.33 -30.33 68.29 Favored 'General case' 0 CA--C 1.536 0.43 0 O-C-N 121.65 -0.912 . . . . 3.65 109.609 175.13 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 28.9 p -52.58 -42.31 64.39 Favored 'General case' 0 CA--C 1.523 -0.085 0 C-N-CA 124.73 1.212 . . . . 4.14 112.153 168.217 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 9.5 tttt -91.71 -28.45 17.42 Favored 'General case' 0 N--CA 1.444 -0.736 0 N-CA-C 109.52 -0.548 . . . . 6.74 109.52 -168.25 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 8.2 mmt -52.9 -46.5 68.04 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 113.599 0.963 . . . . 3.37 113.599 -175.484 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 19.4 m 93.19 147.79 0.03 OUTLIER 'General case' 0 C--N 1.34 0.164 0 C-N-CA 128.323 2.649 . . . . 2.84 109.675 -176.958 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -41.21 -36.72 0.8 Allowed 'General case' 0 N--CA 1.463 0.189 0 C-N-CA 125.682 1.593 . . . . 2.03 113.233 -174.665 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -67.76 -60.96 2.12 Favored 'General case' 0 N--CA 1.456 -0.136 0 N-CA-C 108.406 -0.961 . . . . 2.06 108.406 -174.594 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 23.3 mm100 -53.45 -49.98 66.25 Favored 'General case' 0 C--O 1.22 -0.49 0 CA-C-N 115.349 -0.841 . . . . 2.71 108.85 175.677 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 74.2 t -54.15 -46.93 67.61 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.503 0 CA-C-N 118.404 0.547 . . . . 1.8 111.222 -178.066 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 10.2 tmtt? -62.71 -43.14 99.58 Favored 'General case' 0 CA--C 1.535 0.402 0 O-C-N 121.034 -1.041 . . . . 5.16 110.801 176.881 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 80.5 m-20 -65.24 -48.13 74.37 Favored 'General case' 0 CA--C 1.537 0.449 0 O-C-N 121.483 -0.761 . . . . 3.78 110.297 -179.012 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 3.4 m -57.01 -43.87 81.76 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.213 0 O-C-N 121.241 -0.912 . . . . 1.71 110.31 174.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 6.9 t80 -47.87 -52.95 17.23 Favored 'General case' 0 C--N 1.344 0.327 0 N-CA-C 109.358 -0.608 . . . . 5.3 109.358 172.652 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 11.8 mtt180 -66.53 -32.72 74.25 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 113.733 1.012 . . . . 6.12 113.733 179.526 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 20.0 m-85 -56.21 -40.0 73.36 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 119.937 1.244 . . . . 5.82 110.715 170.451 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.9 mp -78.65 -44.56 25.77 Favored 'Isoleucine or valine' 0 C--O 1.241 0.607 0 O-C-N 121.82 -0.55 . . . . 3.2 111.923 -178.325 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 20.6 t0 -65.61 79.31 0.07 Allowed 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 125.131 1.372 . . . . 1.76 109.106 178.749 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 13.5 t30 -44.78 -56.86 4.12 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 126.516 1.926 . . . . 2.4 112.433 -173.474 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -60.94 -15.68 34.01 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.984 1.714 . . . . 2.52 113.421 177.188 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 13.9 mt-30 57.04 29.79 17.09 Favored 'General case' 0 C--O 1.235 0.3 0 C-N-CA 125.092 1.357 . . . . 3.18 111.331 -175.374 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.4 p -64.05 -20.77 66.17 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.541 0.737 . . . . 2.08 111.636 178.55 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 86.64 15.66 63.24 Favored Glycine 0 CA--C 1.53 0.979 0 N-CA-C 110.38 -1.088 . . . . 1.73 110.38 -172.459 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 76.6 m-85 -136.99 124.77 22.5 Favored 'General case' 0 CA--C 1.515 -0.375 0 C-N-CA 124.803 1.241 . . . . 4.08 108.612 -175.916 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -73.38 83.63 1.44 Allowed 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 104.064 -2.569 . . . . 3.44 104.064 151.972 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -66.75 164.85 16.22 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 107.206 -1.405 . . . . 3.07 107.206 166.204 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -42.07 -51.49 4.53 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 124.545 1.138 . . . . 5.94 112.347 -176.051 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -68.17 -24.31 64.95 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 113.012 0.745 . . . . 3.33 113.012 -173.226 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -57.67 -40.87 80.35 Favored 'General case' 0 C--N 1.341 0.224 0 CA-C-N 120.314 1.415 . . . . 3.29 110.218 172.152 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.2 mp -65.64 -17.95 64.97 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 120.191 -0.603 . . . . 3.65 111.514 179.858 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 29.5 ttpt -79.1 -14.3 59.21 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 118.956 0.798 . . . . 3.24 111.353 172.844 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 68.5 m-85 -145.17 61.34 1.3 Allowed 'General case' 0 C--O 1.241 0.612 0 C-N-CA 124.267 1.027 . . . . 6.04 109.996 175.054 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 18.4 t80 -91.84 -80.42 0.36 Allowed 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.974 1.31 . . . . 4.0 108.84 -175.3 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 8.2 mp -65.25 -4.79 5.68 Favored 'General case' 0 N--CA 1.465 0.301 0 O-C-N 120.683 -1.26 . . . . 3.03 113.379 170.871 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.13 -23.18 66.41 Favored 'General case' 0 N--CA 1.45 -0.466 0 O-C-N 121.262 -0.898 . . . . 2.83 111.4 171.213 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 6.8 mptt -91.52 -42.73 10.09 Favored 'General case' 0 C--N 1.342 0.277 0 CA-C-N 119.298 0.954 . . . . 4.49 110.886 167.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 45.0 m-85 -55.4 -50.23 70.3 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 118.447 0.567 . . . . 4.99 111.462 -177.377 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 25.2 tp10 -110.97 -66.78 1.05 Allowed 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 124.927 1.291 . . . . 3.47 108.904 -177.087 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 48.6 m 107.63 113.52 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 128.377 2.671 . . . . 4.03 109.026 -165.564 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 74.25 44.74 27.52 Favored Glycine 0 CA--C 1.527 0.842 0 N-CA-C 111.384 -0.686 . . . . 2.52 111.384 176.618 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -85.47 -118.59 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.537 0.735 . . . . 2.04 110.13 177.166 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.24 -7.08 12.41 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.242 1.017 . . . . 4.52 113.006 -169.239 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -54.38 -32.86 57.97 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 126.252 1.821 . . . . 2.93 112.871 -158.893 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -57.63 -41.72 81.94 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 124.26 1.024 . . . . 2.23 111.596 176.136 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 49.5 m -67.55 104.6 1.62 Allowed 'General case' 0 C--O 1.235 0.295 0 CA-C-N 118.957 0.799 . . . . 1.98 110.04 -178.846 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 13.9 mp0 -61.8 -36.5 81.29 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 115.66 -0.7 . . . . 3.41 110.508 -177.461 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 22.1 t -54.72 -55.68 27.32 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 118.828 0.74 . . . . 1.95 110.687 177.86 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -63.45 -47.89 79.97 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 123.991 0.917 . . . . 3.15 109.124 -178.193 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -52.96 -45.66 67.84 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 115.897 -0.592 . . . . 1.96 110.432 176.534 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 5.1 mmpt? -68.69 -37.74 79.79 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 124.249 1.02 . . . . 5.92 110.883 -178.971 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 22.7 t -51.89 -51.43 56.87 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 119.343 0.974 . . . . 2.3 109.129 171.373 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -62.85 -54.27 41.38 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 118.98 -0.533 . . . . 3.4 110.207 179.19 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 51.4 ttm -46.68 -50.95 17.03 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 118.254 0.479 . . . . 4.14 111.408 176.11 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -54.91 -46.66 74.9 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 125.735 1.614 . . . . 1.64 111.624 -171.009 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -82.16 -38.26 24.95 Favored 'General case' 0 CA--C 1.529 0.14 0 N-CA-C 111.779 0.289 . . . . 2.07 111.779 -179.79 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -63.98 -44.06 93.83 Favored 'General case' 0 N--CA 1.457 -0.115 0 N-CA-C 111.646 0.239 . . . . 1.61 111.646 -179.085 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -65.4 119.27 10.68 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 108.875 -0.787 . . . . 1.04 108.875 178.934 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -103.2 12.01 36.21 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 122.501 0.32 . . . . 3.72 111.508 -174.473 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 34.2 m-20 -103.45 -43.74 5.32 Favored 'General case' 0 C--N 1.34 0.159 0 C-N-CA 124.035 0.934 . . . . 1.59 109.803 179.811 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 90.33 40.17 5.82 Favored Glycine 0 CA--C 1.529 0.968 0 N-CA-C 108.95 -1.66 . . . . 0.96 108.95 -156.354 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -118.45 -59.7 1.85 Allowed 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 117.811 0.805 . . . . 2.46 110.322 177.688 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 131.11 -43.2 1.31 Allowed Glycine 0 CA--C 1.528 0.861 0 C-N-CA 123.827 0.727 . . . . 0.57 111.432 179.559 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 18.5 mtpt -69.36 123.91 22.47 Favored 'General case' 0 N--CA 1.451 -0.405 0 N-CA-C 108.771 -0.826 . . . . 6.64 108.771 176.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 9.7 mt -108.5 110.37 31.76 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.204 0 N-CA-C 109.854 -0.424 . . . . 1.87 109.854 -168.412 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -63.62 157.51 41.43 Favored Glycine 0 CA--C 1.532 1.113 0 N-CA-C 111.106 -0.798 . . . . 0.84 111.106 170.655 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -55.24 -37.75 67.59 Favored 'General case' 0 C--N 1.339 0.137 0 O-C-N 121.936 -0.744 . . . . 1.74 109.745 169.798 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -55.48 -60.88 2.81 Favored 'General case' 0 N--CA 1.448 -0.53 0 C-N-CA 124.308 1.043 . . . . 2.85 109.672 176.582 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -47.87 -49.21 30.24 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.203 1.001 . . . . 1.3 111.279 176.225 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -61.34 -51.79 67.34 Favored 'General case' 0 N--CA 1.457 -0.117 0 CA-C-O 121.401 0.62 . . . . 4.48 110.99 -178.033 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 10.7 tm0? -58.61 -36.5 74.13 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-O 117.74 -1.124 . . . . 3.66 110.438 178.573 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -60.11 -61.46 2.59 Favored 'General case' 0 N--CA 1.457 -0.099 0 CA-C-N 120.012 1.278 . . . . 3.37 110.761 170.44 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 3.7 ttp -54.31 -38.73 66.28 Favored 'General case' 0 C--N 1.34 0.161 0 CA-C-O 120.881 0.372 . . . . 6.31 110.508 -173.569 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 54.6 t -70.56 -76.02 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.446 -0.673 0 C-N-CA 123.388 0.675 . . . . 1.75 110.085 174.363 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 52.8 t-80 -50.82 -44.32 59.13 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 123.668 0.787 . . . . 4.25 111.211 -167.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.251 1.151 0 O-C-N 124.622 1.202 . . . . 5.64 109.557 -174.425 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.512 HG22 HG12 ' A' ' 47' ' ' VAL . 1.6 pp . . . . . 0 CA--C 1.53 0.206 0 CA-C-O 121.616 0.722 . . . . 1.24 110.567 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 12.5 t -66.0 -9.85 34.12 Favored 'General case' 0 N--CA 1.426 -1.667 0 C-N-CA 127.673 2.389 . . . . 1.69 112.078 -174.386 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 26.4 t0 -138.59 28.46 2.44 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.14 0.976 . . . . 2.81 109.822 178.206 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 1.1 p -100.55 -46.74 11.77 Favored 'Isoleucine or valine' 0 C--N 1.344 0.327 0 O-C-N 121.682 -0.636 . . . . 1.93 109.907 173.554 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 173.24 -58.8 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 106.956 -1.498 . . . . 1.1 106.956 -165.742 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -43.48 -31.62 0.74 Allowed 'General case' 0 C--O 1.218 -0.556 0 C-N-CA 126.291 1.836 . . . . 1.31 114.478 -169.386 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -45.5 -47.9 14.08 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 119.235 0.925 . . . . 0.62 112.874 173.775 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -67.21 -42.31 84.31 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-O 122.239 1.019 . . . . 1.78 109.789 -179.86 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -64.86 -43.52 92.72 Favored 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 123.734 0.814 . . . . 2.41 109.425 -175.059 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 26.6 pt -67.1 -39.38 83.1 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.858 0 O-C-N 121.426 -0.796 . . . . 0.74 111.02 176.522 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.63 -40.56 72.31 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 118.649 0.659 . . . . 0.65 110.787 171.907 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.85 -57.09 10.91 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 121.914 -0.491 . . . . 0.57 111.057 171.557 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -46.81 -47.59 21.0 Favored 'General case' 0 N--CA 1.462 0.158 0 C-N-CA 125.895 1.678 . . . . 0.57 111.138 -177.862 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 16.0 tp -48.45 -48.54 37.42 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 125.941 1.696 . . . . 2.6 109.595 178.243 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 -82.94 -43.3 16.63 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 110.517 -0.179 . . . . 3.24 110.517 -174.297 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -66.87 -38.85 87.12 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 110.527 -0.175 . . . . 2.29 110.527 -173.561 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 56.6 m -106.92 62.55 0.63 Allowed 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 124.537 1.135 . . . . 1.52 108.084 166.905 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -74.95 -41.93 58.66 Favored 'General case' 0 N--CA 1.464 0.265 0 O-C-N 121.799 -0.563 . . . . 5.31 109.514 170.972 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -78.81 148.39 72.4 Favored Pre-proline 0 N--CA 1.45 -0.459 0 C-N-CA 123.741 0.816 . . . . 1.98 111.126 -160.238 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -66.3 130.11 23.18 Favored 'Trans proline' 0 N--CA 1.449 -1.114 0 C-N-CA 123.006 2.471 . . . . 1.3 110.915 -175.146 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 74.4 37.62 0.56 Allowed 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 127.689 2.396 . . . . 2.97 110.343 173.317 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 16.1 m -115.71 -6.56 12.14 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.214 1.006 . . . . 0.66 112.759 -173.945 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -80.62 83.42 6.4 Favored 'General case' 0 CA--C 1.535 0.393 0 O-C-N 120.694 -1.254 . . . . 2.3 111.248 -160.836 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -68.17 143.54 96.02 Favored Pre-proline 0 CA--C 1.534 0.332 0 O-C-N 121.596 -0.69 . . . . 2.57 110.183 178.143 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -71.6 -62.52 0.04 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.24 0 C-N-CA 122.562 2.175 . . . . 0.65 111.883 -175.095 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 37.1 mt-30 -55.07 -46.05 75.38 Favored 'General case' 0 C--O 1.233 0.193 0 C-N-CA 123.254 0.621 . . . . 2.4 109.801 179.336 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 42.8 tptt -49.96 -56.64 9.82 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 116.009 -0.541 . . . . 3.26 109.786 173.218 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 54.9 t80 -56.26 -50.97 69.84 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 111.534 0.198 . . . . 2.26 111.534 179.841 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 31.0 m-85 -56.67 -34.6 67.53 Favored 'General case' 0 CA--C 1.532 0.272 0 O-C-N 121.319 -0.863 . . . . 5.25 112.008 -178.963 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 5.5 mm-40 -71.93 -58.6 3.32 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 108.568 -0.901 . . . . 3.17 108.568 174.567 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -63.99 -25.28 68.06 Favored 'General case' 0 N--CA 1.439 -1.005 0 C-N-CA 123.945 0.898 . . . . 0.65 111.839 -169.401 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 18.5 t -85.02 -7.83 58.97 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 126.02 1.728 . . . . 1.48 111.44 179.318 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 86.24 -11.78 62.21 Favored Glycine 0 C--N 1.338 0.674 0 N-CA-C 111.376 -0.69 . . . . 0.7 111.376 174.512 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 93.5 mt -54.78 -42.83 72.23 Favored 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 125.516 1.526 . . . . 1.29 111.029 -179.654 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 5.3 t -72.02 -13.5 61.62 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.102 0.561 . . . . 1.87 111.977 177.159 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -89.45 -35.94 15.71 Favored 'General case' 0 N--CA 1.452 -0.345 0 O-C-N 121.337 -0.852 . . . . 3.49 109.863 174.469 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 59.9 mtt -57.13 152.39 13.57 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 121.603 0.716 . . . . 2.89 111.361 174.295 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 23.8 t -78.69 154.76 29.86 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 116.213 -0.449 . . . . 1.99 109.905 174.579 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -41.0 -44.57 2.4 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 125.602 1.561 . . . . 0.56 112.129 176.018 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 68.3 m-80 -54.33 -58.22 8.24 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.304 0.642 . . . . 1.59 110.339 178.85 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 3.6 mm-40 -59.82 -44.61 93.93 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 123.077 0.551 . . . . 2.67 109.849 -179.864 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.416 ' CG1' ' CZ ' ' A' ' 48' ' ' PHE . 53.1 t -57.91 -43.95 85.59 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 CA-C-O 121.293 0.568 . . . . 0.6 109.523 -179.264 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 21.6 tttt -63.27 -48.92 76.14 Favored 'General case' 0 N--CA 1.452 -0.37 0 O-C-N 121.289 -0.882 . . . . 2.98 110.922 176.288 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -51.54 -54.09 31.02 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 118.18 0.446 . . . . 3.07 110.671 176.363 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.512 HG12 HG22 ' A' ' 3' ' ' ILE 0.27 17.4 m -54.7 -44.34 70.04 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.206 0 CA-C-O 118.826 -0.607 . . . . 0.58 110.984 178.802 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.559 ' CZ ' ' HB3' ' A' ' 103' ' ' PHE . 15.1 m-30 -54.21 -40.39 67.6 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 119.153 0.888 . . . . 5.94 112.783 174.343 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 69.7 mtp85 -57.25 -42.02 80.72 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 118.613 0.642 . . . . 2.96 109.947 174.906 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 -68.64 -33.24 73.67 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 118.67 -0.681 . . . . 5.56 110.949 176.77 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 14.0 mm -63.65 -59.81 3.72 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 CA-C-O 118.433 -0.794 . . . . 1.5 110.89 175.718 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 55.6 t0 -74.13 71.18 1.63 Allowed 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 119.194 0.906 . . . . 1.87 110.554 -175.791 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 27.7 t30 -46.32 -47.24 18.49 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 125.888 1.675 . . . . 1.92 111.0 176.617 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -64.39 -19.26 65.38 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 126.639 1.976 . . . . 3.96 112.12 -177.905 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 59.64 12.64 2.97 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 127.08 2.152 . . . . 4.61 113.58 178.677 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 3.9 p -70.12 -10.32 58.39 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 113.83 1.048 . . . . 2.21 113.83 -170.138 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 85.71 34.89 12.4 Favored Glycine 0 CA--C 1.529 0.937 0 CA-C-N 118.933 0.788 . . . . 2.43 111.968 172.067 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -171.05 143.71 2.01 Favored 'General case' 0 CA--C 1.519 -0.233 0 C-N-CA 127.289 2.235 . . . . 2.75 105.001 175.625 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -102.93 68.54 1.0 Allowed 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 107.309 -1.367 . . . . 2.27 107.309 176.272 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -56.81 146.45 26.16 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.744 1.618 . . . . 1.67 110.761 179.362 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -44.89 -51.26 9.84 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 123.512 0.725 . . . . 3.54 112.953 -175.395 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -69.67 -19.62 63.59 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 121.968 -0.457 . . . . 3.28 111.917 -173.39 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 91.4 mt-10 -77.64 -44.57 27.77 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-O 121.293 0.568 . . . . 2.39 109.598 167.413 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 6.4 tp -53.23 -28.24 26.2 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.644 0.777 . . . . 2.63 110.978 174.191 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 30.2 ttpt -50.67 -16.71 0.42 Allowed 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 113.904 1.076 . . . . 2.47 113.904 169.326 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 27.5 p90 -127.48 33.93 4.76 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 120.097 1.317 . . . . 5.25 112.634 170.138 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 46.4 t80 -57.76 -67.36 0.34 Allowed 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.649 0.78 . . . . 2.45 110.794 178.431 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 2.9 tp -85.38 -9.27 57.79 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.473 -0.767 . . . . 2.39 112.066 -175.79 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 49.5 mm-40 -56.0 -18.72 10.11 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.098 0.959 . . . . 1.61 111.399 171.405 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -83.04 -16.39 47.22 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 121.196 -0.94 . . . . 3.55 111.476 177.969 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 6.3 m-30 -101.16 -53.87 2.92 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 124.674 1.189 . . . . 3.25 108.916 -179.1 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -112.83 161.2 17.21 Favored 'General case' 0 C--O 1.222 -0.371 0 N-CA-C 106.606 -1.627 . . . . 3.35 106.606 175.8 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 24.1 m -85.66 -34.62 21.27 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 118.896 0.771 . . . . 2.08 110.524 172.629 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -114.48 42.61 1.88 Allowed Glycine 0 CA--C 1.519 0.324 0 N-CA-C 109.568 -1.413 . . . . 1.04 109.568 -170.444 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.08 -171.57 0.92 Allowed 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 120.953 0.406 . . . . 1.28 111.01 177.552 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.7 -13.59 39.31 Favored 'General case' 0 N--CA 1.453 -0.287 0 O-C-N 121.696 -0.628 . . . . 3.0 112.545 -166.112 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -46.47 -40.59 12.64 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 126.842 2.057 . . . . 3.11 112.802 -163.445 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.401 HD22 ' H ' ' A' ' 78' ' ' LEU . 0.2 OUTLIER -49.04 -43.1 40.37 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.607 1.163 . . . . 0.81 112.144 175.584 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 91.8 m -69.26 104.77 2.31 Favored 'General case' 0 C--O 1.235 0.304 0 O-C-N 121.523 -0.736 . . . . 0.77 109.98 175.997 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -54.77 -41.98 71.14 Favored 'General case' 0 C--O 1.219 -0.542 0 CA-C-N 115.609 -0.723 . . . . 3.07 111.671 178.807 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 34.7 t -54.28 -53.91 47.37 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-O 121.463 0.649 . . . . 1.79 111.081 -178.463 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -63.36 -47.67 81.12 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 124.074 0.949 . . . . 2.89 108.577 -178.765 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -52.22 -44.91 65.03 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 116.177 -0.465 . . . . 0.55 111.229 174.232 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -76.42 -27.3 56.2 Favored 'General case' 0 C--O 1.221 -0.422 0 C-N-CA 124.219 1.007 . . . . 5.09 110.718 -175.793 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 24.6 m -61.6 -45.96 91.87 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 119.089 0.859 . . . . 1.5 109.798 168.667 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -59.3 -57.91 10.96 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 110.039 -0.356 . . . . 2.78 110.039 172.194 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 22.2 ttp -47.16 -52.64 15.05 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.22 0.608 . . . . 3.07 111.366 178.214 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -49.65 -51.37 38.41 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 126.117 1.767 . . . . 0.5 111.537 -172.028 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -78.02 -41.73 34.81 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-O 119.853 -0.118 . . . . 0.49 111.294 179.835 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -54.81 -41.36 70.54 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-O 120.682 0.277 . . . . 0.35 111.036 179.263 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -77.76 80.96 4.21 Favored 'General case' 0 N--CA 1.445 -0.688 0 C-N-CA 123.245 0.618 . . . . 0.93 111.083 -176.574 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 52.8 p-10 -76.26 41.31 0.23 Allowed 'General case' 0 CA--C 1.541 0.633 0 O-C-N 121.405 -0.809 . . . . 2.79 112.16 176.374 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 29.2 m-20 -126.11 -58.98 1.35 Allowed 'General case' 0 C--N 1.342 0.251 0 C-N-CA 126.193 1.797 . . . . 1.25 108.299 172.913 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 93.94 44.33 3.62 Favored Glycine 0 CA--C 1.53 0.971 0 N-CA-C 109.147 -1.581 . . . . 0.82 109.147 -157.304 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 41.0 p-10 -124.87 -47.43 1.8 Allowed 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 124.621 1.168 . . . . 2.05 110.318 172.395 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 115.7 -31.24 6.22 Favored Glycine 0 CA--C 1.524 0.638 0 C-N-CA 124.618 1.104 . . . . 0.64 111.227 170.655 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 21.5 pttp -69.34 114.22 7.39 Favored 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 107.692 -1.225 . . . . 5.16 107.692 168.715 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 19.7 mt -103.83 115.57 46.02 Favored 'Isoleucine or valine' 0 C--O 1.231 0.13 0 C-N-CA 123.551 0.74 . . . . 0.66 109.36 -171.842 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -72.28 162.15 54.48 Favored Glycine 0 CA--C 1.534 1.267 0 CA-C-O 121.831 0.684 . . . . 0.55 112.143 172.463 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -57.11 -40.09 76.38 Favored 'General case' 0 C--O 1.226 -0.184 0 O-C-N 121.78 -0.835 . . . . 0.6 109.673 172.106 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -56.19 -54.18 48.23 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.978 0.911 . . . . 2.57 110.274 177.262 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -51.66 -50.53 60.19 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.079 0.952 . . . . 1.27 110.422 176.954 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' PHE . . . . . 0.559 ' HB3' ' CZ ' ' A' ' 48' ' ' PHE . 3.4 m-85 -61.12 -44.22 97.68 Favored 'General case' 0 CA--C 1.534 0.364 0 O-C-N 121.87 -0.519 . . . . 3.78 111.709 177.847 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 30.9 tt0 -57.42 -49.83 74.95 Favored 'General case' 0 C--O 1.222 -0.384 0 N-CA-C 108.796 -0.816 . . . . 2.07 108.796 178.877 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -47.01 -60.39 2.48 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 123.521 0.729 . . . . 3.24 110.548 172.913 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.22 -43.42 98.87 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 120.378 -0.529 . . . . 2.85 110.976 -172.257 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 66.2 t -64.23 -38.93 83.78 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.428 0 CA-C-O 119.306 -0.378 . . . . 1.01 111.227 176.596 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 79.5 t60 -66.42 -22.48 66.23 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 124.376 1.07 . . . . 2.6 110.055 -173.899 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 22.7 t . . . . . 0 C--O 1.253 1.273 0 CA-C-O 115.343 -2.265 . . . . 2.58 112.986 176.886 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.512 HG22 HG12 ' A' ' 47' ' ' VAL . 1.6 pp . . . . . 0 CA--C 1.53 0.206 0 CA-C-O 121.616 0.722 . . . . 1.24 110.567 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 12.5 t -66.0 -9.85 34.12 Favored 'General case' 0 N--CA 1.426 -1.667 0 C-N-CA 127.673 2.389 . . . . 1.69 112.078 -174.386 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 26.4 t0 -138.59 28.46 2.44 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.14 0.976 . . . . 2.81 109.822 178.206 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 1.1 p -100.55 -46.74 11.77 Favored 'Isoleucine or valine' 0 C--N 1.344 0.327 0 O-C-N 121.682 -0.636 . . . . 1.93 109.907 173.554 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 173.24 -58.8 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 106.956 -1.498 . . . . 1.1 106.956 -165.742 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -43.48 -31.62 0.74 Allowed 'General case' 0 C--O 1.218 -0.556 0 C-N-CA 126.291 1.836 . . . . 1.31 114.478 -169.386 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -45.5 -47.9 14.08 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 119.235 0.925 . . . . 0.62 112.874 173.775 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -67.21 -42.31 84.31 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-O 122.239 1.019 . . . . 1.78 109.789 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -64.86 -43.52 92.72 Favored 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 123.734 0.814 . . . . 2.41 109.425 -175.059 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 26.6 pt -67.1 -39.38 83.1 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.858 0 O-C-N 121.426 -0.796 . . . . 0.74 111.02 176.522 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.63 -40.56 72.31 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 118.649 0.659 . . . . 0.65 110.787 171.907 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.85 -57.09 10.91 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 121.914 -0.491 . . . . 0.57 111.057 171.557 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -46.81 -47.59 21.0 Favored 'General case' 0 N--CA 1.462 0.158 0 C-N-CA 125.895 1.678 . . . . 0.57 111.138 -177.862 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 16.0 tp -48.45 -48.54 37.42 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 125.941 1.696 . . . . 2.6 109.595 178.243 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 -82.94 -43.3 16.63 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 110.517 -0.179 . . . . 3.24 110.517 -174.297 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -66.87 -38.85 87.12 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 110.527 -0.175 . . . . 2.29 110.527 -173.561 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 56.6 m -106.92 62.55 0.63 Allowed 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 124.537 1.135 . . . . 1.52 108.084 166.905 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -74.95 -41.93 58.66 Favored 'General case' 0 N--CA 1.464 0.265 0 O-C-N 121.799 -0.563 . . . . 5.31 109.514 170.972 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -78.81 148.39 72.4 Favored Pre-proline 0 N--CA 1.45 -0.459 0 C-N-CA 123.741 0.816 . . . . 1.98 111.126 -160.238 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -66.3 130.11 23.18 Favored 'Trans proline' 0 N--CA 1.449 -1.114 0 C-N-CA 123.006 2.471 . . . . 1.3 110.915 -175.146 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 74.4 37.62 0.56 Allowed 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 127.689 2.396 . . . . 2.97 110.343 173.317 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 16.1 m -115.71 -6.56 12.14 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.214 1.006 . . . . 0.66 112.759 -173.945 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -80.62 83.42 6.4 Favored 'General case' 0 CA--C 1.535 0.393 0 O-C-N 120.694 -1.254 . . . . 2.3 111.248 -160.836 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -68.17 143.54 96.02 Favored Pre-proline 0 CA--C 1.534 0.332 0 O-C-N 121.596 -0.69 . . . . 2.57 110.183 178.143 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -71.6 -62.52 0.04 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.24 0 C-N-CA 122.562 2.175 . . . . 0.65 111.883 -175.095 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 37.1 mt-30 -55.07 -46.05 75.38 Favored 'General case' 0 C--O 1.233 0.193 0 C-N-CA 123.254 0.621 . . . . 2.4 109.801 179.336 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 42.8 tptt -49.96 -56.64 9.82 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 116.009 -0.541 . . . . 3.26 109.786 173.218 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 54.9 t80 -56.26 -50.97 69.84 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 111.534 0.198 . . . . 2.26 111.534 179.841 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 31.0 m-85 -56.67 -34.6 67.53 Favored 'General case' 0 CA--C 1.532 0.272 0 O-C-N 121.319 -0.863 . . . . 5.25 112.008 -178.963 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 5.5 mm-40 -71.93 -58.6 3.32 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 108.568 -0.901 . . . . 3.17 108.568 174.567 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -63.99 -25.28 68.06 Favored 'General case' 0 N--CA 1.439 -1.005 0 C-N-CA 123.945 0.898 . . . . 0.65 111.839 -169.401 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 18.5 t -85.02 -7.83 58.97 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 126.02 1.728 . . . . 1.48 111.44 179.318 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 86.24 -11.78 62.21 Favored Glycine 0 C--N 1.338 0.674 0 N-CA-C 111.376 -0.69 . . . . 0.7 111.376 174.512 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 93.5 mt -54.78 -42.83 72.23 Favored 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 125.516 1.526 . . . . 1.29 111.029 -179.654 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 5.3 t -72.02 -13.5 61.62 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.102 0.561 . . . . 1.87 111.977 177.159 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -89.45 -35.94 15.71 Favored 'General case' 0 N--CA 1.452 -0.345 0 O-C-N 121.337 -0.852 . . . . 3.49 109.863 174.469 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 59.9 mtt -57.13 152.39 13.57 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 121.603 0.716 . . . . 2.89 111.361 174.295 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 23.8 t -78.69 154.76 29.86 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 116.213 -0.449 . . . . 1.99 109.905 174.579 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -41.0 -44.57 2.4 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 125.602 1.561 . . . . 0.56 112.129 176.018 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 68.3 m-80 -54.33 -58.22 8.24 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.304 0.642 . . . . 1.59 110.339 178.85 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 3.6 mm-40 -59.82 -44.61 93.93 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 123.077 0.551 . . . . 2.67 109.849 -179.864 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.416 ' CG1' ' CZ ' ' A' ' 48' ' ' PHE . 53.1 t -57.91 -43.95 85.59 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 CA-C-O 121.293 0.568 . . . . 0.6 109.523 -179.264 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 21.6 tttt -63.27 -48.92 76.14 Favored 'General case' 0 N--CA 1.452 -0.37 0 O-C-N 121.289 -0.882 . . . . 2.98 110.922 176.288 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -51.54 -54.09 31.02 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 118.18 0.446 . . . . 3.07 110.671 176.363 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.512 HG12 HG22 ' A' ' 3' ' ' ILE 0.27 17.4 m -54.7 -44.34 70.04 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.206 0 CA-C-O 118.826 -0.607 . . . . 0.58 110.984 178.802 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.559 ' CZ ' ' HB3' ' A' ' 103' ' ' PHE . 15.1 m-30 -54.21 -40.39 67.6 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 119.153 0.888 . . . . 5.94 112.783 174.343 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 69.7 mtp85 -57.25 -42.02 80.72 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 118.613 0.642 . . . . 2.96 109.947 174.906 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 -68.64 -33.24 73.67 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 118.67 -0.681 . . . . 5.56 110.949 176.77 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 14.0 mm -63.65 -59.81 3.72 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 CA-C-O 118.433 -0.794 . . . . 1.5 110.89 175.718 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 55.6 t0 -74.13 71.18 1.63 Allowed 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 119.194 0.906 . . . . 1.87 110.554 -175.791 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 27.7 t30 -46.32 -47.24 18.49 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 125.888 1.675 . . . . 1.92 111.0 176.617 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -64.39 -19.26 65.38 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 126.639 1.976 . . . . 3.96 112.12 -177.905 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 59.64 12.64 2.97 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 127.08 2.152 . . . . 4.61 113.58 178.677 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 3.9 p -70.12 -10.32 58.39 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 113.83 1.048 . . . . 2.21 113.83 -170.138 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 85.71 34.89 12.4 Favored Glycine 0 CA--C 1.529 0.937 0 CA-C-N 118.933 0.788 . . . . 2.43 111.968 172.067 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -171.05 143.71 2.01 Favored 'General case' 0 CA--C 1.519 -0.233 0 C-N-CA 127.289 2.235 . . . . 2.75 105.001 175.625 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -102.93 68.54 1.0 Allowed 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 107.309 -1.367 . . . . 2.27 107.309 176.272 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -56.81 146.45 26.16 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.744 1.618 . . . . 1.67 110.761 179.362 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -44.89 -51.26 9.84 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 123.512 0.725 . . . . 3.54 112.953 -175.395 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -69.67 -19.62 63.59 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 121.968 -0.457 . . . . 3.28 111.917 -173.39 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 91.4 mt-10 -77.64 -44.57 27.77 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-O 121.293 0.568 . . . . 2.39 109.598 167.413 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 6.4 tp -53.23 -28.24 26.2 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.644 0.777 . . . . 2.63 110.978 174.191 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 30.2 ttpt -50.67 -16.71 0.42 Allowed 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 113.904 1.076 . . . . 2.47 113.904 169.326 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 27.5 p90 -127.48 33.93 4.76 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 120.097 1.317 . . . . 5.25 112.634 170.138 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 46.4 t80 -57.76 -67.36 0.34 Allowed 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.649 0.78 . . . . 2.45 110.794 178.431 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 2.9 tp -85.38 -9.27 57.79 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.473 -0.767 . . . . 2.39 112.066 -175.79 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 49.5 mm-40 -56.0 -18.72 10.11 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.098 0.959 . . . . 1.61 111.399 171.405 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -83.04 -16.39 47.22 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 121.196 -0.94 . . . . 3.55 111.476 177.969 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 6.3 m-30 -101.16 -53.87 2.92 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 124.674 1.189 . . . . 3.25 108.916 -179.1 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -112.83 161.2 17.21 Favored 'General case' 0 C--O 1.222 -0.371 0 N-CA-C 106.606 -1.627 . . . . 3.35 106.606 175.8 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 24.1 m -85.66 -34.62 21.27 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 118.896 0.771 . . . . 2.08 110.524 172.629 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -114.48 42.61 1.88 Allowed Glycine 0 CA--C 1.519 0.324 0 N-CA-C 109.568 -1.413 . . . . 1.04 109.568 -170.444 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.08 -171.57 0.92 Allowed 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 120.953 0.406 . . . . 1.28 111.01 177.552 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.7 -13.59 39.31 Favored 'General case' 0 N--CA 1.453 -0.287 0 O-C-N 121.696 -0.628 . . . . 3.0 112.545 -166.112 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -46.47 -40.59 12.64 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 126.842 2.057 . . . . 3.11 112.802 -163.445 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.401 HD22 ' H ' ' A' ' 78' ' ' LEU . 0.2 OUTLIER -49.04 -43.1 40.37 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.607 1.163 . . . . 0.81 112.144 175.584 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 91.8 m -69.26 104.77 2.31 Favored 'General case' 0 C--O 1.235 0.304 0 O-C-N 121.523 -0.736 . . . . 0.77 109.98 175.997 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -54.77 -41.98 71.14 Favored 'General case' 0 C--O 1.219 -0.542 0 CA-C-N 115.609 -0.723 . . . . 3.07 111.671 178.807 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 34.7 t -54.28 -53.91 47.37 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-O 121.463 0.649 . . . . 1.79 111.081 -178.463 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -63.36 -47.67 81.12 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 124.074 0.949 . . . . 2.89 108.577 -178.765 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -52.22 -44.91 65.03 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 116.177 -0.465 . . . . 0.55 111.229 174.232 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -76.42 -27.3 56.2 Favored 'General case' 0 C--O 1.221 -0.422 0 C-N-CA 124.219 1.007 . . . . 5.09 110.718 -175.793 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 24.6 m -61.6 -45.96 91.87 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 119.089 0.859 . . . . 1.5 109.798 168.667 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -59.3 -57.91 10.96 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 110.039 -0.356 . . . . 2.78 110.039 172.194 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 22.2 ttp -47.16 -52.64 15.05 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.22 0.608 . . . . 3.07 111.366 178.214 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -49.65 -51.37 38.41 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 126.117 1.767 . . . . 0.5 111.537 -172.028 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -78.02 -41.73 34.81 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-O 119.853 -0.118 . . . . 0.49 111.294 179.835 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -54.81 -41.36 70.54 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-O 120.682 0.277 . . . . 0.35 111.036 179.263 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -77.76 80.96 4.21 Favored 'General case' 0 N--CA 1.445 -0.688 0 C-N-CA 123.245 0.618 . . . . 0.93 111.083 -176.574 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 52.8 p-10 -76.26 41.31 0.23 Allowed 'General case' 0 CA--C 1.541 0.633 0 O-C-N 121.405 -0.809 . . . . 2.79 112.16 176.374 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 29.2 m-20 -126.11 -58.98 1.35 Allowed 'General case' 0 C--N 1.342 0.251 0 C-N-CA 126.193 1.797 . . . . 1.25 108.299 172.913 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 93.94 44.33 3.62 Favored Glycine 0 CA--C 1.53 0.971 0 N-CA-C 109.147 -1.581 . . . . 0.82 109.147 -157.304 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 41.0 p-10 -124.87 -47.43 1.8 Allowed 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 124.621 1.168 . . . . 2.05 110.318 172.395 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 115.7 -31.24 6.22 Favored Glycine 0 CA--C 1.524 0.638 0 C-N-CA 124.618 1.104 . . . . 0.64 111.227 170.655 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 21.5 pttp -69.34 114.22 7.39 Favored 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 107.692 -1.225 . . . . 5.16 107.692 168.715 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 19.7 mt -103.83 115.57 46.02 Favored 'Isoleucine or valine' 0 C--O 1.231 0.13 0 C-N-CA 123.551 0.74 . . . . 0.66 109.36 -171.842 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -72.28 162.15 54.48 Favored Glycine 0 CA--C 1.534 1.267 0 CA-C-O 121.831 0.684 . . . . 0.55 112.143 172.463 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -57.11 -40.09 76.38 Favored 'General case' 0 C--O 1.226 -0.184 0 O-C-N 121.78 -0.835 . . . . 0.6 109.673 172.106 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -56.19 -54.18 48.23 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.978 0.911 . . . . 2.57 110.274 177.262 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -51.66 -50.53 60.19 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.079 0.952 . . . . 1.27 110.422 176.954 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' PHE . . . . . 0.559 ' HB3' ' CZ ' ' A' ' 48' ' ' PHE . 3.4 m-85 -61.12 -44.22 97.68 Favored 'General case' 0 CA--C 1.534 0.364 0 O-C-N 121.87 -0.519 . . . . 3.78 111.709 177.847 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 30.9 tt0 -57.42 -49.83 74.95 Favored 'General case' 0 C--O 1.222 -0.384 0 N-CA-C 108.796 -0.816 . . . . 2.07 108.796 178.877 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -47.01 -60.39 2.48 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 123.521 0.729 . . . . 3.24 110.548 172.913 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.22 -43.42 98.87 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 120.378 -0.529 . . . . 2.85 110.976 -172.257 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 66.2 t -64.23 -38.93 83.78 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.428 0 CA-C-O 119.306 -0.378 . . . . 1.01 111.227 176.596 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 79.5 t60 -66.42 -22.48 66.23 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 124.376 1.07 . . . . 2.6 110.055 -173.899 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 22.7 t . . . . . 0 C--O 1.253 1.273 0 CA-C-O 115.343 -2.265 . . . . 2.58 112.986 176.886 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.689 HG22 HG12 ' A' ' 47' ' ' VAL . 1.3 pp . . . . . 0 CA--C 1.543 0.679 0 N-CA-C 112.662 0.615 . . . . 1.22 112.662 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 14.8 t -68.89 -7.06 31.22 Favored 'General case' 0 N--CA 1.429 -1.491 0 C-N-CA 127.866 2.466 . . . . 1.82 112.812 -177.241 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 47.1 t0 -153.11 44.34 0.64 Allowed 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.438 1.495 . . . . 2.54 108.891 -177.766 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 13.2 t -128.29 -59.14 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.339 0.133 0 C-N-CA 126.171 1.788 . . . . 1.55 108.936 174.49 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -172.54 -47.55 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.14 0 N-CA-C 106.986 -1.487 . . . . 1.29 106.986 -175.194 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 2.4 m -48.15 -32.66 7.24 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 114.46 1.282 . . . . 0.94 114.46 -175.747 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -51.19 -40.72 59.3 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 119.363 0.983 . . . . 0.85 113.218 174.818 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -76.04 -37.15 58.67 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 121.54 0.686 . . . . 2.17 109.791 177.854 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 23.2 m-20 -57.47 -52.31 65.9 Favored 'General case' 0 C--O 1.234 0.278 0 C-N-CA 124.083 0.953 . . . . 2.59 108.569 -179.43 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 28.3 pt -61.8 -39.3 82.9 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.278 0 CA-C-N 115.352 -0.84 . . . . 0.73 109.929 -178.131 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -54.23 -44.68 71.91 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 118.267 0.485 . . . . 0.66 111.045 174.885 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.96 -59.14 5.24 Favored 'General case' 0 CA--C 1.53 0.185 0 O-C-N 121.908 -0.495 . . . . 0.64 110.84 174.495 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -48.79 -46.06 41.05 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 124.132 0.973 . . . . 0.63 112.015 -177.56 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -50.11 -44.07 52.02 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 125.369 1.468 . . . . 2.78 109.346 177.52 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 13.7 mt-30 -85.09 -30.19 24.26 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-O 118.285 -0.864 . . . . 2.82 112.623 -178.967 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -74.33 -25.56 59.62 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 119.956 1.253 . . . . 2.43 111.207 -179.66 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 91.6 m -128.16 46.51 2.56 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.037 1.335 . . . . 1.42 110.009 177.419 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.67 -40.43 63.7 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 119.048 0.84 . . . . 6.56 109.309 171.769 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -62.18 133.96 94.42 Favored Pre-proline 0 N--CA 1.445 -0.702 0 C-N-CA 124.756 1.222 . . . . 3.06 108.151 -171.988 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 55.1 Cg_endo -60.17 142.83 99.16 Favored 'Trans proline' 0 N--CA 1.448 -1.189 0 C-N-CA 121.957 1.771 . . . . 1.33 109.751 -174.128 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 69.45 21.73 6.74 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.905 0.882 . . . . 3.32 111.615 170.049 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.1 m -113.81 11.02 17.89 Favored 'General case' 0 C--N 1.347 0.458 0 C-N-CA 125.142 1.377 . . . . 0.95 112.148 -179.531 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -84.98 114.16 21.95 Favored 'General case' 0 C--O 1.232 0.143 0 N-CA-C 107.863 -1.162 . . . . 2.28 107.863 179.76 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -110.78 149.05 39.79 Favored Pre-proline 0 CA--C 1.534 0.331 0 C-N-CA 124.264 1.026 . . . . 2.76 109.473 174.319 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_endo -65.7 -73.34 0.02 OUTLIER 'Trans proline' 0 N--CA 1.452 -0.917 0 C-N-CA 123.353 2.702 . . . . 0.69 111.614 -173.578 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -49.73 -43.79 48.0 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 124.964 1.306 . . . . 2.54 110.772 -179.858 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.53 -64.57 0.77 Allowed 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 125.834 1.654 . . . . 2.8 110.454 175.81 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 65.8 t80 -58.14 -43.51 87.35 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-O 122.85 1.31 . . . . 2.01 110.981 -179.795 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.518 ' CE1' ' HA ' ' A' ' 107' ' ' VAL . 3.8 t80 -52.16 -51.57 57.18 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.117 0.967 . . . . 4.65 112.1 178.485 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 30.1 mt-30 -72.56 -36.81 68.31 Favored 'General case' 0 N--CA 1.45 -0.43 0 O-C-N 121.431 -0.793 . . . . 3.81 110.724 176.901 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -64.14 -41.18 97.3 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-N 119.139 0.881 . . . . 1.37 110.983 -176.559 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 11.5 p -62.3 -50.3 72.19 Favored 'General case' 0 N--CA 1.441 -0.895 0 N-CA-C 106.777 -1.564 . . . . 2.9 106.777 173.885 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 102.39 20.58 11.9 Favored Glycine 0 CA--C 1.521 0.464 0 N-CA-C 109.619 -1.392 . . . . 1.72 109.619 -176.829 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 32.5 mt -60.08 -24.81 64.91 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 121.866 -0.785 . . . . 1.46 109.772 168.809 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 22.8 t -62.05 -24.78 67.29 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 123.459 0.704 . . . . 2.41 110.52 173.944 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -92.83 -24.74 18.4 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 123.006 0.522 . . . . 4.29 109.831 178.457 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 21.1 mmt -66.85 144.88 56.02 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 121.674 0.749 . . . . 3.83 111.141 176.387 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 8.5 t -75.01 156.26 36.44 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.983 -0.553 . . . . 2.02 109.512 179.336 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -45.53 -43.35 11.76 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 124.335 1.054 . . . . 0.6 111.435 176.447 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -49.96 -62.85 1.33 Allowed 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.66 0.784 . . . . 2.87 110.587 175.339 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 1.7 mm-40 -56.25 -46.45 79.63 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 122.983 0.513 . . . . 3.19 109.924 -179.315 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 78.4 t -58.4 -38.67 71.07 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.646 0 O-C-N 122.07 -0.394 . . . . 0.54 110.419 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 14.7 tptt -68.68 -44.26 74.39 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 121.182 -0.948 . . . . 4.21 111.091 176.898 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 73.6 m-20 -59.09 -53.43 58.47 Favored 'General case' 0 C--O 1.232 0.163 0 N-CA-C 109.767 -0.457 . . . . 2.9 109.767 178.85 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.689 HG12 HG22 ' A' ' 3' ' ' ILE . 7.8 m -58.2 -43.75 86.36 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 N-CA-C 109.505 -0.554 . . . . 0.65 109.505 176.907 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.439 ' CE1' ' HB2' ' A' ' 100' ' ' ALA . 7.7 t80 -49.19 -48.69 45.01 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 118.482 0.583 . . . . 4.16 111.019 175.274 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 73.2 mtp180 -58.73 -37.68 76.71 Favored 'General case' 0 CA--C 1.532 0.266 0 O-C-N 121.684 -0.635 . . . . 4.02 112.432 177.583 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 9.8 m-85 -62.7 -33.71 75.66 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 118.497 0.589 . . . . 3.57 110.18 174.122 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.3 mm -73.59 -47.14 45.97 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 CA-C-O 118.707 -0.663 . . . . 1.54 110.407 -179.303 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 20.1 t0 -73.32 65.29 0.85 Allowed 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 118.898 0.772 . . . . 1.9 108.969 176.445 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 10.8 t30 -58.29 -36.17 72.91 Favored 'General case' 0 C--N 1.332 -0.179 0 C-N-CA 125.104 1.361 . . . . 2.29 111.863 -170.598 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -73.38 -20.06 60.85 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.438 1.095 . . . . 2.55 111.955 175.782 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 14.0 mt-30 53.87 72.09 0.47 Allowed 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.831 1.652 . . . . 3.11 110.954 -175.016 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 89.4 p -105.72 -28.97 10.37 Favored 'General case' 0 C--N 1.34 0.171 0 C-N-CA 123.824 0.849 . . . . 1.41 111.909 174.609 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 87.74 7.41 74.97 Favored Glycine 0 CA--C 1.532 1.096 0 CA-C-O 119.398 -0.668 . . . . 1.53 112.063 -167.513 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 16.2 m-85 -134.11 133.57 41.23 Favored 'General case' 0 C--O 1.233 0.218 0 N-CA-C 108.214 -1.032 . . . . 2.5 108.214 164.526 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -93.33 80.58 4.42 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 126.689 1.995 . . . . 1.94 105.809 163.716 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -63.65 153.73 35.13 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 114.393 -1.276 . . . . 1.93 109.431 169.568 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -50.41 -46.1 56.08 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 124.345 1.058 . . . . 3.79 112.252 -173.15 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.5 tm-20 -59.56 -46.1 89.88 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 123.293 0.637 . . . . 3.61 110.355 -177.059 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 90.3 mt-10 -59.17 -43.79 92.13 Favored 'General case' 0 N--CA 1.451 -0.425 0 O-C-N 121.763 -0.585 . . . . 2.15 110.129 175.886 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -58.25 -37.63 75.31 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 122.289 -0.257 . . . . 2.2 110.607 175.559 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 21.0 ttmt -58.77 -12.32 4.18 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.966 0.906 . . . . 3.0 112.968 172.287 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 9.0 t80 -123.08 28.21 7.27 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.573 1.149 . . . . 5.06 110.47 173.176 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -66.06 -74.63 0.1 Allowed 'General case' 0 CA--C 1.53 0.181 0 O-C-N 121.247 -0.908 . . . . 2.65 110.604 -179.764 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.484 HD22 ' HB2' ' A' ' 75' ' ' ALA . 0.4 OUTLIER -68.01 -17.2 64.35 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 121.619 -0.675 . . . . 2.92 110.999 -164.592 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 78.0 mm-40 -51.03 -21.63 1.91 Allowed 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.911 1.684 . . . . 1.88 112.354 166.125 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 1.9 mmpt? -80.07 -25.35 40.09 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 121.07 -1.019 . . . . 3.15 111.385 176.077 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 16.6 m-30 -94.07 -62.7 1.3 Allowed 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 125.435 1.494 . . . . 3.1 109.551 -179.823 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -105.65 -178.91 3.79 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 125.983 1.713 . . . . 2.99 107.864 -179.276 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 20.0 m -124.04 47.45 2.06 Favored 'General case' 0 N--CA 1.461 0.101 0 C-N-CA 123.123 0.569 . . . . 2.5 111.088 177.535 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 154.18 59.39 0.01 OUTLIER Glycine 0 CA--C 1.519 0.343 0 N-CA-C 110.019 -1.232 . . . . 1.16 110.019 179.147 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.573 ' HB3' ' OE2' ' A' ' 77' ' ' GLU . . . -91.1 -142.41 0.18 Allowed 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 108.558 -0.904 . . . . 1.64 108.558 175.104 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -123.26 41.69 3.4 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 123.91 0.884 . . . . 5.02 110.659 -175.831 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.573 ' OE2' ' HB3' ' A' ' 75' ' ' ALA . 4.2 mp0 -77.06 -36.84 55.64 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 125.296 1.439 . . . . 4.78 109.028 177.557 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.487 ' H ' HD22 ' A' ' 78' ' ' LEU . 0.2 OUTLIER -52.99 -44.85 67.53 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 114.75 -1.114 . . . . 0.99 110.54 178.026 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 23.8 m -67.87 113.47 5.63 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 121.7 0.762 . . . . 1.02 110.43 179.55 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -58.75 -41.95 87.71 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-N 114.737 -1.12 . . . . 2.84 111.002 177.591 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 15.8 m -47.66 -60.21 2.72 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 119.066 0.848 . . . . 1.38 111.318 173.634 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.74 -40.39 79.86 Favored 'General case' 0 N--CA 1.454 -0.229 0 O-C-N 121.896 -0.503 . . . . 3.41 109.932 -171.989 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 1.1 m -53.28 -47.74 68.92 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-O 122.06 0.933 . . . . 0.66 108.89 171.303 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 33.5 tttp -70.14 -27.77 64.82 Favored 'General case' 0 N--CA 1.44 -0.973 0 C-N-CA 124.236 1.014 . . . . 4.9 111.473 -174.761 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 52.5 m -55.94 -47.91 76.7 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 120.195 1.362 . . . . 1.31 109.998 168.189 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 9.0 mt -60.76 -58.21 9.43 Favored 'General case' 0 C--O 1.233 0.226 0 N-CA-C 109.47 -0.567 . . . . 2.26 109.47 172.612 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 2.6 ttp -46.96 -43.6 19.33 Favored 'General case' 0 CA--C 1.535 0.366 0 O-C-N 123.528 0.517 . . . . 3.48 112.39 -178.092 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -56.45 -45.92 80.58 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 125.886 1.675 . . . . 0.62 111.668 -173.34 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -84.91 -44.6 13.02 Favored 'General case' 0 CA--C 1.521 -0.137 0 N-CA-C 110.575 -0.157 . . . . 0.68 110.575 178.51 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -55.99 -45.4 79.02 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 122.706 0.403 . . . . 0.36 110.483 -176.644 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -73.75 77.8 1.56 Allowed 'General case' 0 N--CA 1.448 -0.566 0 CA-C-O 121.274 0.559 . . . . 0.93 109.571 177.325 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -76.19 45.48 0.37 Allowed 'General case' 0 CA--C 1.538 0.496 0 O-C-N 121.477 -0.764 . . . . 2.7 111.827 178.286 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 62.5 m-20 -135.37 -58.93 0.78 Allowed 'General case' 0 C--N 1.338 0.07 0 C-N-CA 125.463 1.505 . . . . 1.57 109.278 -177.517 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 103.26 45.67 1.54 Allowed Glycine 0 CA--C 1.532 1.106 0 N-CA-C 110.025 -1.23 . . . . 0.87 110.025 -163.329 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -124.6 -61.89 1.29 Allowed 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 125.078 1.351 . . . . 1.97 109.687 171.085 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 127.43 -24.28 5.3 Favored Glycine 0 CA--C 1.529 0.948 0 C-N-CA 124.678 1.133 . . . . 0.7 111.563 177.733 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 40.0 mtpt -80.71 114.08 19.34 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 106.823 -1.547 . . . . 4.21 106.823 175.544 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 5.5 mt -95.16 153.6 3.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 N-CA-C 107.232 -1.395 . . . . 0.87 107.232 -178.09 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -132.03 -179.35 16.14 Favored Glycine 0 CA--C 1.522 0.47 0 N-CA-C 108.903 -1.679 . . . . 0.75 108.903 175.853 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' ALA . . . . . 0.439 ' HB2' ' CE1' ' A' ' 48' ' ' PHE . . . -66.06 -36.79 84.18 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 117.601 0.701 . . . . 0.7 110.404 -177.242 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 -60.02 -59.13 5.9 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-O 118.797 -0.62 . . . . 2.51 110.13 173.594 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -52.24 -47.98 65.44 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-O 121.767 0.794 . . . . 1.43 110.648 -179.664 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 58.7 t80 -62.46 -54.22 43.34 Favored 'General case' 0 N--CA 1.454 -0.27 0 O-C-N 121.821 -0.55 . . . . 3.6 110.363 -178.205 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 46.7 tt0 -55.44 -46.44 76.73 Favored 'General case' 0 C--O 1.22 -0.497 0 CA-C-O 118.294 -0.86 . . . . 2.17 110.613 177.747 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -51.96 -58.88 5.19 Favored 'General case' 0 CA--C 1.522 -0.126 0 CA-C-N 119.462 1.028 . . . . 3.09 110.075 176.67 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -55.8 -47.21 77.52 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 109.44 -0.578 . . . . 4.73 109.44 -179.475 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 107' ' ' VAL . . . . . 0.518 ' HA ' ' CE1' ' A' ' 31' ' ' PHE . 76.1 t -75.35 -6.06 8.08 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.795 0 C-N-CA 124.293 1.037 . . . . 1.4 112.552 -177.284 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 6.6 t60 -90.15 -11.58 40.75 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 120.086 -1.634 . . . . 2.72 110.221 173.983 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 28.5 t . . . . . 0 C--O 1.252 1.219 0 CA-C-O 114.935 -2.459 . . . . 2.31 114.016 -174.109 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.484 HG22 HG12 ' A' ' 47' ' ' VAL . 1.7 pp . . . . . 0 N--CA 1.465 0.289 0 CA-C-O 121.65 0.738 . . . . 1.21 111.942 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 12.9 t -65.91 -15.38 62.9 Favored 'General case' 0 N--CA 1.422 -1.844 0 C-N-CA 126.879 2.071 . . . . 1.96 111.616 -174.889 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 36.6 t0 -134.0 44.72 2.7 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.914 0.886 . . . . 2.86 109.537 -179.326 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 20.1 t -121.02 -61.82 2.09 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.229 0 C-N-CA 124.912 1.285 . . . . 1.58 109.4 177.636 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 9.1 tp -171.95 -61.55 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 104.991 -2.226 . . . . 1.67 104.991 -174.933 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -33.03 -37.83 0.03 OUTLIER 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 128.921 2.888 . . . . 1.2 115.8 -173.213 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -51.27 -41.12 60.18 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 118.94 0.791 . . . . 0.8 112.893 179.54 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.3 t0 -68.2 -45.5 73.17 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 122.86 1.314 . . . . 1.9 108.56 177.027 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -62.62 -47.63 82.9 Favored 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 125.143 1.377 . . . . 2.51 109.34 -170.171 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 26.6 pt -60.57 -38.28 77.8 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.877 0 C-N-CA 123.188 0.595 . . . . 0.97 111.394 176.402 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.84 -44.72 93.94 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 118.34 0.518 . . . . 1.07 110.045 177.484 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.85 -54.76 43.52 Favored 'General case' 0 C--O 1.234 0.247 0 O-C-N 122.174 -0.328 . . . . 0.89 110.471 172.055 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -48.55 -46.49 39.01 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 124.549 1.14 . . . . 0.72 111.272 -177.93 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -54.32 -43.44 71.17 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 124.6 1.16 . . . . 3.75 109.65 -179.475 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -77.99 -49.27 14.39 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 109.699 -0.482 . . . . 2.97 109.699 -176.096 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -59.69 -33.2 71.29 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 122.025 0.13 . . . . 3.2 110.904 -175.205 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 75.0 m -107.98 36.91 2.6 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 124.796 1.238 . . . . 1.34 110.493 177.359 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 53.7 ttt-85 -78.93 -30.86 44.91 Favored 'General case' 0 C--O 1.234 0.242 0 O-C-N 121.364 -0.835 . . . . 5.36 109.964 179.155 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 61.3 m-20 -74.27 144.87 82.18 Favored Pre-proline 0 CA--C 1.539 0.551 0 C-N-CA 123.789 0.836 . . . . 2.05 109.613 177.212 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -64.31 140.79 72.18 Favored 'Trans proline' 0 N--CA 1.456 -0.68 0 C-N-CA 123.505 2.803 . . . . 1.33 111.02 -176.087 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 62.73 10.83 4.45 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.084 1.353 . . . . 2.41 113.184 177.356 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 29.3 m -92.7 16.21 12.76 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.299 1.44 . . . . 1.12 110.957 -177.996 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 7.4 t80 -99.86 112.47 24.74 Favored 'General case' 0 N--CA 1.444 -0.764 0 N-CA-C 106.767 -1.568 . . . . 2.68 106.767 179.693 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -104.42 147.64 34.7 Favored Pre-proline 0 C--O 1.235 0.303 0 N-CA-C 108.257 -1.016 . . . . 4.86 108.257 167.598 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -62.05 -62.67 0.11 Allowed 'Trans proline' 0 N--CA 1.451 -1.015 0 C-N-CA 122.88 2.387 . . . . 0.57 111.176 -176.013 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 48.9 mt-30 -59.0 -40.63 85.5 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 123.177 0.591 . . . . 2.2 110.937 -173.684 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -50.45 -69.41 0.11 Allowed 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.54 1.136 . . . . 4.96 108.966 169.817 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 80.8 t80 -53.65 -43.39 68.77 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 123.583 0.753 . . . . 2.46 112.183 -175.216 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -50.59 -59.07 4.42 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 127.325 2.25 . . . . 4.78 109.983 177.093 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.73 -48.0 76.2 Favored 'General case' 0 N--CA 1.445 -0.693 0 N-CA-C 107.972 -1.121 . . . . 3.79 107.972 -177.072 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -63.35 -35.74 81.4 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 123.514 0.726 . . . . 0.69 112.914 -171.682 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 43.5 m -76.49 2.65 13.16 Favored 'General case' 0 N--CA 1.449 -0.518 0 O-C-N 123.705 0.628 . . . . 2.06 110.803 176.87 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 79.62 9.42 86.86 Favored Glycine 0 C--N 1.339 0.73 0 N-CA-C 110.951 -0.859 . . . . 0.7 110.951 169.258 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 50.0 mt -73.91 -24.06 59.63 Favored 'General case' 0 N--CA 1.441 -0.879 0 O-C-N 121.378 -1.072 . . . . 1.42 109.818 -172.979 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 26.3 p -66.29 -25.69 66.97 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.34 0.656 . . . . 2.57 111.063 168.853 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 13.1 tptt -86.27 -34.09 20.48 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 108.175 -1.046 . . . . 3.81 108.175 -177.726 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.4 ' O ' ' CB ' ' A' ' 40' ' ' SER . 36.2 mtt -47.67 -66.88 0.33 Allowed 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 114.702 1.371 . . . . 3.7 114.702 -177.064 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' SER . . . . . 0.4 ' CB ' ' O ' ' A' ' 39' ' ' MET . 42.1 t 113.99 139.93 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 128.714 2.806 . . . . 1.94 108.021 -172.788 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -37.22 -40.34 0.32 Allowed 'General case' 0 C--N 1.341 0.217 0 C-N-CA 125.206 1.402 . . . . 0.74 112.688 173.695 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 60.8 m-80 -56.9 -61.37 2.49 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-O 122.028 0.918 . . . . 2.11 109.703 -179.031 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' GLN . . . . . 0.453 ' O ' HG13 ' A' ' 47' ' ' VAL . 28.8 tt0 -70.43 -35.57 73.46 Favored 'General case' 0 N--CA 1.439 -1.002 0 CA-C-N 115.165 -0.925 . . . . 3.24 109.558 -176.244 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 51.8 t -59.26 -49.31 83.91 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.67 0 CA-C-N 119.063 0.847 . . . . 0.56 108.994 178.653 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -55.08 -46.78 75.49 Favored 'General case' 0 N--CA 1.455 -0.221 0 O-C-N 121.361 -0.837 . . . . 2.82 110.608 173.31 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 33.7 t0 -56.2 -55.36 34.08 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 118.076 0.398 . . . . 2.47 110.778 178.597 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.484 HG12 HG22 ' A' ' 3' ' ' ILE . 3.1 m -52.79 -44.4 47.75 Favored 'Isoleucine or valine' 0 C--N 1.342 0.27 0 CA-C-O 118.983 -0.532 . . . . 0.79 110.304 179.468 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 16.0 m-30 -49.98 -39.71 41.82 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 118.535 0.607 . . . . 5.65 112.067 177.109 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 69.0 mtp180 -58.89 -30.17 67.58 Favored 'General case' 0 CA--C 1.532 0.259 0 O-C-N 121.195 -0.941 . . . . 3.22 111.989 179.145 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 18.1 t80 -70.02 -25.14 63.44 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.503 0.721 . . . . 4.01 110.919 178.054 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.438 HG21 ' CD1' ' A' ' 67' ' ' PHE . 4.1 mp -125.69 99.61 6.08 Favored 'Isoleucine or valine' 0 C--N 1.342 0.266 0 C-N-CA 124.066 0.946 . . . . 2.66 111.206 -177.02 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 57.0 t0 -155.99 -49.04 0.08 Allowed 'General case' 0 C--O 1.223 -0.338 0 C-N-CA 125.979 1.712 . . . . 3.9 106.388 166.56 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 17.6 t-20 97.62 -52.88 0.01 OUTLIER 'General case' 0 C--N 1.34 0.195 0 C-N-CA 128.31 2.644 . . . . 4.87 107.825 -178.128 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 40.6 m-20 -56.88 -46.22 82.03 Favored 'General case' 0 CA--C 1.528 0.107 0 CA-C-O 121.455 0.645 . . . . 2.99 110.24 169.201 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 59.26 63.32 1.61 Allowed 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 114.468 -1.242 . . . . 3.99 109.491 -152.569 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 98.0 p -103.22 -43.69 5.39 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 127.185 2.194 . . . . 2.47 110.424 178.821 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 108.97 -11.73 34.5 Favored Glycine 0 CA--C 1.534 1.23 0 C-N-CA 124.591 1.091 . . . . 1.81 111.626 -166.447 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 76.6 m-85 -100.51 115.44 30.11 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 124.698 1.199 . . . . 3.34 109.187 175.412 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -87.43 81.51 7.8 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 125.889 1.676 . . . . 1.87 106.855 167.101 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -63.59 144.14 57.25 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 114.306 -1.316 . . . . 1.38 109.19 174.674 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -40.26 -51.35 2.73 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 125.247 1.419 . . . . 3.48 113.95 -171.056 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -71.57 -22.27 61.76 Favored 'General case' 0 N--CA 1.452 -0.325 0 O-C-N 121.274 -0.891 . . . . 3.54 112.14 -173.921 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 89.0 mt-10 -67.9 -38.42 82.96 Favored 'General case' 0 N--CA 1.456 -0.171 0 O-C-N 120.725 -1.235 . . . . 2.09 108.694 169.29 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -51.02 -47.35 61.67 Favored 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 109.231 -0.655 . . . . 2.62 109.231 171.714 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 29.3 ttpt -54.99 -13.57 1.17 Allowed 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 114.466 1.284 . . . . 2.32 114.466 176.234 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 78.8 m-85 -124.03 10.21 8.79 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 119.876 1.217 . . . . 5.35 112.289 173.61 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.438 ' CD1' HG21 ' A' ' 51' ' ' ILE . 85.5 t80 -49.76 -64.51 0.79 Allowed 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.89 1.276 . . . . 2.77 111.548 -169.321 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 70.2 mt -65.2 -12.86 55.7 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 113.443 0.905 . . . . 2.42 113.443 -176.79 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 11.1 mm-40 -61.31 -30.66 70.64 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 120.458 1.481 . . . . 1.67 110.505 -179.796 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.9 mptm? -59.74 -30.03 68.56 Favored 'General case' 0 CA--C 1.531 0.247 0 O-C-N 122.157 -0.339 . . . . 2.84 111.897 172.344 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 9.4 m-30 -86.75 -53.75 4.76 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 123.305 0.642 . . . . 3.1 109.659 -179.438 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -143.22 123.29 13.63 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.275 1.03 . . . . 3.7 108.493 -174.99 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 79.8 p -44.7 -37.12 3.5 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 126.423 1.889 . . . . 2.4 112.26 174.585 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -106.4 28.44 13.54 Favored Glycine 0 CA--C 1.525 0.669 0 C-N-CA 125.883 1.706 . . . . 1.48 111.946 -172.649 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -71.42 -165.85 0.16 Allowed 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 117.956 0.878 . . . . 1.42 111.681 174.546 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 6.0 tpt180 -113.48 -9.75 13.27 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 115.626 1.713 . . . . 3.11 115.626 -158.412 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 55.1 mm-40 -59.35 -6.9 1.11 Allowed 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 114.06 1.133 . . . . 4.57 114.06 -175.827 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.576 ' H ' HD22 ' A' ' 78' ' ' LEU . 0.9 OUTLIER -57.31 -39.97 76.92 Favored 'General case' 0 N--CA 1.446 -0.673 0 O-C-N 121.105 -0.997 . . . . 1.34 110.562 171.922 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 4.1 m -76.84 129.95 36.95 Favored 'General case' 0 C--N 1.345 0.385 0 C-N-CA 118.987 -1.085 . . . . 0.96 109.875 177.644 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -65.45 -43.81 89.22 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-N 115.285 -0.87 . . . . 3.25 110.677 177.497 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 73.7 m -50.11 -62.86 1.33 Allowed 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 119.41 1.005 . . . . 1.18 111.761 171.755 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -54.09 -42.51 69.45 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 118.207 0.458 . . . . 2.94 111.074 -177.532 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 5.8 m -57.7 -53.62 56.08 Favored 'General case' 0 C--N 1.34 0.179 0 CA-C-O 121.913 0.863 . . . . 0.89 109.785 173.824 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 8.5 tptt -58.67 -38.58 78.48 Favored 'General case' 0 N--CA 1.445 -0.722 0 C-N-CA 125.91 1.684 . . . . 3.97 110.591 -170.998 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 67.4 m -52.1 -46.99 65.49 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 118.988 0.813 . . . . 1.25 111.696 170.835 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -65.66 -56.38 12.44 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 108.298 -1.001 . . . . 2.22 108.298 177.542 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 3.5 ttp -45.3 -45.27 12.08 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.456 0.702 . . . . 3.43 111.991 178.628 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -58.84 -43.57 90.78 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 126.086 1.755 . . . . 0.67 112.21 -171.863 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -90.27 -31.66 16.88 Favored 'General case' 0 N--CA 1.461 0.098 0 C-N-CA 122.552 0.341 . . . . 0.64 111.45 -179.694 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -62.05 -48.56 79.69 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 123.025 0.53 . . . . 0.34 110.675 175.525 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -71.24 114.41 9.28 Favored 'General case' 0 N--CA 1.446 -0.626 0 N-CA-C 108.856 -0.794 . . . . 1.01 108.856 178.984 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 8.0 m-80 -110.22 37.14 2.8 Favored 'General case' 0 N--CA 1.463 0.202 0 N-CA-C 109.661 -0.496 . . . . 3.1 109.661 -179.135 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 32.9 m-20 -119.06 -47.53 2.48 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 125.093 1.357 . . . . 1.43 110.195 173.333 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 89.75 41.56 5.63 Favored Glycine 0 CA--C 1.53 0.989 0 N-CA-C 108.672 -1.771 . . . . 0.87 108.672 -155.985 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -121.94 -55.03 1.91 Allowed 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.363 1.065 . . . . 2.69 110.134 -179.861 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 121.44 -38.15 2.74 Favored Glycine 0 CA--C 1.527 0.828 0 C-N-CA 124.19 0.9 . . . . 0.7 111.253 176.78 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 77.9 mttt -69.58 121.87 17.95 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 107.384 -1.339 . . . . 4.16 107.384 176.973 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 9.0 mt -105.71 127.65 60.49 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.323 0 N-CA-C 108.603 -0.888 . . . . 0.71 108.603 -173.728 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -85.11 158.88 33.46 Favored Glycine 0 CA--C 1.528 0.905 0 N-CA-C 110.387 -1.085 . . . . 0.55 110.387 169.688 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -51.27 -34.82 34.52 Favored 'General case' 0 C--N 1.34 0.176 0 O-C-N 122.044 -0.68 . . . . 0.8 109.896 167.973 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 25.8 tt0 -61.67 -62.27 1.92 Allowed 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 123.57 0.748 . . . . 2.48 110.67 179.021 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -44.57 -48.61 10.31 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.164 0.985 . . . . 2.19 110.167 172.613 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -65.72 -42.05 91.53 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 115.956 -0.566 . . . . 2.76 111.522 -175.682 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 12.4 tt0 -61.19 -43.8 98.3 Favored 'General case' 0 C--O 1.222 -0.38 0 CA-C-O 118.166 -0.921 . . . . 2.72 108.962 173.697 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -54.15 -53.16 57.2 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 120.032 1.287 . . . . 3.12 110.916 176.57 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.97 -54.42 47.15 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 108.449 -0.945 . . . . 2.7 108.449 -179.026 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 92.5 t -74.9 -15.74 16.04 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 CA-C-N 115.308 -0.86 . . . . 1.56 112.866 -169.838 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 3.0 t60 -98.15 3.86 49.05 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 120.423 -1.423 . . . . 2.62 111.186 175.521 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 31.3 t . . . . . 0 C--O 1.254 1.297 0 CA-C-O 115.995 -1.955 . . . . 2.4 111.37 179.491 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.61 HG22 HG12 ' A' ' 47' ' ' VAL . 1.2 pp . . . . . 0 CA--C 1.539 0.538 0 CA-C-O 121.119 0.485 . . . . 1.78 110.275 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 2.8 t -82.44 52.37 2.04 Favored 'General case' 0 N--CA 1.438 -1.063 0 C-N-CA 125.979 1.712 . . . . 3.09 108.919 179.885 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -174.64 -50.89 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.126 0 C-N-CA 125.026 1.33 . . . . 3.11 108.394 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 24.2 t -51.08 -46.71 31.52 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 C-N-CA 124.144 0.978 . . . . 1.86 111.683 -177.734 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 11.7 tp -164.34 -58.47 0.03 OUTLIER 'General case' 0 CA--C 1.517 -0.305 0 N-CA-C 106.901 -1.518 . . . . 1.62 106.901 -177.229 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 2.3 m -49.26 -26.08 2.76 Favored 'General case' 0 C--O 1.215 -0.747 0 CA-C-O 117.785 -1.103 . . . . 0.99 112.948 -171.382 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -36.86 -48.46 0.75 Allowed 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 114.402 1.26 . . . . 1.06 114.402 168.741 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -70.17 -44.39 68.89 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-O 122.69 1.233 . . . . 2.09 109.375 -179.825 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -64.0 -41.57 97.44 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 124.612 1.165 . . . . 2.6 110.434 -173.365 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 45.8 pt -60.6 -39.74 82.38 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.811 0 O-C-N 121.289 -0.882 . . . . 1.44 110.299 175.153 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.16 -41.16 99.21 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 118.347 0.521 . . . . 1.0 109.788 178.86 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.48 -59.7 4.98 Favored 'General case' 0 CA--C 1.536 0.415 0 O-C-N 122.229 -0.294 . . . . 0.77 110.416 171.701 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -48.78 -47.52 41.9 Favored 'General case' 0 C--O 1.234 0.248 0 C-N-CA 125.842 1.657 . . . . 0.66 111.589 -176.525 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 18.9 tp -48.52 -43.86 35.63 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 126.199 1.799 . . . . 3.07 110.227 178.164 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -90.73 -42.98 10.4 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 110.052 -0.351 . . . . 2.92 110.052 -173.106 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -65.86 -34.46 78.2 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 122.379 0.271 . . . . 2.31 111.374 -173.657 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 58.2 m -123.18 62.93 1.01 Allowed 'General case' 0 C--O 1.234 0.263 0 C-N-CA 124.038 0.935 . . . . 1.81 108.495 171.777 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 36.4 ttt180 -82.5 -18.75 40.49 Favored 'General case' 0 CA--C 1.535 0.392 0 O-C-N 121.715 -0.616 . . . . 5.91 111.729 176.817 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -97.21 147.34 32.81 Favored Pre-proline 0 C--O 1.235 0.341 0 C-N-CA 124.986 1.315 . . . . 2.23 111.314 -166.429 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_endo -60.0 127.94 24.93 Favored 'Trans proline' 0 N--CA 1.452 -0.934 0 C-N-CA 123.049 2.499 . . . . 1.25 111.233 -173.658 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 41.7 m-20 76.29 18.44 1.87 Allowed 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 126.925 2.09 . . . . 2.92 111.944 169.36 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 7.2 m -90.15 -17.09 28.25 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.494 0.718 . . . . 0.7 111.989 -178.615 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -86.01 97.15 10.11 Favored 'General case' 0 CA--C 1.534 0.362 0 O-C-N 121.731 -0.606 . . . . 3.75 111.313 -157.857 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -80.44 155.47 74.02 Favored Pre-proline 0 CA--C 1.534 0.331 0 C-N-CA 123.918 0.887 . . . . 2.71 110.548 -178.938 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -70.81 -63.27 0.04 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.209 0 C-N-CA 122.534 2.156 . . . . 0.63 111.243 -177.636 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 38.2 mt-30 -61.12 -31.93 71.63 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 122.765 0.426 . . . . 2.46 110.867 -178.245 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.79 -64.43 0.96 Allowed 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 109.337 -0.616 . . . . 3.41 109.337 171.014 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 4.8 t80 -54.82 -48.38 72.88 Favored 'General case' 0 C--O 1.22 -0.469 0 C-N-CA 123.281 0.632 . . . . 2.21 110.676 -174.355 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -34.99 -64.09 0.29 Allowed 'General case' 0 C--O 1.234 0.267 0 C-N-CA 127.741 2.417 . . . . 5.11 111.837 171.86 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 -66.75 -48.61 68.58 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 108.747 -0.834 . . . . 3.32 108.747 -177.408 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -60.63 -25.57 66.39 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 123.582 0.753 . . . . 0.67 112.238 -174.627 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 30.7 t -89.82 -3.53 58.08 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 126.616 1.967 . . . . 1.43 111.086 -179.472 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 80.61 5.85 89.68 Favored Glycine 0 C--N 1.335 0.52 0 N-CA-C 111.326 -0.709 . . . . 0.68 111.326 172.359 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 80.7 mt -68.55 -26.57 65.48 Favored 'General case' 0 N--CA 1.445 -0.695 0 O-C-N 121.831 -0.805 . . . . 1.49 109.902 -177.153 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 24.2 t -64.02 -30.61 71.67 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.604 1.162 . . . . 2.15 111.387 169.117 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -86.6 -38.09 17.46 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 109.296 -0.631 . . . . 4.0 109.296 -176.353 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 28.6 mtt -56.18 128.13 34.1 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-O 120.968 0.413 . . . . 3.15 111.039 174.66 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 7.7 m -63.73 158.67 21.03 Favored 'General case' 0 N--CA 1.452 -0.335 0 O-C-N 121.74 -0.6 . . . . 2.1 110.057 173.428 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -43.01 -41.55 3.46 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 124.231 1.013 . . . . 0.72 111.983 177.005 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 7.8 m120 -55.0 -58.46 7.53 Favored 'General case' 0 N--CA 1.457 -0.093 0 C-N-CA 123.787 0.835 . . . . 2.53 110.075 177.648 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 13.4 mm-40 -60.49 -48.0 83.68 Favored 'General case' 0 C--O 1.219 -0.527 0 N-CA-C 109.555 -0.535 . . . . 2.85 109.555 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 77.1 t -54.55 -48.69 70.16 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 CA-C-N 118.975 0.807 . . . . 0.56 110.489 -179.645 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 63.9 tttt -74.9 -24.05 58.47 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 121.087 -1.008 . . . . 3.15 111.812 -178.784 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 61.3 t0 -66.66 -65.46 0.68 Allowed 'General case' 0 CA--C 1.529 0.151 0 N-CA-C 108.782 -0.821 . . . . 2.84 108.782 168.888 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.61 HG12 HG22 ' A' ' 3' ' ' ILE . 15.2 m -47.35 -50.88 7.2 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 C-N-CA 123.678 0.791 . . . . 0.59 110.805 179.406 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 20.9 m-85 -55.29 -43.77 75.07 Favored 'General case' 0 C--O 1.225 -0.225 0 CA-C-N 118.843 0.747 . . . . 6.72 111.975 177.695 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 84.0 mtm180 -68.37 -36.44 79.2 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 119.169 0.895 . . . . 6.09 112.261 176.524 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 49.4 t80 -63.96 -41.2 97.64 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 118.448 0.567 . . . . 2.91 109.509 -179.819 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.0 mp -78.02 -32.52 17.46 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 CA-C-O 118.607 -0.711 . . . . 2.07 111.975 177.003 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 52.4 t0 -66.98 75.57 0.12 Allowed 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 119.354 0.979 . . . . 1.86 108.983 170.501 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 25.3 t-20 -54.73 156.46 3.58 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 107.699 -1.223 . . . . 3.37 107.699 167.922 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 72.23 -44.77 0.6 Allowed 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 123.916 0.886 . . . . 3.48 113.118 -173.861 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 59.09 52.09 6.53 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 124.207 1.003 . . . . 3.84 111.312 -172.645 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 16.6 p -57.78 -6.98 0.6 Allowed 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.3 1.44 . . . . 1.94 113.093 166.419 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 73.78 14.07 80.18 Favored Glycine 0 CA--C 1.527 0.808 0 N-CA-C 110.0 -1.24 . . . . 1.59 110.0 -167.871 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 -148.06 141.93 25.78 Favored 'General case' 0 N--CA 1.441 -0.894 0 C-N-CA 124.929 1.292 . . . . 3.4 108.207 -179.235 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 4.9 mp -95.25 78.99 3.49 Favored 'General case' 0 N--CA 1.435 -1.212 0 N-CA-C 105.26 -2.126 . . . . 3.18 105.26 161.333 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -63.19 170.39 2.92 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-N 113.754 -1.566 . . . . 1.5 109.224 175.733 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -48.7 -57.33 6.45 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 120.059 1.299 . . . . 4.08 111.727 -171.255 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -45.32 -35.4 3.48 Favored 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 115.258 1.577 . . . . 3.51 115.258 172.082 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -57.86 -44.08 86.37 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 121.213 1.824 . . . . 2.38 109.379 174.498 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -77.89 16.81 0.65 Allowed 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 115.219 -0.901 . . . . 2.44 111.259 175.439 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 26.7 ttpt -106.22 5.78 30.19 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.825 1.25 . . . . 2.42 109.019 161.828 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 25.3 p90 -152.8 30.28 0.51 Allowed 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 118.606 0.639 . . . . 5.75 112.189 171.631 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 27.4 t80 -57.83 -61.75 2.3 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 119.116 0.871 . . . . 2.44 108.916 -179.277 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 1.3 mp -82.58 -13.91 55.75 Favored 'General case' 0 CA--C 1.535 0.374 0 O-C-N 120.951 -1.093 . . . . 2.46 113.238 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 48.9 mm-40 -69.5 14.06 0.11 Allowed 'General case' 0 CA--C 1.544 0.734 0 O-C-N 121.146 -0.971 . . . . 1.58 112.114 176.881 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.86 -25.85 12.46 Favored 'General case' 0 CA--C 1.533 0.293 0 O-C-N 120.21 -1.556 . . . . 3.64 110.326 165.28 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -81.14 -48.26 12.37 Favored 'General case' 0 N--CA 1.456 -0.159 0 N-CA-C 108.184 -1.043 . . . . 7.53 108.184 173.629 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -120.7 177.46 5.07 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 123.688 0.795 . . . . 4.03 110.672 -175.073 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 7.0 m -96.32 -28.16 14.62 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.704 1.202 . . . . 2.15 111.031 165.581 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -113.08 15.01 23.46 Favored Glycine 0 CA--C 1.527 0.802 0 C-N-CA 123.706 0.669 . . . . 1.26 112.081 -166.504 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -72.09 157.58 37.52 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 117.288 0.544 . . . . 2.07 111.059 -176.567 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.87 18.41 0.1 Allowed 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 115.597 1.702 . . . . 3.43 115.597 -159.228 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 73.1 mm-40 -58.96 -34.25 71.57 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 122.43 1.109 . . . . 3.96 111.718 -173.229 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.534 ' H ' HD22 ' A' ' 78' ' ' LEU . 0.1 OUTLIER -55.21 -35.4 64.83 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 114.764 -1.107 . . . . 0.76 111.912 175.759 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 52.6 m -76.6 106.03 8.01 Favored 'General case' 0 C--N 1.342 0.273 0 CA-C-N 119.117 0.871 . . . . 0.85 109.758 -179.045 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -56.17 -41.33 75.32 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 114.942 -1.027 . . . . 3.17 110.92 -176.605 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 69.8 m -62.38 -53.33 56.61 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.103 0.561 . . . . 1.49 111.864 -178.266 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -58.7 -46.63 86.84 Favored 'General case' 0 C--O 1.233 0.229 0 O-C-N 121.482 -0.761 . . . . 3.17 110.341 176.773 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -50.0 -51.17 43.87 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-O 121.545 0.688 . . . . 0.55 109.764 175.176 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 89.2 mttt -66.62 -28.25 68.34 Favored 'General case' 0 C--O 1.22 -0.481 0 C-N-CA 124.969 1.308 . . . . 5.02 111.61 -177.517 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 3.4 t -60.79 -47.19 87.46 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 119.561 1.073 . . . . 1.71 109.446 171.14 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -63.67 -51.3 65.72 Favored 'General case' 0 C--O 1.234 0.28 0 O-C-N 121.871 -0.518 . . . . 3.24 110.412 174.744 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 31.6 ttm -45.82 -50.97 13.6 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 123.263 0.352 . . . . 3.09 111.747 173.659 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -54.6 -46.27 73.76 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 125.831 1.652 . . . . 0.48 111.863 -169.177 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -86.54 -41.29 14.45 Favored 'General case' 0 C--O 1.226 -0.157 0 N-CA-C 111.635 0.235 . . . . 0.45 111.635 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -59.16 -39.3 82.03 Favored 'General case' 0 CA--C 1.521 -0.135 0 CA-C-N 118.092 0.406 . . . . 0.31 111.288 179.761 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 15.7 t0 -67.04 112.56 4.45 Favored 'General case' 0 N--CA 1.443 -0.811 0 N-CA-C 108.206 -1.035 . . . . 1.59 108.206 174.087 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 76.0 m-20 -93.14 4.97 53.09 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-O 118.747 -0.644 . . . . 2.65 110.908 -179.894 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 49.8 m-20 -99.71 -56.22 2.45 Favored 'General case' 0 C--N 1.345 0.404 0 CA-C-N 118.904 0.775 . . . . 1.21 110.975 -178.799 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 99.44 50.62 1.4 Allowed Glycine 0 CA--C 1.53 1.025 0 N-CA-C 108.69 -1.764 . . . . 0.8 108.69 -156.63 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 30.1 p-10 -134.74 -50.63 0.78 Allowed 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 126.191 1.796 . . . . 1.92 110.544 176.729 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 126.9 -46.87 1.05 Allowed Glycine 0 CA--C 1.521 0.428 0 C-N-CA 124.785 1.183 . . . . 0.83 110.716 170.473 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 6.3 ptpp? -57.21 136.29 56.46 Favored 'General case' 0 C--O 1.241 0.649 0 CA-C-N 117.282 0.541 . . . . 4.36 109.542 171.304 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 8.1 mt -125.41 114.6 40.45 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.197 0 C-N-CA 124.538 1.135 . . . . 0.67 108.646 -172.001 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -71.13 160.16 54.01 Favored Glycine 0 CA--C 1.531 1.032 0 N-CA-C 110.121 -1.192 . . . . 0.56 110.121 172.643 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -57.76 -36.91 72.75 Favored 'General case' 0 C--O 1.227 -0.12 0 O-C-N 121.848 -0.796 . . . . 1.08 109.354 171.909 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -47.51 -69.57 0.12 Allowed 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.98 0.912 . . . . 4.02 111.847 166.256 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -44.01 -46.46 8.36 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.428 1.091 . . . . 2.15 111.942 179.045 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -67.38 -50.16 60.88 Favored 'General case' 0 CA--C 1.541 0.629 0 O-C-N 121.997 -0.439 . . . . 3.74 111.869 -178.698 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 5.7 tm0? -62.22 -32.75 73.46 Favored 'General case' 0 C--O 1.223 -0.301 0 C-N-CA 124.083 0.953 . . . . 2.21 110.618 178.189 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -60.1 -60.11 4.35 Favored 'General case' 0 N--CA 1.456 -0.156 0 CA-C-N 119.123 0.874 . . . . 4.3 109.523 169.823 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 7.7 tpt -54.0 -44.32 70.77 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-O 121.072 0.463 . . . . 2.78 109.919 -174.019 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 46.0 t -72.44 -64.59 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.595 0 CA-C-N 115.872 -0.604 . . . . 1.26 111.403 178.825 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 22.5 t60 -58.17 -36.19 72.66 Favored 'General case' 0 C--N 1.331 -0.233 0 O-C-N 121.038 -1.039 . . . . 3.47 110.529 -169.529 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 80.6 p . . . . . 0 C--O 1.251 1.175 0 C-N-CA 125.938 1.695 . . . . 5.71 113.166 173.622 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.57 HG22 HG12 ' A' ' 47' ' ' VAL . 2.9 pt . . . . . 0 N--CA 1.463 0.181 0 CA-C-O 121.509 0.671 . . . . 1.64 112.237 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 11.9 t -54.51 -37.44 65.35 Favored 'General case' 0 N--CA 1.424 -1.763 0 C-N-CA 126.281 1.832 . . . . 2.27 112.355 -178.753 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 39.5 t0 -112.58 45.17 1.34 Allowed 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.769 0.828 . . . . 3.06 109.994 -175.635 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 66.1 t -120.05 -64.4 1.63 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.21 0 C-N-CA 124.23 1.012 . . . . 1.42 109.724 175.367 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -169.89 -54.45 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 106.704 -1.591 . . . . 1.17 106.704 -173.849 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 2.5 m -34.7 -29.61 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 129.507 3.123 . . . . 0.86 116.446 -172.185 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -49.08 -49.77 40.09 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 119.076 0.853 . . . . 0.78 111.939 172.781 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -63.03 -42.15 99.7 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-O 122.51 1.147 . . . . 2.09 109.484 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -68.29 -43.68 77.18 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-N 115.197 -0.911 . . . . 2.42 108.905 -171.647 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 10.0 pt -61.92 -37.49 78.37 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.943 0 O-C-N 121.21 -0.931 . . . . 1.32 111.526 174.029 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.44 -44.57 89.22 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 118.928 0.785 . . . . 0.78 110.305 175.331 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.21 -56.26 24.4 Favored 'General case' 0 CA--C 1.535 0.4 0 O-C-N 122.198 -0.314 . . . . 0.56 110.737 173.018 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -53.72 -44.19 69.67 Favored 'General case' 0 N--CA 1.457 -0.097 0 C-N-CA 124.691 1.196 . . . . 0.6 111.256 -175.579 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.9 tt -51.29 -38.72 54.4 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 125.302 1.441 . . . . 3.42 110.838 177.428 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 13.0 tt0 -89.18 -43.54 10.94 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 117.725 0.238 . . . . 2.9 110.807 -177.328 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -69.15 -34.74 75.46 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 117.865 0.302 . . . . 3.16 111.104 -175.528 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 19.6 t -108.29 52.62 0.71 Allowed 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 125.303 1.441 . . . . 2.95 109.462 175.416 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 5.8 ttt-85 -92.41 -46.92 7.43 Favored 'General case' 0 C--O 1.231 0.112 0 C-N-CA 123.426 0.69 . . . . 4.15 109.516 179.027 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -62.72 148.67 90.89 Favored Pre-proline 0 CA--C 1.537 0.471 0 C-N-CA 125.523 1.529 . . . . 2.81 109.483 178.665 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -67.83 138.58 45.12 Favored 'Trans proline' 0 N--CA 1.451 -1.022 0 C-N-CA 122.123 1.882 . . . . 1.31 111.386 -175.364 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 64.48 25.58 13.31 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 126.165 1.786 . . . . 2.36 111.695 170.78 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 8.6 m -91.53 -13.62 31.78 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 124.558 1.143 . . . . 1.05 111.574 -179.848 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 3.4 t80 -54.51 120.6 6.89 Favored 'General case' 0 CA--C 1.534 0.339 0 O-C-N 121.635 -0.666 . . . . 4.02 111.325 179.829 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -119.43 155.37 54.11 Favored Pre-proline 0 CA--C 1.537 0.477 0 C-N-CA 125.393 1.477 . . . . 2.42 109.665 169.674 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -67.19 -82.21 0.01 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.706 0 C-N-CA 123.736 2.958 . . . . 1.01 112.083 -176.085 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 47.1 mt-30 -49.31 -45.64 45.61 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 124.584 1.154 . . . . 1.77 111.189 -176.481 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -39.41 -68.2 0.18 Allowed 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 125.111 1.364 . . . . 2.61 110.004 166.963 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 25.2 t80 -65.05 -38.21 90.1 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 122.421 0.288 . . . . 3.03 111.291 -174.764 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 9.0 m-30 -57.41 -43.0 83.37 Favored 'General case' 0 CA--C 1.53 0.189 0 O-C-N 121.345 -0.847 . . . . 4.87 110.323 179.001 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -69.73 -52.45 25.31 Favored 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 109.481 -0.563 . . . . 2.74 109.481 174.643 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -63.64 -26.72 68.8 Favored 'General case' 0 N--CA 1.446 -0.63 0 C-N-CA 123.033 0.533 . . . . 0.99 111.559 -170.141 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 25.8 t -93.42 1.14 56.97 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 125.488 1.515 . . . . 1.68 111.787 178.623 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 88.79 -11.46 68.75 Favored Glycine 0 C--N 1.337 0.632 0 C-N-CA 124.276 0.941 . . . . 1.05 111.288 171.398 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 52.8 mt -65.15 -38.17 89.72 Favored 'General case' 0 N--CA 1.44 -0.936 0 C-N-CA 124.578 1.151 . . . . 1.44 111.367 -167.909 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 46.0 m -70.13 -20.6 63.16 Favored 'General case' 0 N--CA 1.461 0.106 0 CA-C-N 118.524 0.602 . . . . 3.03 111.954 174.855 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 13.2 tttt -86.65 -38.04 17.44 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 108.678 -0.86 . . . . 4.11 108.678 -178.76 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 31.1 mmt -58.87 131.47 51.08 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-O 121.588 0.709 . . . . 3.16 109.625 169.331 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -68.63 158.47 34.0 Favored 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 108.659 -0.867 . . . . 2.16 108.659 179.575 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -41.82 -42.58 2.71 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 124.407 1.083 . . . . 0.72 112.408 177.606 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -52.34 -55.11 23.71 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.523 0.729 . . . . 2.51 111.535 174.707 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 16.9 mm100 -69.0 -39.1 79.52 Favored 'General case' 0 N--CA 1.454 -0.234 0 O-C-N 122.04 -0.413 . . . . 2.89 110.426 -177.928 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 94.2 t -59.1 -41.14 82.65 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 O-C-N 121.568 -0.707 . . . . 0.63 109.408 175.736 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 83.2 tttt -64.47 -40.21 95.26 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.21 0.604 . . . . 2.56 111.023 175.772 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -57.5 -64.65 0.82 Allowed 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 118.759 0.709 . . . . 3.23 110.513 173.164 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.57 HG12 HG22 ' A' ' 3' ' ' ILE . 14.9 m -53.61 -45.27 59.64 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.306 0 N-CA-C 110.32 -0.252 . . . . 0.7 110.32 -175.71 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.833 ' CZ ' ' HB2' ' A' ' 100' ' ' ALA . 14.6 t80 -40.96 -44.83 2.43 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 125.16 1.384 . . . . 4.71 112.72 172.67 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 47.4 mtp180 -58.63 -30.34 67.21 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 119.107 0.867 . . . . 3.02 112.071 -178.046 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -79.0 -38.07 37.6 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 123.291 0.636 . . . . 4.13 109.509 -178.559 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 4.1 mp -66.72 176.14 0.44 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.939 0 C-N-CA 124.319 1.048 . . . . 2.42 108.398 168.968 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 18.5 t70 73.67 -51.05 0.7 Allowed 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 127.199 2.2 . . . . 3.86 111.209 -174.944 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 7.1 t30 77.51 -42.09 0.38 Allowed 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 125.442 1.497 . . . . 1.85 112.581 175.456 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 86.1 m-20 -48.48 -52.32 22.94 Favored 'General case' 0 C--N 1.342 0.242 0 N-CA-C 108.237 -1.023 . . . . 2.87 108.237 165.302 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 91.88 -1.88 0.17 Allowed 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 128.817 2.847 . . . . 4.33 110.477 -164.565 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 95.5 p -46.75 -41.86 15.89 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 126.936 2.094 . . . . 2.17 111.309 168.972 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 87.3 -14.16 58.31 Favored Glycine 0 CA--C 1.528 0.892 0 C-N-CA 123.747 0.689 . . . . 2.51 113.073 -174.979 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 33.6 m-85 -76.86 100.75 5.63 Favored 'General case' 0 CA--C 1.511 -0.524 0 N-CA-C 107.064 -1.458 . . . . 2.38 107.064 165.113 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 8.6 mp -68.87 87.93 0.37 Allowed 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 106.137 -1.801 . . . . 2.75 106.137 163.012 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -67.28 152.18 46.18 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.133 1.373 . . . . 1.47 108.415 168.015 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -46.4 -53.83 10.27 Favored 'General case' 0 CA--C 1.535 0.374 0 O-C-N 121.229 -0.919 . . . . 3.76 112.973 -173.192 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -55.38 -27.7 49.2 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.256 0.622 . . . . 3.17 112.509 179.739 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 64.9 mt-10 -75.18 -29.29 60.34 Favored 'General case' 0 C--N 1.33 -0.268 0 O-C-N 120.083 -1.635 . . . . 2.01 111.074 177.376 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 17.4 mt -66.42 -20.65 66.11 Favored 'General case' 0 N--CA 1.449 -0.476 0 O-C-N 121.82 -0.55 . . . . 2.36 110.498 173.165 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 26.6 ttpt -63.52 -6.83 5.63 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.299 0.64 . . . . 2.14 111.843 168.054 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 20.6 p90 -135.33 31.37 3.18 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 120.061 1.3 . . . . 5.2 112.561 169.306 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -50.92 -70.45 0.08 Allowed 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 123.567 0.747 . . . . 2.21 112.304 -178.327 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 2.4 tp -77.94 -20.47 52.71 Favored 'General case' 0 CA--C 1.533 0.318 0 O-C-N 121.059 -1.026 . . . . 2.49 111.63 -179.8 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.07 -13.09 10.05 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.638 1.175 . . . . 2.4 111.111 175.684 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.56 -34.11 77.17 Favored 'General case' 0 N--CA 1.449 -0.479 0 O-C-N 120.996 -1.065 . . . . 2.78 111.991 170.413 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -90.62 -61.86 1.58 Allowed 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 108.06 -1.089 . . . . 7.08 108.06 178.09 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -104.1 -176.65 3.14 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 124.467 1.107 . . . . 3.58 108.418 -170.368 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 66.3 m -124.55 -15.57 6.55 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 119.639 1.109 . . . . 2.34 113.686 -177.801 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -131.72 39.34 1.78 Allowed Glycine 0 CA--C 1.525 0.681 0 C-N-CA 125.151 1.358 . . . . 1.28 111.007 -176.256 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -74.9 -134.51 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.183 0.993 . . . . 1.72 110.286 173.839 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 5.4 tpt85 -124.47 -4.14 7.8 Favored 'General case' 0 CA--C 1.534 0.362 0 O-C-N 121.028 -1.045 . . . . 3.9 113.028 -168.057 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -57.18 -23.52 48.17 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.274 1.03 . . . . 3.12 112.956 -163.177 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.821 ' H ' HD22 ' A' ' 78' ' ' LEU . 0.0 OUTLIER -56.07 -42.19 76.27 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 125.104 1.362 . . . . 0.96 111.834 173.31 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 90.6 m -71.78 102.44 2.84 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 121.599 0.714 . . . . 0.83 110.258 -176.127 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -52.35 -42.1 63.62 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 114.663 -1.153 . . . . 3.09 111.754 -179.278 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 65.7 m -57.76 -40.64 80.25 Favored 'General case' 0 CA--C 1.531 0.23 0 O-C-N 121.342 -0.849 . . . . 1.24 112.308 177.331 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -79.39 -45.77 18.87 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 108.634 -0.876 . . . . 2.69 108.634 -172.705 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -47.79 -55.18 10.24 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-O 121.144 0.497 . . . . 0.57 110.136 167.658 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 27.4 pttt -71.54 -22.27 61.79 Favored 'General case' 0 C--O 1.217 -0.642 0 CA-C-O 118.535 -0.745 . . . . 5.53 111.132 -172.281 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 15.6 t -60.6 -49.83 75.96 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 119.965 1.257 . . . . 1.93 109.073 169.084 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.7 tt -58.16 -54.4 47.41 Favored 'General case' 0 C--N 1.342 0.256 0 N-CA-C 109.404 -0.591 . . . . 3.03 109.404 174.15 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 25.2 ttp -48.21 -52.54 20.54 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 121.046 0.451 . . . . 2.69 111.853 178.717 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -55.01 -40.62 70.36 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 126.293 1.837 . . . . 0.57 111.749 -169.38 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -92.41 -40.35 10.93 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 122.369 0.267 . . . . 0.59 111.701 -178.828 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -58.23 -40.39 81.58 Favored 'General case' 0 C--N 1.339 0.119 0 CA-C-N 118.123 0.42 . . . . 0.4 110.533 176.787 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -70.18 120.68 16.22 Favored 'General case' 0 N--CA 1.444 -0.768 0 N-CA-C 108.469 -0.938 . . . . 1.02 108.469 174.772 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 9.2 m-80 -106.53 12.78 29.14 Favored 'General case' 0 C--N 1.331 -0.21 0 C-N-CA 122.794 0.438 . . . . 2.87 111.152 -179.602 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 38.1 m-20 -99.1 -39.25 8.59 Favored 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 122.987 0.515 . . . . 1.38 109.901 178.09 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 86.09 38.98 8.18 Favored Glycine 0 CA--C 1.529 0.907 0 N-CA-C 108.753 -1.739 . . . . 0.82 108.753 -156.916 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -119.87 -58.77 1.86 Allowed 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 117.795 0.797 . . . . 2.47 111.089 -178.991 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 126.77 -38.93 2.07 Favored Glycine 0 CA--C 1.528 0.889 0 C-N-CA 124.171 0.891 . . . . 0.66 111.506 178.875 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 31.6 mmtp -60.81 117.25 5.17 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 108.141 -1.059 . . . . 3.99 108.141 173.798 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 6.8 mt -108.66 113.8 45.02 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.09 0 N-CA-C 109.317 -0.623 . . . . 0.83 109.317 -178.943 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -75.96 170.42 54.71 Favored Glycine 0 CA--C 1.53 1.015 0 N-CA-C 110.879 -0.888 . . . . 0.5 110.879 170.6 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' ALA . . . . . 0.833 ' HB2' ' CZ ' ' A' ' 48' ' ' PHE . . . -55.34 -42.39 73.77 Favored 'General case' 0 CA--C 1.515 -0.372 0 O-C-N 122.234 -0.568 . . . . 0.68 109.672 173.104 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.16 -63.54 1.26 Allowed 'General case' 0 N--CA 1.447 -0.576 0 O-C-N 124.264 0.977 . . . . 2.75 108.822 -177.057 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -42.25 -52.59 4.4 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.787 0.835 . . . . 1.35 111.769 173.139 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 42.3 t80 -59.76 -56.37 22.7 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-O 121.267 0.556 . . . . 3.45 110.603 -176.625 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -61.57 -37.91 85.6 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 124.764 1.226 . . . . 3.03 110.89 -176.264 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -54.61 -62.98 1.3 Allowed 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 119.411 1.005 . . . . 3.77 109.155 172.095 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 1.7 tpt -63.59 -37.59 87.89 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 120.622 -0.431 . . . . 3.63 111.417 -171.685 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 49.7 t -62.74 -48.21 89.24 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.22 0 C-N-CA 123.063 0.545 . . . . 1.28 110.886 174.024 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 83.9 t60 -67.83 -30.82 70.31 Favored 'General case' 0 N--CA 1.456 -0.141 0 C-N-CA 123.371 0.668 . . . . 2.08 110.55 -173.435 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 5.1 t . . . . . 0 C--O 1.251 1.159 0 C-N-CA 125.962 1.705 . . . . 2.64 112.141 177.694 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.642 HG22 HG12 ' A' ' 47' ' ' VAL . 1.5 pp . . . . . 0 CA--C 1.519 -0.224 0 CA-C-O 121.397 0.618 . . . . 1.25 111.139 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 62.8 p -58.12 -56.27 24.26 Favored 'General case' 0 N--CA 1.439 -1.004 0 C-N-CA 123.881 0.872 . . . . 3.06 108.81 -178.085 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 38.5 t0 -80.99 45.33 0.82 Allowed 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.929 2.091 . . . . 2.43 111.4 -169.73 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 73.9 t -143.46 -57.59 0.16 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.14 0 C-N-CA 126.832 2.053 . . . . 1.57 107.77 -178.085 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 4.2 tp -166.25 -56.11 0.03 OUTLIER 'General case' 0 C--N 1.334 -0.093 0 N-CA-C 106.302 -1.74 . . . . 1.09 106.302 -176.793 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -45.9 -23.57 0.3 Allowed 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 127.631 2.372 . . . . 1.13 115.496 -165.313 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -49.66 -47.57 49.95 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 119.558 1.072 . . . . 0.93 111.525 170.931 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -63.81 -39.81 95.13 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-O 122.449 1.119 . . . . 1.79 109.725 -179.414 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -72.76 -42.58 63.86 Favored 'General case' 0 N--CA 1.443 -0.792 0 C-N-CA 123.714 0.806 . . . . 2.44 109.987 -173.271 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 29.0 pt -61.92 -41.43 90.83 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.769 0 O-C-N 121.224 -0.923 . . . . 0.97 110.249 172.707 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.25 -46.53 76.07 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 118.947 0.794 . . . . 0.71 111.129 173.062 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -57.04 -59.14 5.5 Favored 'General case' 0 CA--C 1.536 0.41 0 O-C-N 121.617 -0.677 . . . . 0.53 110.837 174.046 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -46.11 -43.58 14.92 Favored 'General case' 0 CA--C 1.528 0.132 0 C-N-CA 125.633 1.573 . . . . 0.68 111.484 178.717 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 39.5 tp -60.26 -40.56 90.76 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 123.833 0.853 . . . . 2.78 110.508 -176.622 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 18.2 tt0 -87.91 -40.1 14.23 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 110.3 -0.259 . . . . 2.7 110.3 -173.847 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.4 pp20? -68.11 -49.19 62.7 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 109.232 -0.655 . . . . 3.4 109.232 -179.392 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -86.4 46.88 1.39 Allowed 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 124.543 1.137 . . . . 1.95 108.855 -179.608 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 61.1 ttt180 -87.29 -56.42 3.38 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 108.458 -0.941 . . . . 4.25 108.458 -176.351 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -55.13 131.35 68.62 Favored Pre-proline 0 N--CA 1.449 -0.508 0 CA-C-O 118.657 -0.687 . . . . 2.32 109.47 176.381 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -62.78 150.1 89.21 Favored 'Trans proline' 0 N--CA 1.453 -0.895 0 C-N-CA 122.443 2.095 . . . . 1.25 110.304 -173.813 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 66.99 3.78 3.27 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.902 1.681 . . . . 2.99 113.367 174.62 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 12.5 m -77.9 -7.74 57.14 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 120.783 -1.198 . . . . 0.81 111.981 -176.519 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 41.3 t80 -68.48 113.68 6.23 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 121.429 -0.794 . . . . 4.26 111.927 -173.114 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -102.87 155.61 36.35 Favored Pre-proline 0 CA--C 1.542 0.65 0 C-N-CA 125.396 1.478 . . . . 2.74 111.035 166.944 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.36 -71.8 0.02 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.531 0 C-N-CA 124.47 3.446 . . . . 0.78 112.575 -175.114 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 35.1 mt-30 -52.94 -46.35 68.08 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 123.734 0.814 . . . . 2.65 110.567 -178.428 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -44.56 -67.39 0.29 Allowed 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 124.931 1.292 . . . . 3.7 108.349 170.182 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 51.1 t80 -48.95 -52.96 21.83 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-O 118.635 -0.697 . . . . 2.82 111.768 178.47 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.465 ' CE1' HD21 ' A' ' 86' ' ' LEU . 16.9 m-85 -52.11 -45.46 64.9 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 119.486 1.039 . . . . 4.78 111.698 -176.441 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -72.87 -42.84 63.23 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 119.704 -0.798 . . . . 3.1 110.293 179.265 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -61.31 -36.28 79.69 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 123.357 0.663 . . . . 0.81 111.716 -178.517 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 57.7 p -83.03 -0.12 47.45 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 124.245 1.018 . . . . 1.99 111.206 178.848 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 82.19 -8.58 60.44 Favored Glycine 0 C--N 1.337 0.636 0 N-CA-C 110.773 -0.931 . . . . 0.83 110.773 176.363 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 75.0 mt -59.39 -38.03 79.5 Favored 'General case' 0 N--CA 1.442 -0.855 0 C-N-CA 124.456 1.102 . . . . 1.31 111.212 -174.381 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 21.3 m -71.45 -23.14 61.78 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 118.663 0.665 . . . . 2.85 112.057 176.352 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 6.8 ttpt -83.87 -36.36 23.47 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 109.124 -0.695 . . . . 4.42 109.124 179.008 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 14.2 mmt -59.95 135.72 57.79 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-O 121.631 0.729 . . . . 2.57 110.445 173.21 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 69.5 m -63.58 152.45 38.74 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 116.082 -0.508 . . . . 1.84 110.382 174.458 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -39.51 -40.76 0.9 Allowed 'General case' 0 C--O 1.224 -0.246 0 C-N-CA 125.674 1.59 . . . . 0.66 111.976 172.805 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 67.7 m-20 -52.33 -56.16 16.73 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.632 1.173 . . . . 1.57 111.45 176.103 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -72.65 -38.87 67.54 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 108.98 -0.748 . . . . 3.62 108.98 -174.922 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.422 ' CG1' ' CZ ' ' A' ' 48' ' ' PHE . 52.7 t -58.52 -47.77 87.39 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 CA-C-O 121.342 0.591 . . . . 0.6 109.557 175.565 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -55.58 -48.97 73.95 Favored 'General case' 0 N--CA 1.453 -0.291 0 O-C-N 121.228 -0.92 . . . . 2.83 109.952 173.84 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -57.31 -51.13 70.63 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 120.224 -0.59 . . . . 2.99 111.294 179.924 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.642 HG12 HG22 ' A' ' 3' ' ' ILE . 3.7 m -55.19 -42.14 64.17 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 O-C-N 121.785 -0.572 . . . . 0.65 110.484 178.186 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.499 ' CZ ' ' HB3' ' A' ' 103' ' ' PHE . 17.3 m-30 -54.34 -34.42 61.03 Favored 'General case' 0 C--N 1.341 0.217 0 N-CA-C 113.027 0.751 . . . . 5.89 113.027 174.746 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 81.2 mtp180 -61.58 -40.53 95.09 Favored 'General case' 0 CA--C 1.529 0.154 0 CA-C-N 119.506 1.048 . . . . 4.24 109.975 174.882 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -64.5 -43.56 93.72 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 109.36 -0.607 . . . . 4.07 109.36 176.23 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.423 HD11 ' CZ ' ' A' ' 71' ' ' PHE . 27.9 mm -58.09 -54.91 25.92 Favored 'Isoleucine or valine' 0 C--O 1.237 0.401 0 CA-C-O 118.799 -0.62 . . . . 1.55 110.874 177.64 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -75.89 64.19 1.81 Allowed 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 124.821 1.248 . . . . 1.92 109.326 -173.179 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 31.6 t30 -55.27 -32.83 62.68 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 125.869 1.668 . . . . 1.87 111.942 -174.139 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 16.6 p-10 -74.5 -29.05 61.26 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.947 1.699 . . . . 2.36 111.977 175.163 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 8.7 mt-30 57.31 60.64 2.83 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 125.285 1.434 . . . . 2.92 110.859 -173.152 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 79.1 p -89.34 -46.02 9.06 Favored 'General case' 0 C--N 1.337 0.048 0 C-N-CA 123.858 0.863 . . . . 1.4 111.134 174.193 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 113.47 -18.87 20.06 Favored Glycine 0 CA--C 1.531 1.066 0 C-N-CA 123.912 0.768 . . . . 1.29 111.42 -164.871 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 77.9 m-85 -118.48 142.8 47.22 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 124.073 0.949 . . . . 2.53 110.076 178.324 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.428 HD13 ' CE2' ' A' ' 103' ' ' PHE . 0.2 OUTLIER -104.01 70.3 0.99 Allowed 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 124.648 1.179 . . . . 3.09 108.695 173.352 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -56.29 158.5 4.13 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.584 1.553 . . . . 2.04 111.472 176.931 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 54.9 mt-10 -43.67 -56.29 3.85 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 125.029 1.332 . . . . 3.41 113.633 -175.728 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 16.3 tt0 -62.88 -25.64 68.39 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 121.969 -0.457 . . . . 3.08 111.789 -178.633 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -71.02 -41.2 71.18 Favored 'General case' 0 N--CA 1.446 -0.652 0 O-C-N 121.109 -0.994 . . . . 2.81 109.272 175.205 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -53.78 -40.67 66.46 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 122.85 0.46 . . . . 2.81 110.416 172.629 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 21.3 ttpt -53.58 -16.55 1.6 Allowed 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.143 0.977 . . . . 1.97 112.814 174.805 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 59.5 m-85 -132.8 53.76 1.99 Allowed 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 118.923 0.783 . . . . 4.65 110.368 167.295 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 48.8 t80 -79.21 -75.84 0.23 Allowed 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.98 0.912 . . . . 2.31 109.97 173.787 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 1.7 tp -76.11 -8.91 58.07 Favored 'General case' 0 CA--C 1.542 0.636 0 O-C-N 120.438 -1.414 . . . . 2.45 112.341 -176.776 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 61.1 mm-40 -47.5 -49.43 25.91 Favored 'General case' 0 C--N 1.343 0.289 0 C-N-CA 124.264 1.025 . . . . 1.65 110.886 175.478 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.4 -11.25 14.62 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 112.919 0.711 . . . . 3.53 112.919 -177.958 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.423 ' CZ ' HD11 ' A' ' 51' ' ' ILE . 13.4 m-30 -100.96 -60.13 1.58 Allowed 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 124.025 0.93 . . . . 3.62 110.067 178.688 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -101.21 -22.43 14.66 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 112.354 0.502 . . . . 3.51 112.354 -170.256 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 3.4 t 74.97 -50.7 0.67 Allowed 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 125.663 1.585 . . . . 2.46 110.654 -174.385 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -99.99 41.02 2.26 Favored Glycine 0 CA--C 1.526 0.777 0 O-C-N 121.239 -0.913 . . . . 1.03 111.065 179.096 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -80.98 -172.03 3.51 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 117.199 0.499 . . . . 1.39 111.287 179.805 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -87.84 -7.26 57.49 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 123.427 0.691 . . . . 2.97 112.536 -167.187 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -49.28 -35.55 18.2 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.453 1.501 . . . . 3.18 113.299 -163.426 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.557 ' H ' HD22 ' A' ' 78' ' ' LEU . 0.1 OUTLIER -52.08 -44.57 64.41 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.389 1.076 . . . . 0.85 112.025 173.58 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 32.1 m -65.1 107.71 1.62 Allowed 'General case' 0 C--O 1.236 0.366 0 CA-C-O 122.075 0.94 . . . . 0.81 110.294 179.025 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -58.29 -41.58 84.69 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 113.925 -1.489 . . . . 2.72 110.347 -178.934 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -48.1 -59.13 3.62 Favored 'General case' 0 C--O 1.225 -0.215 0 CA-C-N 118.863 0.756 . . . . 1.54 111.341 176.649 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 14.5 mt-10 -71.7 -42.68 67.08 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 123.795 0.838 . . . . 2.68 109.382 -168.049 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -49.08 -52.73 24.03 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 116.105 -0.498 . . . . 0.59 110.049 168.3 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 15.0 mmmt -69.17 -31.91 70.87 Favored 'General case' 0 C--O 1.22 -0.463 0 C-N-CA 123.402 0.681 . . . . 4.51 111.07 -174.323 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 70.9 m -58.26 -42.82 87.27 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 120.084 1.311 . . . . 1.4 110.644 170.2 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.465 HD21 ' CE1' ' A' ' 31' ' ' PHE . 0.5 OUTLIER -61.33 -62.56 1.75 Allowed 'General case' 0 C--O 1.234 0.254 0 N-CA-C 108.397 -0.964 . . . . 2.99 108.397 172.062 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 9.7 ttm -49.27 -48.51 45.84 Favored 'General case' 0 CA--C 1.536 0.418 0 O-C-N 123.666 0.604 . . . . 4.4 112.435 -173.272 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -49.72 -46.04 49.84 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 126.627 1.971 . . . . 0.7 111.955 -178.89 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -83.63 -49.86 8.77 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 110.433 -0.21 . . . . 0.83 110.433 -177.689 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.479 ' HB3' HD13 ' A' ' 98' ' ' ILE . . . -54.46 -41.83 69.94 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 122.691 0.396 . . . . 0.64 111.681 -178.753 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -74.42 81.75 1.92 Allowed 'General case' 0 N--CA 1.446 -0.658 0 CA-C-O 121.352 0.596 . . . . 1.23 110.084 178.94 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 42.6 p-10 -77.46 49.88 0.76 Allowed 'General case' 0 CA--C 1.536 0.414 0 O-C-N 121.646 -0.659 . . . . 2.67 111.315 176.023 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 34.2 m-20 -137.53 -60.44 0.66 Allowed 'General case' 0 C--N 1.341 0.231 0 C-N-CA 126.356 1.862 . . . . 1.22 109.258 178.595 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 102.26 43.27 2.06 Favored Glycine 0 CA--C 1.533 1.199 0 C-N-CA 125.028 1.299 . . . . 1.06 110.247 -161.95 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -121.85 -61.53 1.49 Allowed 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.948 1.699 . . . . 1.94 109.552 173.427 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 119.55 -24.13 8.17 Favored Glycine 0 CA--C 1.53 0.975 0 C-N-CA 125.2 1.381 . . . . 0.79 111.28 -179.533 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 41.0 mttt -78.86 103.72 9.0 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 107.673 -1.232 . . . . 5.17 107.673 171.393 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' ILE . . . . . 0.479 HD13 ' HB3' ' A' ' 90' ' ' ALA . 67.8 mt -94.43 118.92 41.57 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.577 0 N-CA-C 107.794 -1.188 . . . . 0.91 107.794 -176.121 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -72.51 166.87 53.83 Favored Glycine 0 CA--C 1.534 1.244 0 CA-C-O 121.69 0.606 . . . . 0.55 111.835 170.577 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -61.18 -37.15 81.92 Favored 'General case' 0 N--CA 1.456 -0.143 0 O-C-N 121.285 -1.127 . . . . 0.59 110.087 178.058 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 56.0 mt-10 -62.34 -55.81 24.45 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-O 118.686 -0.673 . . . . 2.75 110.552 176.173 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -43.7 -50.3 7.61 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-O 121.829 0.824 . . . . 1.44 110.008 173.936 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' PHE . . . . . 0.499 ' HB3' ' CZ ' ' A' ' 48' ' ' PHE . 0.8 OUTLIER -61.3 -54.2 47.0 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 112.868 0.692 . . . . 4.01 112.868 177.867 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 18.7 tt0 -53.66 -49.88 66.99 Favored 'General case' 0 C--O 1.223 -0.308 0 C-N-CA 124.55 1.14 . . . . 2.41 108.756 -178.714 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 65.4 mt-10 -48.99 -58.23 5.23 Favored 'General case' 0 C--O 1.232 0.165 0 C-N-CA 123.952 0.901 . . . . 3.46 110.064 176.928 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.3 -47.86 84.02 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 120.776 -0.37 . . . . 3.61 111.193 -175.518 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 37.4 t -58.67 -44.95 90.9 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.193 0 C-N-CA 122.974 0.509 . . . . 1.28 111.393 178.444 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 63.4 t60 -62.88 -30.08 71.24 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 125.65 1.58 . . . . 2.52 110.179 -173.268 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 2.9 t . . . . . 0 C--O 1.251 1.154 0 CA-C-O 116.848 -1.549 . . . . 2.77 111.701 -177.195 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.439 HG22 HG12 ' A' ' 47' ' ' VAL . 1.2 pp . . . . . 0 CA--C 1.529 0.157 0 CA-C-O 121.641 0.734 . . . . 1.29 110.035 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 9.9 t -74.12 7.78 2.51 Favored 'General case' 0 N--CA 1.436 -1.173 0 C-N-CA 126.574 1.95 . . . . 1.9 111.056 -174.486 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -168.38 45.84 0.04 OUTLIER 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 126.54 1.936 . . . . 3.62 105.804 -158.493 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -148.13 -50.83 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.529 0.152 0 CA-C-N 115.38 -0.827 . . . . 1.78 110.879 179.849 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 177.98 -56.1 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 105.945 -1.872 . . . . 1.19 105.945 -172.81 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 8.4 m -44.39 -32.92 1.49 Allowed 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 126.243 1.817 . . . . 0.91 115.393 -172.344 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -49.53 -43.9 46.02 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 119.489 1.041 . . . . 0.84 112.941 175.349 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 42.9 t0 -72.34 -39.24 68.28 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 122.725 1.25 . . . . 2.04 109.751 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 43.9 m-20 -62.16 -44.99 95.38 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 123.581 0.752 . . . . 2.51 110.276 -178.213 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 39.0 pt -62.83 -40.94 90.65 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.196 0 CA-C-O 118.231 -0.89 . . . . 0.79 110.13 177.479 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -52.36 -47.74 65.96 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 119.291 0.95 . . . . 0.69 111.043 174.538 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -54.17 -60.78 2.88 Favored 'General case' 0 CA--C 1.529 0.162 0 O-C-N 122.334 -0.229 . . . . 0.65 111.083 173.173 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -50.98 -48.63 61.15 Favored 'General case' 0 C--O 1.233 0.222 0 C-N-CA 123.269 0.628 . . . . 0.66 112.09 -177.77 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -48.73 -50.03 35.48 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 125.203 1.401 . . . . 4.12 110.053 178.9 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -79.23 -46.96 16.81 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 120.033 -0.667 . . . . 2.89 109.484 -174.98 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 43.9 tp10 -45.81 -50.4 14.16 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 124.507 1.123 . . . . 4.27 110.662 178.899 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 76.2 m -105.94 46.91 0.9 Allowed 'General case' 0 C--O 1.236 0.361 0 C-N-CA 123.053 0.541 . . . . 1.6 110.242 -178.078 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.24 -43.28 82.32 Favored 'General case' 0 C--N 1.343 0.322 0 CA-C-O 121.798 0.809 . . . . 7.14 109.078 -179.699 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -67.35 134.92 93.19 Favored Pre-proline 0 N--CA 1.442 -0.846 0 C-N-CA 125.885 1.674 . . . . 2.32 109.404 -173.223 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -63.76 148.31 92.09 Favored 'Trans proline' 0 N--CA 1.456 -0.705 0 C-N-CA 122.835 2.356 . . . . 1.29 112.01 -171.35 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 9.5 t70 69.27 -0.15 2.63 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 127.608 2.363 . . . . 3.68 113.639 179.172 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 14.9 m -77.55 -21.03 53.21 Favored 'General case' 0 C--N 1.341 0.215 0 N-CA-C 114.099 1.148 . . . . 0.93 114.099 -175.45 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -75.27 90.9 2.62 Favored 'General case' 0 CA--C 1.539 0.538 0 O-C-N 121.42 -0.8 . . . . 3.76 111.61 -165.063 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -77.48 155.11 81.61 Favored Pre-proline 0 CA--C 1.535 0.396 0 O-C-N 121.717 -0.614 . . . . 2.75 110.453 175.264 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -71.57 -67.23 0.03 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.108 0 C-N-CA 122.987 2.458 . . . . 0.77 111.804 -176.271 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 71.5 mt-30 -53.54 -44.6 69.34 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 118.565 0.62 . . . . 2.04 110.487 179.503 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 25.3 tptt -43.84 -62.29 1.16 Allowed 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.429 1.091 . . . . 2.83 110.062 169.105 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 16.0 t80 -53.6 -51.54 62.7 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.13 0.572 . . . . 2.82 111.406 179.025 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 7.4 m-30 -58.08 -34.69 70.42 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 121.593 -0.692 . . . . 5.0 111.576 -176.8 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 12.9 tt0 -73.58 -57.57 3.9 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 108.616 -0.883 . . . . 3.61 108.616 175.932 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -54.51 -38.03 66.03 Favored 'General case' 0 N--CA 1.444 -0.76 0 C-N-CA 124.829 1.252 . . . . 1.28 110.631 -172.605 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 69.2 m -88.6 1.78 54.34 Favored 'General case' 0 N--CA 1.445 -0.72 0 N-CA-C 112.926 0.713 . . . . 2.2 112.926 -177.165 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 76.83 -15.35 6.27 Favored Glycine 0 CA--C 1.532 1.147 0 O-C-N 119.951 -1.718 . . . . 1.23 112.836 172.295 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 94.2 mt -45.01 -35.24 2.82 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 127.445 2.298 . . . . 1.58 112.434 170.527 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 9.1 t -60.57 -37.99 83.11 Favored 'General case' 0 CA--C 1.529 0.157 0 O-C-N 121.683 -0.636 . . . . 2.02 110.57 176.281 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 29.1 tttp -89.45 -30.38 18.35 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-O 118.857 -0.592 . . . . 4.8 111.235 -174.995 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -31.73 -67.31 0.1 Allowed 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 125.852 1.661 . . . . 3.33 113.303 -174.545 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 26.1 m 135.34 143.97 0.0 OUTLIER 'General case' 0 C--O 1.234 0.242 0 C-N-CA 130.433 3.493 . . . . 1.71 106.719 -177.442 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -42.61 -41.9 3.23 Favored 'General case' 0 C--O 1.226 -0.179 0 C-N-CA 124.668 1.187 . . . . 0.64 111.393 175.485 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 50.2 m-20 -58.94 -57.74 11.73 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 123.616 0.766 . . . . 1.83 110.006 -176.943 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 3.4 mm-40 -62.42 -53.88 48.43 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 109.328 -0.619 . . . . 2.98 109.328 -178.353 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 70.0 t -49.62 -46.2 20.88 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.724 0 CA-C-O 121.664 0.745 . . . . 0.79 111.192 177.737 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -63.17 -46.22 88.14 Favored 'General case' 0 N--CA 1.452 -0.37 0 O-C-N 120.61 -1.306 . . . . 3.36 111.419 177.927 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -55.69 -52.03 65.27 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 118.191 0.451 . . . . 2.99 110.878 175.964 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.439 HG12 HG22 ' A' ' 3' ' ' ILE . 3.4 m -56.21 -42.94 74.98 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 C-N-CA 120.516 -0.474 . . . . 0.76 109.885 177.687 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 25.3 m-85 -60.49 -39.37 87.47 Favored 'General case' 0 C--N 1.342 0.253 0 CA-C-N 119.055 0.843 . . . . 6.6 112.35 176.547 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 43.5 mtp180 -58.49 -43.02 88.85 Favored 'General case' 0 C--N 1.339 0.111 0 CA-C-N 119.287 0.949 . . . . 3.67 110.918 171.843 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 27.3 t80 -58.98 -44.62 91.59 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 118.197 0.453 . . . . 4.01 110.249 177.619 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.632 ' CG2' HD11 ' A' ' 59' ' ' LEU . 1.6 mp -58.68 -49.34 82.98 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 CA-C-O 118.088 -0.958 . . . . 1.61 112.061 174.461 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 45.1 t0 -69.91 70.02 0.33 Allowed 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.275 1.03 . . . . 1.79 109.567 -175.259 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 20.3 t30 -61.81 -38.43 88.1 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 126.849 2.06 . . . . 1.8 111.958 -165.94 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -69.74 -25.48 63.85 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 125.471 1.509 . . . . 2.32 111.559 171.76 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 4.9 mt-30 65.2 36.08 7.37 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 125.693 1.597 . . . . 2.79 113.036 -179.703 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 70.9 p -57.8 -31.88 67.0 Favored 'General case' 0 CA--C 1.534 0.341 0 O-C-N 121.373 -0.829 . . . . 1.33 112.3 169.421 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 88.51 37.43 7.53 Favored Glycine 0 CA--C 1.526 0.772 0 N-CA-C 109.011 -1.636 . . . . 1.41 109.011 -164.947 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 11.8 m-85 -164.74 135.83 4.18 Favored 'General case' 0 CA--C 1.516 -0.356 0 C-N-CA 125.273 1.429 . . . . 2.64 108.796 -177.269 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.632 HD11 ' CG2' ' A' ' 51' ' ' ILE . 1.0 OUTLIER -86.19 78.01 9.45 Favored 'General case' 0 N--CA 1.443 -0.786 0 N-CA-C 107.511 -1.292 . . . . 2.18 107.511 167.358 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -69.55 157.66 36.74 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 114.336 -1.302 . . . . 1.65 110.199 177.093 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -53.14 -51.51 61.71 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.422 1.089 . . . . 4.56 112.969 -168.281 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.9 tm-20 -59.92 -47.89 83.92 Favored 'General case' 0 CA--C 1.531 0.228 0 N-CA-C 109.719 -0.474 . . . . 4.04 109.719 -173.931 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -56.69 -36.26 69.41 Favored 'General case' 0 C--N 1.332 -0.18 0 C-N-CA 123.399 0.679 . . . . 2.04 111.219 177.611 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 7.0 tp -55.74 -34.68 65.4 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 122.496 0.318 . . . . 2.34 110.546 176.719 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 31.1 ttpt -62.73 -10.82 14.07 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.881 1.272 . . . . 2.15 112.761 174.252 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -124.85 18.99 8.56 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 126.089 1.756 . . . . 5.02 110.561 175.21 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 83.3 t80 -52.2 -70.99 0.07 Allowed 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.391 1.077 . . . . 2.15 111.689 -172.797 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.56 -19.24 62.18 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.495 0.718 . . . . 3.35 109.53 -176.597 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -71.31 1.52 6.06 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 126.608 1.963 . . . . 2.13 113.09 178.459 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.75 -32.06 59.83 Favored 'General case' 0 CA--C 1.529 0.156 0 O-C-N 121.308 -0.87 . . . . 3.11 110.496 159.817 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.44 ' CZ ' HD11 ' A' ' 51' ' ' ILE . 4.4 m-30 -93.43 -58.74 2.2 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 124.289 1.036 . . . . 3.31 108.845 -174.228 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -96.01 -170.95 2.21 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 124.804 1.242 . . . . 2.92 107.898 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 23.8 m -136.35 48.68 2.13 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 123.603 0.761 . . . . 2.38 110.271 175.516 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 141.61 60.88 0.03 OUTLIER Glycine 0 C--N 1.336 0.554 0 N-CA-C 109.92 -1.272 . . . . 1.41 109.92 -178.594 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -89.17 -98.82 0.09 Allowed 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.038 0.535 . . . . 2.01 109.994 179.674 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -144.07 24.53 1.63 Allowed 'General case' 0 CA--C 1.528 0.12 0 CA-C-O 121.682 0.753 . . . . 3.28 111.51 -179.396 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 5.2 mp0 -72.29 -36.07 68.85 Favored 'General case' 0 N--CA 1.445 -0.717 0 C-N-CA 125.229 1.412 . . . . 4.69 108.7 -172.052 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.497 ' H ' HD22 ' A' ' 78' ' ' LEU . 0.2 OUTLIER -51.77 -56.48 13.6 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 126.305 1.842 . . . . 0.97 111.434 178.74 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 58.9 m -59.89 114.44 2.81 Favored 'General case' 0 C--N 1.341 0.231 0 N-CA-C 110.021 -0.363 . . . . 0.89 110.021 -173.755 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -64.97 -44.68 88.53 Favored 'General case' 0 N--CA 1.447 -0.609 0 N-CA-C 109.825 -0.435 . . . . 3.39 109.825 -176.149 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.5 m -50.9 -59.69 3.86 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 123.815 0.846 . . . . 1.54 110.374 177.058 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.93 -49.38 71.47 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 123.8 0.84 . . . . 2.6 110.737 178.98 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -58.83 -39.19 80.51 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 120.125 -0.63 . . . . 0.9 109.594 179.757 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 90.3 mttt -69.42 -27.61 65.42 Favored 'General case' 0 C--O 1.219 -0.51 0 C-N-CA 124.054 0.942 . . . . 4.74 111.388 177.81 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 14.6 m -58.36 -46.15 86.85 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 120.183 1.356 . . . . 1.31 109.907 169.806 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.3 mp -61.01 -59.79 4.82 Favored 'General case' 0 C--O 1.233 0.226 0 N-CA-C 109.829 -0.434 . . . . 3.04 109.829 170.077 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 29.8 ttp -46.09 -53.8 9.67 Favored 'General case' 0 C--O 1.221 -0.431 0 C-N-CA 123.06 0.544 . . . . 2.73 111.592 -175.209 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -47.41 -64.11 0.87 Allowed 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 127.456 2.302 . . . . 1.0 110.741 -174.986 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -65.07 -53.11 50.71 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 116.348 -0.387 . . . . 0.68 110.037 179.879 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -50.41 -39.29 46.78 Favored 'General case' 0 C--O 1.226 -0.143 0 N-CA-C 111.769 0.285 . . . . 0.51 111.769 -176.131 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -72.28 -58.33 3.49 Favored 'General case' 0 N--CA 1.445 -0.719 0 C-N-CA 124.124 0.97 . . . . 2.42 110.333 178.843 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 46.31 25.61 0.38 Allowed 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.344 1.458 . . . . 3.04 114.837 -175.039 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 69.2 m-20 -112.23 -45.16 3.31 Favored 'General case' 0 N--CA 1.463 0.192 0 C-N-CA 123.752 0.821 . . . . 1.85 109.452 177.178 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 97.68 39.81 3.79 Favored Glycine 0 CA--C 1.53 0.971 0 C-N-CA 125.681 1.61 . . . . 1.24 109.48 -161.792 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -127.39 -47.29 1.45 Allowed 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 118.386 1.093 . . . . 1.77 111.856 174.505 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 109.27 -27.89 11.87 Favored Glycine 0 CA--C 1.527 0.841 0 C-N-CA 124.175 0.893 . . . . 0.73 112.347 172.089 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 23.7 mttt -78.9 131.43 36.4 Favored 'General case' 0 C--O 1.241 0.642 0 N-CA-C 107.986 -1.116 . . . . 4.12 107.986 174.08 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 10.6 mt -123.8 106.14 16.62 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.457 0 C-N-CA 124.659 1.183 . . . . 1.12 108.426 -166.416 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -62.68 161.0 32.45 Favored Glycine 0 CA--C 1.53 0.981 0 N-CA-C 110.159 -1.176 . . . . 0.7 110.159 168.082 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -58.88 -37.08 75.75 Favored 'General case' 0 N--CA 1.453 -0.284 0 O-C-N 121.604 -0.939 . . . . 0.96 109.81 177.068 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 61.5 mt-10 -66.13 -47.89 72.6 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 122.947 0.499 . . . . 3.79 111.431 -179.594 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -47.88 -53.51 15.52 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 121.853 0.835 . . . . 1.95 109.632 170.495 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -66.92 -44.38 80.89 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 116.113 -0.494 . . . . 3.19 111.201 -173.285 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 10.1 tt0 -51.96 -54.38 30.28 Favored 'General case' 0 C--O 1.221 -0.439 0 C-N-CA 125.157 1.383 . . . . 2.72 109.515 172.356 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -48.36 -52.42 21.8 Favored 'General case' 0 C--O 1.231 0.097 0 CA-C-N 119.071 0.85 . . . . 4.0 110.212 177.231 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -61.88 -46.26 90.18 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 119.921 -0.712 . . . . 3.11 110.879 -176.937 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 44.0 t -59.97 -38.03 74.83 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.23 0 CA-C-O 119.196 -0.431 . . . . 1.46 111.828 175.181 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 2.0 t60 -64.66 -19.79 65.92 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 125.512 1.525 . . . . 2.46 109.997 -171.397 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 34.8 t . . . . . 0 C--O 1.254 1.296 0 CA-C-O 115.077 -2.392 . . . . 2.71 113.148 175.742 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.65 HG22 HG12 ' A' ' 47' ' ' VAL . 1.3 pp . . . . . 0 CA--C 1.534 0.336 0 CA-C-O 121.874 0.845 . . . . 1.4 110.784 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.54 ' HA ' ' HB2' ' A' ' 9' ' ' ALA . 0.6 OUTLIER -68.21 -10.76 56.77 Favored 'General case' 0 N--CA 1.439 -0.989 0 C-N-CA 126.082 1.753 . . . . 1.88 112.014 179.013 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.0 t0 -135.83 32.5 2.97 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.096 1.359 . . . . 2.56 109.948 -174.238 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 11.2 m -125.34 -56.33 2.04 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 N-CA-C 112.576 0.584 . . . . 2.59 112.576 172.643 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 22.3 tp -171.55 -59.2 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.135 0 N-CA-C 106.131 -1.803 . . . . 1.43 106.131 -172.641 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 28.5 m -42.06 -35.78 0.98 Allowed 'General case' 0 C--O 1.217 -0.656 0 C-N-CA 125.501 1.52 . . . . 1.22 113.698 -175.909 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.54 ' HB2' ' HA ' ' A' ' 4' ' ' THR . . . -40.68 -45.63 2.42 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 114.094 1.146 . . . . 0.84 114.094 172.245 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -70.9 -43.63 67.94 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 122.261 1.029 . . . . 1.78 109.597 179.352 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -62.83 -46.55 87.38 Favored 'General case' 0 N--CA 1.449 -0.518 0 C-N-CA 123.963 0.905 . . . . 2.55 109.966 -175.654 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 35.9 pt -58.94 -41.67 83.76 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.767 0 C-N-CA 123.752 0.821 . . . . 0.97 110.354 178.362 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.8 -46.76 84.19 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 110.267 -0.272 . . . . 1.09 110.267 176.975 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.49 -52.28 66.27 Favored 'General case' 0 CA--C 1.529 0.15 0 O-C-N 121.781 -0.574 . . . . 0.91 110.715 173.458 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.418 ' HB1' ' CE2' ' A' ' 30' ' ' PHE . . . -53.11 -43.82 67.15 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 124.769 1.227 . . . . 1.03 111.537 -176.259 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -55.36 -43.24 74.91 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 124.225 1.01 . . . . 3.7 109.017 176.455 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 68.5 mt-30 -77.23 -39.17 49.45 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-O 119.164 -0.446 . . . . 4.14 111.663 -176.513 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.34 -44.58 82.9 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 108.99 -0.744 . . . . 3.38 108.99 179.25 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 76.4 m -85.49 41.58 0.9 Allowed 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.219 1.008 . . . . 2.26 111.195 175.873 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 15.1 mtt180 -77.69 -55.58 5.23 Favored 'General case' 0 CA--C 1.518 -0.285 0 O-C-N 121.142 -0.974 . . . . 4.99 108.605 178.813 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -69.46 140.52 90.0 Favored Pre-proline 0 N--CA 1.448 -0.55 0 CA-C-N 115.83 -0.623 . . . . 2.72 109.509 -175.036 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -63.63 142.65 84.66 Favored 'Trans proline' 0 N--CA 1.449 -1.108 0 C-N-CA 122.208 1.939 . . . . 1.24 111.207 -175.94 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 17.8 t70 57.62 36.92 27.24 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 127.009 2.124 . . . . 3.62 112.179 178.76 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 24.4 m -102.31 -29.57 11.59 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.872 1.269 . . . . 0.82 111.281 177.085 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -53.87 125.44 18.64 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 125.688 1.595 . . . . 2.39 109.155 -177.488 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -119.64 152.06 52.79 Favored Pre-proline 0 C--O 1.232 0.134 0 C-N-CA 124.686 1.194 . . . . 2.18 108.294 172.537 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -64.94 -66.47 0.04 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.217 0 C-N-CA 122.707 2.271 . . . . 0.56 110.52 178.428 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 35.0 mt-30 -60.61 -36.53 78.82 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 122.978 0.511 . . . . 2.17 111.297 -175.103 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -58.5 -64.85 0.78 Allowed 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 109.316 -0.624 . . . . 5.16 109.316 173.108 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.418 ' CE2' ' HB1' ' A' ' 15' ' ' ALA . 55.9 t80 -56.6 -45.55 81.37 Favored 'General case' 0 C--O 1.221 -0.42 0 CA-C-O 121.427 0.632 . . . . 2.19 110.593 -174.717 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.404 ' CE1' ' HA ' ' A' ' 107' ' ' VAL . 4.4 t80 -41.29 -57.24 2.19 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 126.784 2.034 . . . . 4.71 111.047 176.422 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 12.0 mt-30 -70.96 -45.36 64.26 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 109.933 -0.395 . . . . 2.96 109.933 178.698 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -55.99 -29.06 59.74 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 123.11 0.564 . . . . 0.72 112.439 -179.001 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 14.7 t -88.5 -8.74 54.34 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 126.489 1.916 . . . . 1.44 110.429 -175.505 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 81.05 -1.99 82.7 Favored Glycine 0 C--N 1.34 0.795 0 O-C-N 121.322 -0.861 . . . . 0.67 111.04 174.047 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.413 ' HB3' HG13 ' A' ' 107' ' ' VAL . 85.0 mt -63.36 -28.85 70.27 Favored 'General case' 0 N--CA 1.441 -0.896 0 C-N-CA 124.737 1.215 . . . . 1.33 110.217 -176.246 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 60.4 p -63.02 -35.52 80.5 Favored 'General case' 0 C--N 1.338 0.102 0 C-N-CA 123.711 0.805 . . . . 2.36 111.62 171.894 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 7.5 tttt -82.79 -32.08 27.88 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 108.945 -0.761 . . . . 5.1 108.945 -176.158 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 21.5 mtt -57.62 124.66 19.84 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-O 121.088 0.471 . . . . 2.86 110.342 174.273 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 6.9 m -61.2 157.09 16.89 Favored 'General case' 0 N--CA 1.452 -0.368 0 O-C-N 121.525 -0.734 . . . . 1.91 110.15 172.171 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -43.33 -40.26 3.51 Favored 'General case' 0 C--O 1.225 -0.22 0 C-N-CA 124.031 0.932 . . . . 0.67 111.414 175.399 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 49.9 m-20 -47.02 -60.07 2.7 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 124.351 1.061 . . . . 1.87 110.381 174.559 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 30.6 mm100 -69.32 -43.56 73.47 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 115.778 -0.646 . . . . 3.25 109.547 -175.696 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 95.2 t -56.91 -45.89 83.6 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 CA-C-N 119.166 0.894 . . . . 0.56 110.087 -179.937 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 14.2 tttt -63.03 -43.15 99.49 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 109.598 -0.519 . . . . 3.54 109.598 176.206 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 27.0 t0 -61.75 -54.99 34.94 Favored 'General case' 0 CA--C 1.535 0.38 0 O-C-N 121.947 -0.471 . . . . 2.45 110.964 -179.098 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.65 HG12 HG22 ' A' ' 3' ' ' ILE . 15.0 m -55.19 -43.65 71.43 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.202 0 C-N-CA 123.045 0.538 . . . . 0.69 110.364 176.694 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -44.8 -48.25 10.95 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 118.679 0.672 . . . . 5.25 111.221 171.733 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 83.6 mtm180 -60.27 -30.91 69.75 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 118.807 0.731 . . . . 6.5 112.479 177.857 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 14.0 m-85 -70.46 -34.59 72.59 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 118.963 0.801 . . . . 3.82 111.105 172.638 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.764 HG22 ' H ' ' A' ' 52' ' ' ASP . 18.0 mm -77.83 -171.82 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.84 0 CA-C-N 118.994 0.816 . . . . 2.39 109.692 177.95 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.764 ' H ' HG22 ' A' ' 51' ' ' ILE . 41.8 t0 75.55 -55.8 0.62 Allowed 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 127.331 2.253 . . . . 4.11 110.216 -178.472 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 11.3 t30 96.52 -54.41 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.187 0 C-N-CA 127.935 2.494 . . . . 2.13 108.437 -179.787 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -56.06 -35.23 66.72 Favored 'General case' 0 CA--C 1.529 0.14 0 C-N-CA 124.371 1.069 . . . . 2.37 111.642 170.937 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 75.8 mt-30 55.8 49.96 15.09 Favored 'General case' 0 CA--C 1.539 0.523 0 N-CA-C 109.19 -0.67 . . . . 4.55 109.19 -159.768 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 51.0 p -90.47 -44.25 9.73 Favored 'General case' 0 C--N 1.339 0.13 0 C-N-CA 123.422 0.689 . . . . 2.12 110.045 174.508 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 117.44 -37.88 3.16 Favored Glycine 0 C--N 1.336 0.573 0 N-CA-C 111.241 -0.743 . . . . 2.27 111.241 -177.411 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 11.2 m-85 -70.73 110.12 5.35 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 106.453 -1.684 . . . . 2.48 106.453 167.744 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -84.71 81.49 8.85 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 106.117 -1.808 . . . . 1.88 106.117 166.034 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -69.65 150.62 46.83 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 114.122 -1.399 . . . . 1.46 109.161 -179.628 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -47.76 -46.5 30.24 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.768 1.227 . . . . 3.9 112.112 -171.642 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -57.39 -39.99 77.28 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 123.143 0.577 . . . . 3.68 111.089 -178.896 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -71.54 -28.34 63.81 Favored 'General case' 0 CA--C 1.517 -0.289 0 O-C-N 120.959 -1.088 . . . . 2.34 110.399 -178.889 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.27 -30.36 59.96 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 119.285 -0.388 . . . . 2.33 110.375 170.137 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 31.5 ttpt -60.71 -9.92 4.63 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.093 0.957 . . . . 1.96 113.222 172.997 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 30.4 m-85 -132.39 23.12 4.41 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.299 1.039 . . . . 4.97 111.244 172.217 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 44.2 t80 -55.02 -65.54 0.56 Allowed 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 118.827 0.739 . . . . 2.48 110.742 -178.624 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 14.3 tp -84.35 -13.65 51.73 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.399 0.68 . . . . 2.41 111.598 -176.065 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 83.5 mm-40 -52.56 -57.02 11.31 Favored 'General case' 0 C--N 1.344 0.343 0 N-CA-C 109.006 -0.739 . . . . 2.13 109.006 173.719 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.78 42.31 0.37 Allowed 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 112.296 0.48 . . . . 2.35 112.296 -179.658 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.598 ' CE1' HD11 ' A' ' 51' ' ' ILE . 0.1 OUTLIER -147.04 -56.87 0.26 Allowed 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 127.384 2.273 . . . . 3.33 106.404 -179.258 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -104.8 -46.34 4.34 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.516 1.126 . . . . 3.89 111.657 -178.295 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 19.9 m 81.4 109.13 0.07 Allowed 'General case' 0 C--N 1.34 0.182 0 C-N-CA 126.687 1.995 . . . . 3.24 110.358 -170.684 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 86.64 40.73 7.11 Favored Glycine 0 CA--C 1.525 0.711 0 N-CA-C 110.594 -1.002 . . . . 1.21 110.594 -179.597 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -85.88 -154.77 0.22 Allowed 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.041 0.937 . . . . 1.34 110.886 177.739 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 1.6 tpt85 -102.28 -9.26 20.55 Favored 'General case' 0 N--CA 1.463 0.182 0 C-N-CA 123.524 0.729 . . . . 4.08 112.684 -161.744 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -43.89 -39.75 4.12 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 129.253 3.021 . . . . 3.38 113.038 -167.004 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.571 ' H ' HD22 ' A' ' 78' ' ' LEU . 0.6 OUTLIER -50.55 -41.48 54.07 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 124.669 1.188 . . . . 1.08 111.991 176.128 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 63.7 m -65.33 109.47 2.28 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 108.63 -0.878 . . . . 0.85 108.63 171.722 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 16.5 pt-20 -54.95 -46.62 75.03 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-N 115.457 -0.792 . . . . 3.17 110.525 176.199 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.1 m -50.13 -58.08 6.31 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 119.457 1.026 . . . . 1.28 112.393 176.912 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -64.82 -40.52 95.34 Favored 'General case' 0 N--CA 1.453 -0.325 0 N-CA-C 109.836 -0.431 . . . . 2.7 109.836 -173.402 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -61.85 -44.92 95.86 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 122.515 1.15 . . . . 0.94 109.563 174.224 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -62.65 -31.62 72.52 Favored 'General case' 0 N--CA 1.444 -0.743 0 C-N-CA 124.898 1.279 . . . . 7.1 109.91 -176.406 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 50.6 m -53.82 -43.21 69.21 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 119.529 1.059 . . . . 1.31 111.284 171.087 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 8.0 mt -64.92 -56.61 12.27 Favored 'General case' 0 C--O 1.233 0.228 0 N-CA-C 109.184 -0.673 . . . . 2.17 109.184 170.958 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 7.7 ttm -43.59 -47.55 7.48 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 124.077 0.861 . . . . 3.07 112.056 -177.592 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -54.5 -46.86 73.55 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 127.661 2.384 . . . . 0.89 112.392 -173.47 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -87.08 -41.53 13.75 Favored 'General case' 0 CA--C 1.522 -0.111 0 CA-C-N 117.821 0.282 . . . . 0.75 110.783 179.18 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -54.83 -46.85 74.66 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 116.554 -0.294 . . . . 0.35 110.212 -179.252 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -73.7 77.97 1.54 Allowed 'General case' 0 N--CA 1.447 -0.589 0 CA-C-O 121.625 0.726 . . . . 0.98 109.7 178.669 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 51.4 p30 -77.07 41.58 0.29 Allowed 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.61 -0.681 . . . . 2.65 111.793 177.794 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 26.4 m-20 -128.14 -59.72 1.17 Allowed 'General case' 0 C--N 1.34 0.158 0 C-N-CA 126.614 1.966 . . . . 1.23 108.527 179.3 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 103.78 45.41 1.52 Allowed Glycine 0 CA--C 1.531 1.083 0 C-N-CA 125.19 1.376 . . . . 0.77 110.096 -164.129 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -125.1 -63.89 1.13 Allowed 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.58 1.552 . . . . 1.88 110.194 173.754 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 128.08 -30.8 3.82 Favored Glycine 0 CA--C 1.531 1.079 0 C-N-CA 124.885 1.231 . . . . 0.79 111.794 -179.915 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 37.9 mttp -73.17 108.4 6.03 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 108.153 -1.055 . . . . 4.46 108.153 169.439 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 18.1 mt -97.6 115.25 36.98 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.353 0 C-N-CA 123.952 0.901 . . . . 0.76 108.855 -174.393 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -69.93 164.9 51.34 Favored Glycine 0 CA--C 1.537 1.446 0 CA-C-N 118.73 0.696 . . . . 0.84 112.527 172.534 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -59.08 -39.56 82.5 Favored 'General case' 0 N--CA 1.456 -0.163 0 O-C-N 121.518 -0.989 . . . . 1.23 108.525 171.613 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -51.22 -57.94 7.48 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 124.344 1.057 . . . . 4.07 111.288 170.216 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -51.13 -48.1 61.86 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.133 0.973 . . . . 1.99 110.406 176.637 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -56.54 -60.3 3.74 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 112.349 0.5 . . . . 3.54 112.349 176.267 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -59.82 -35.69 75.23 Favored 'General case' 0 C--O 1.22 -0.467 0 CA-C-O 118.587 -0.721 . . . . 3.1 110.19 -178.286 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 17.8 mm-40 -57.5 -59.86 4.52 Favored 'General case' 0 N--CA 1.456 -0.128 0 CA-C-N 119.686 1.13 . . . . 3.21 109.654 174.068 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -56.14 -50.7 70.38 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-O 121.719 0.771 . . . . 3.86 109.119 -177.349 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 107' ' ' VAL . . . . . 0.413 HG13 ' HB3' ' A' ' 36' ' ' LEU . 96.6 t -72.49 -30.6 34.96 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.761 0 CA-C-N 115.604 -0.726 . . . . 1.49 112.58 -172.528 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 15.2 t60 -95.16 15.36 19.31 Favored 'General case' 0 CA--C 1.532 0.286 0 O-C-N 120.117 -1.614 . . . . 3.44 110.952 178.367 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 5.8 t . . . . . 0 C--O 1.253 1.239 0 CA-C-O 116.868 -1.539 . . . . 3.45 109.142 179.661 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.583 HG22 HG12 ' A' ' 47' ' ' VAL 0.311 0.6 OUTLIER . . . . . 0 CA--C 1.548 0.882 0 N-CA-C 112.858 0.688 . . . . 1.58 112.858 . . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 5.7 t -38.77 -29.94 0.04 OUTLIER 'General case' 0 N--CA 1.442 -0.83 1 C-N-CA 133.036 4.535 . . . . 1.93 115.5 176.59 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 39.5 t0 -145.22 57.25 1.25 Allowed 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 121.822 0.82 . . . . 3.59 109.08 170.176 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 97.0 t -116.83 -59.47 3.1 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.17 0 CA-C-N 115.226 -0.897 . . . . 1.75 109.366 173.813 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 13.6 tp -169.67 -60.55 0.02 OUTLIER 'General case' 0 CA--C 1.519 -0.213 0 N-CA-C 106.075 -1.824 . . . . 1.47 106.075 -178.354 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -53.18 -20.42 3.94 Favored 'General case' 0 N--CA 1.446 -0.666 0 C-N-CA 125.507 1.523 . . . . 1.02 113.152 -172.012 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -50.13 -40.97 47.92 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 113.516 0.932 . . . . 0.94 113.516 169.847 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -70.87 -42.45 70.05 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 122.4 1.095 . . . . 1.85 109.264 176.013 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -65.29 -44.12 88.97 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 115.489 -0.778 . . . . 2.48 109.659 -172.538 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 36.3 pt -58.67 -39.15 75.37 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.671 0 O-C-N 120.855 -1.153 . . . . 0.77 111.066 175.778 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.63 -43.2 93.92 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 109.689 -0.486 . . . . 0.64 109.689 176.394 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.43 -56.66 19.24 Favored 'General case' 0 CA--C 1.535 0.397 0 O-C-N 122.115 -0.366 . . . . 0.51 110.419 172.699 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -50.34 -46.79 55.93 Favored 'General case' 0 C--O 1.231 0.116 0 C-N-CA 125.224 1.41 . . . . 0.51 111.448 -176.927 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.1 mt -50.01 -44.88 51.46 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.056 -0.975 . . . . 3.22 109.712 178.386 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.38 -46.5 17.48 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 109.763 -0.458 . . . . 4.51 109.763 -175.945 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.74 -28.26 66.65 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 121.207 -0.197 . . . . 2.74 111.416 -169.867 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 62.5 m -112.78 49.59 0.93 Allowed 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.887 1.275 . . . . 1.36 109.054 171.199 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -73.49 -33.65 64.91 Favored 'General case' 0 C--O 1.236 0.351 0 O-C-N 121.25 -0.906 . . . . 5.54 109.716 177.521 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -83.97 141.27 40.57 Favored Pre-proline 0 N--CA 1.449 -0.499 0 C-N-CA 125.456 1.502 . . . . 1.96 109.46 -171.205 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -59.96 148.94 86.85 Favored 'Trans proline' 0 N--CA 1.451 -0.98 0 C-N-CA 122.342 2.028 . . . . 1.21 110.441 -170.879 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 50.81 42.24 27.49 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 126.243 1.817 . . . . 2.65 111.333 173.525 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 10.4 m -109.65 -24.49 10.9 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 125.089 1.356 . . . . 1.04 112.869 179.451 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -53.38 112.51 0.91 Allowed 'General case' 0 N--CA 1.445 -0.718 0 C-N-CA 123.417 0.687 . . . . 3.15 112.141 -177.04 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -102.78 156.16 35.64 Favored Pre-proline 0 CA--C 1.539 0.531 0 C-N-CA 124.531 1.132 . . . . 2.63 109.836 173.663 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_endo -68.4 -78.42 0.01 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.883 0 C-N-CA 123.563 2.842 . . . . 1.09 112.187 -176.481 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 46.3 mt-30 -50.1 -43.91 51.78 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.991 0.916 . . . . 2.88 110.892 -178.562 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -44.59 -63.55 0.88 Allowed 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 124.266 1.026 . . . . 3.31 110.163 169.863 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 5.3 t80 -60.76 -42.47 97.52 Favored 'General case' 0 C--O 1.224 -0.266 0 CA-C-N 118.21 0.459 . . . . 2.11 110.915 -179.071 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 8.3 m-30 -56.08 -37.77 69.79 Favored 'General case' 0 CA--C 1.532 0.272 0 O-C-N 121.21 -0.931 . . . . 4.6 110.93 -179.242 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 12.6 tt0 -76.31 -53.27 8.44 Favored 'General case' 0 N--CA 1.456 -0.134 0 O-C-N 121.921 -0.487 . . . . 3.0 110.101 174.119 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -66.3 -17.39 64.73 Favored 'General case' 0 N--CA 1.447 -0.608 0 C-N-CA 123.557 0.743 . . . . 0.9 112.618 -171.931 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 2.6 t -96.41 -3.82 42.87 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 125.747 1.619 . . . . 1.46 111.154 176.236 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 80.43 -21.78 5.02 Favored Glycine 0 CA--C 1.532 1.144 0 O-C-N 120.662 -1.274 . . . . 0.73 112.308 178.673 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -40.75 -48.02 2.94 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 126.968 2.107 . . . . 2.76 114.018 178.32 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 43.6 p -68.47 -26.15 65.34 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 118.873 0.761 . . . . 2.02 112.016 -179.731 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 22.2 tttt -78.89 -38.0 38.66 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 107.903 -1.147 . . . . 4.23 107.903 178.345 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 9.8 mmt -62.64 139.47 58.64 Favored 'General case' 0 N--CA 1.44 -0.95 0 CA-C-O 121.575 0.703 . . . . 3.74 109.541 176.006 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 44.5 p -74.97 162.07 28.92 Favored 'General case' 0 N--CA 1.449 -0.48 0 O-C-N 121.759 -0.588 . . . . 2.02 109.889 -179.164 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -45.7 -35.99 4.61 Favored 'General case' 0 C--O 1.225 -0.223 0 C-N-CA 124.235 1.014 . . . . 0.61 112.239 176.738 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -49.9 -60.34 3.01 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 123.331 0.652 . . . . 2.77 110.681 172.334 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 5.8 mm100 -69.38 -42.38 75.23 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-O 119.134 -0.46 . . . . 2.53 109.948 -176.776 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 60.7 t -59.55 -38.41 75.22 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-N 119.148 0.885 . . . . 0.61 110.051 179.363 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 54.8 tttp -63.62 -48.92 75.35 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 118.719 0.69 . . . . 2.77 110.245 174.079 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -55.65 -57.55 11.51 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 120.626 0.251 . . . . 3.12 110.709 -179.827 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.583 HG12 HG22 ' A' ' 3' ' ' ILE . 5.5 m -57.91 -46.94 87.45 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.214 0 N-CA-C 109.579 -0.526 . . . . 0.53 109.579 177.776 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 13.8 t80 -46.15 -48.46 17.39 Favored 'General case' 0 C--O 1.224 -0.285 0 CA-C-O 118.454 -0.784 . . . . 4.05 110.663 177.243 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 76.2 mtp180 -54.74 -40.59 69.46 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-N 119.302 0.956 . . . . 3.91 111.493 177.169 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -63.78 -41.26 97.98 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 110.242 -0.281 . . . . 3.84 110.242 176.487 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.424 HG22 HD11 ' A' ' 59' ' ' LEU . 3.3 mp -65.42 -42.09 92.63 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.687 0 O-C-N 121.623 -0.673 . . . . 1.66 110.716 176.396 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 54.3 t0 -75.76 63.09 1.59 Allowed 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 124.933 1.293 . . . . 1.95 110.073 179.311 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -47.11 144.11 2.79 Favored 'General case' 0 C--O 1.232 0.175 0 N-CA-C 107.715 -1.217 . . . . 3.64 107.715 168.008 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 75.91 -33.82 0.23 Allowed 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 125.048 1.339 . . . . 3.4 112.209 -173.86 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 56.75 41.08 28.71 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 124.7 1.2 . . . . 4.59 111.532 -175.275 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 11.8 p -48.22 -32.15 6.75 Favored 'General case' 0 C--N 1.341 0.238 0 C-N-CA 126.36 1.864 . . . . 2.13 112.196 176.02 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 113.34 -17.79 21.22 Favored Glycine 0 CA--C 1.525 0.673 0 N-CA-C 109.365 -1.494 . . . . 1.87 109.365 -164.229 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 84.7 m-85 -135.39 159.44 41.57 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-O 123.041 1.4 . . . . 2.14 112.005 179.727 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.424 HD11 HG22 ' A' ' 51' ' ' ILE . 3.5 mm? -98.21 73.8 2.2 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 105.426 -2.064 . . . . 1.89 105.426 164.731 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -55.17 146.22 19.27 Favored 'General case' 0 CA--C 1.545 0.765 0 CA-C-N 113.807 -1.542 . . . . 1.61 108.815 172.376 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -50.15 -54.45 20.67 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 113.952 1.093 . . . . 3.34 113.952 -160.937 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 64.5 mt-10 -55.34 -31.69 61.92 Favored 'General case' 0 CA--C 1.535 0.368 0 O-C-N 121.589 -0.695 . . . . 3.59 111.982 177.965 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -71.14 -43.09 68.24 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 123.149 0.58 . . . . 2.32 109.614 176.767 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -51.6 -36.01 43.87 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.471 1.108 . . . . 2.61 110.398 173.225 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 10.8 ttmt -46.82 -60.84 2.16 Favored 'General case' 0 N--CA 1.464 0.272 0 O-C-N 121.879 -0.513 . . . . 2.67 110.309 169.752 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -73.38 60.48 0.62 Allowed 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.91 0.884 . . . . 4.62 109.981 177.62 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -89.03 -69.38 0.71 Allowed 'General case' 0 C--N 1.331 -0.223 0 O-C-N 120.533 -1.354 . . . . 2.93 108.193 175.592 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 5.8 mp -68.18 -26.24 65.64 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 122.718 0.407 . . . . 3.36 111.368 -173.424 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -72.95 0.61 10.74 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 123.999 0.92 . . . . 3.55 113.132 -176.25 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 7.1 mptt -70.83 -32.2 69.18 Favored 'General case' 0 N--CA 1.455 -0.215 0 O-C-N 121.405 -0.809 . . . . 4.21 109.823 161.949 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -92.4 -58.17 2.46 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 123.335 0.654 . . . . 3.27 109.322 -172.087 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -98.31 175.97 5.87 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 123.597 0.759 . . . . 3.04 109.095 -178.055 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 15.9 p -109.51 -9.68 14.9 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 124.01 0.924 . . . . 2.51 112.29 171.952 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -137.95 41.27 1.39 Allowed Glycine 0 CA--C 1.527 0.802 0 N-CA-C 111.079 -0.809 . . . . 1.19 111.079 179.852 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -83.67 -177.5 6.72 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-O 121.948 0.88 . . . . 1.59 111.422 176.544 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 2.2 tpt180 -89.04 24.2 2.18 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.121 1.369 . . . . 3.08 113.409 -162.596 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -53.52 -55.58 24.28 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-O 122.54 1.162 . . . . 6.74 111.344 -176.006 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.408 ' H ' HD22 ' A' ' 78' ' ' LEU . 0.4 OUTLIER -49.85 -35.53 23.56 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 126.87 2.068 . . . . 1.46 112.678 -177.857 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 19.3 m -70.68 102.4 2.28 Favored 'General case' 0 CA--C 1.514 -0.41 0 C-N-CA 118.558 -1.257 . . . . 0.88 109.172 176.913 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -62.24 -40.15 95.21 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 113.153 -1.839 . . . . 3.44 109.371 -177.559 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 18.4 m -49.73 -51.82 36.06 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 120.391 1.45 . . . . 1.27 112.585 171.671 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -69.93 -46.78 64.62 Favored 'General case' 0 C--O 1.234 0.261 0 N-CA-C 108.903 -0.777 . . . . 2.65 108.903 -172.216 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -54.1 -48.88 70.24 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-O 122.059 0.933 . . . . 0.78 109.362 174.852 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 8.0 tmtt? -74.3 -29.61 61.71 Favored 'General case' 0 N--CA 1.442 -0.829 0 C-N-CA 124.869 1.268 . . . . 5.49 110.245 -170.707 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 23.2 t -57.57 -51.12 70.78 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 119.232 0.924 . . . . 1.68 108.642 170.317 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -60.39 -51.66 68.53 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-O 119.296 -0.383 . . . . 3.76 110.125 176.25 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 37.1 ttp -50.19 -44.33 52.94 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 117.798 0.272 . . . . 2.43 111.675 175.712 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -55.3 -45.49 76.25 Favored 'General case' 0 C--O 1.226 -0.172 0 C-N-CA 125.117 1.367 . . . . 0.53 111.226 -171.577 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -88.46 -43.99 11.05 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 116.345 -0.389 . . . . 0.54 110.702 -178.331 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -54.95 -41.94 71.71 Favored 'General case' 0 C--N 1.339 0.142 0 CA-C-N 117.809 0.277 . . . . 0.47 110.694 178.722 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -74.39 104.34 5.09 Favored 'General case' 0 N--CA 1.442 -0.841 0 N-CA-C 108.264 -1.013 . . . . 1.21 108.264 175.145 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 24.1 p30 -99.1 5.87 46.76 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-O 119.525 -0.274 . . . . 2.87 111.599 -177.832 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 45.7 m-20 -79.88 -52.22 8.15 Favored 'General case' 0 C--N 1.341 0.198 0 N-CA-C 108.944 -0.761 . . . . 1.4 108.944 167.472 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 91.64 44.75 4.17 Favored Glycine 0 CA--C 1.529 0.929 0 N-CA-C 109.275 -1.53 . . . . 0.83 109.275 -157.875 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -126.26 -48.66 1.57 Allowed 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 124.641 1.176 . . . . 2.46 110.533 177.47 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 126.52 -46.1 1.11 Allowed Glycine 0 C--N 1.337 0.585 0 C-N-CA 124.606 1.098 . . . . 0.75 110.372 171.111 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -60.12 114.89 3.1 Favored 'General case' 0 C--O 1.237 0.446 0 N-CA-C 108.915 -0.772 . . . . 3.62 108.915 174.099 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 7.2 mt -97.94 153.71 3.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 C-N-CA 124.781 1.233 . . . . 0.77 108.693 177.919 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -126.62 178.85 16.6 Favored Glycine 0 CA--C 1.526 0.747 0 N-CA-C 109.062 -1.615 . . . . 1.02 109.062 174.398 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -61.41 -47.25 86.63 Favored 'General case' 0 CA--C 1.516 -0.335 0 O-C-N 122.437 -0.449 . . . . 1.04 109.822 -175.974 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -55.33 -68.27 0.21 Allowed 'General case' 0 N--CA 1.447 -0.588 0 O-C-N 124.573 1.171 . . . . 3.68 109.179 176.043 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -38.28 -49.72 1.41 Allowed 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.82 0.848 . . . . 1.4 112.153 176.871 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 63.0 t80 -61.69 -56.76 16.21 Favored 'General case' 0 CA--C 1.537 0.451 0 O-C-N 122.399 -0.188 . . . . 3.59 111.111 179.652 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 33.4 tp60 -57.55 -47.55 81.74 Favored 'General case' 0 C--O 1.218 -0.6 0 CA-C-O 117.281 -1.342 . . . . 5.03 110.727 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -44.95 -56.59 4.45 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 120.793 1.633 . . . . 3.79 110.528 176.286 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -64.57 -47.55 78.28 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 120.18 -0.608 . . . . 3.68 110.465 -177.301 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 42.8 t -56.22 -35.42 42.41 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.462 0 C-N-CA 123.058 0.543 . . . . 1.36 112.379 176.96 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 52.3 t60 -73.38 -22.08 60.35 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 125.958 1.703 . . . . 2.62 110.934 -174.395 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 23.2 t . . . . . 0 C--O 1.253 1.285 0 CA-C-O 115.066 -2.397 . . . . 2.63 112.866 -176.181 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.574 HG22 HG12 ' A' ' 47' ' ' VAL . 1.2 pp . . . . . 0 CA--C 1.533 0.318 0 CA-C-O 121.306 0.574 . . . . 1.31 111.349 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -60.76 -29.4 69.39 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 123.731 0.813 . . . . 1.86 111.684 -175.189 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 48.0 t0 -122.18 55.84 1.12 Allowed 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 107.937 -1.134 . . . . 2.55 107.937 -176.531 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -135.72 -52.67 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.222 0 CA-C-N 115.739 -0.664 . . . . 1.97 111.498 176.345 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 179.85 -60.8 0.01 OUTLIER 'General case' 0 N--CA 1.456 -0.135 0 N-CA-C 106.368 -1.716 . . . . 1.03 106.368 -173.386 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 25.5 m -49.94 -17.5 0.39 Allowed 'General case' 0 C--O 1.219 -0.53 0 N-CA-C 115.659 1.726 . . . . 2.02 115.659 -169.36 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -49.33 -46.13 46.4 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 121.157 1.799 . . . . 0.72 112.151 168.381 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -66.17 -42.47 88.91 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 122.534 1.159 . . . . 2.08 109.845 179.0 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -69.1 -41.08 77.93 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 115.341 -0.845 . . . . 2.71 109.247 -172.454 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 29.0 pt -63.52 -39.76 86.51 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.748 0 O-C-N 120.477 -1.39 . . . . 0.78 110.78 173.37 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.57 -45.38 77.35 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 118.784 0.72 . . . . 0.69 110.19 174.289 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -55.91 -57.34 12.5 Favored 'General case' 0 CA--C 1.531 0.241 0 O-C-N 122.18 -0.325 . . . . 0.63 110.975 171.131 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -48.45 -48.22 37.73 Favored 'General case' 0 C--O 1.231 0.098 0 C-N-CA 124.101 0.96 . . . . 0.6 111.394 -177.421 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -52.23 -41.85 63.11 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 125.219 1.408 . . . . 2.81 109.741 -177.925 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 38.4 tt0 -87.61 -49.36 7.22 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 117.747 0.248 . . . . 3.6 110.835 -176.466 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 24.7 tp10 -47.49 -49.75 24.94 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 125.203 1.401 . . . . 3.7 110.301 178.214 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 79.3 m -111.02 55.81 0.65 Allowed 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 108.007 -1.108 . . . . 1.52 108.007 178.169 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 71.2 ttt180 -77.95 -55.0 5.66 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 119.73 1.15 . . . . 4.22 108.695 178.977 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -52.12 140.21 32.89 Favored Pre-proline 0 N--CA 1.446 -0.652 0 C-N-CA 124.795 1.238 . . . . 2.29 110.922 -178.163 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -57.8 151.53 55.68 Favored 'Trans proline' 0 N--CA 1.453 -0.873 0 C-N-CA 123.377 2.718 . . . . 1.21 110.441 -176.075 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 13.2 t70 69.52 -22.66 0.15 Allowed 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 127.472 2.309 . . . . 3.53 114.941 -179.801 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 2.0 m -73.88 24.37 0.08 Allowed 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.837 1.655 . . . . 1.09 113.439 -164.497 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -105.29 80.59 1.61 Allowed 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 119.374 0.988 . . . . 3.5 111.037 -163.385 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -71.0 145.04 91.04 Favored Pre-proline 0 C--O 1.234 0.26 0 C-N-CA 123.174 0.59 . . . . 2.99 110.451 -177.597 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -66.01 -65.69 0.04 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.347 0 C-N-CA 122.193 1.928 . . . . 0.75 111.151 179.768 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.73 -42.14 67.79 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 123.829 0.851 . . . . 3.07 110.822 -176.533 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 6.4 ttpt -58.74 -59.87 4.72 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 119.228 -0.415 . . . . 3.67 109.955 174.678 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 11.3 t80 -53.76 -49.71 67.6 Favored 'General case' 0 C--O 1.224 -0.241 0 CA-C-N 118.261 0.482 . . . . 2.02 110.289 -176.632 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -41.32 -56.25 2.5 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 126.764 2.026 . . . . 4.77 111.889 174.599 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 22.5 tt0 -68.58 -50.54 50.95 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 109.04 -0.726 . . . . 2.9 109.04 -179.655 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -64.75 -20.63 66.46 Favored 'General case' 0 N--CA 1.441 -0.898 0 C-N-CA 124.207 1.003 . . . . 0.7 112.265 -171.366 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 67.6 p -89.08 -9.19 52.07 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.482 1.513 . . . . 2.21 112.004 177.007 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 83.17 6.19 88.29 Favored Glycine 0 C--N 1.337 0.591 0 N-CA-C 111.558 -0.617 . . . . 0.69 111.558 172.803 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 83.0 mt -66.94 -28.96 68.72 Favored 'General case' 0 N--CA 1.443 -0.802 0 O-C-N 122.182 -0.599 . . . . 1.24 109.998 179.173 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 19.5 p -58.5 -38.11 76.96 Favored 'General case' 0 N--CA 1.464 0.243 0 C-N-CA 123.395 0.678 . . . . 2.65 111.912 165.85 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -83.66 -26.72 29.62 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 125.321 1.448 . . . . 5.99 108.991 -166.93 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 18.2 mtt -54.26 -65.03 0.64 Allowed 'General case' 0 N--CA 1.447 -0.624 0 N-CA-C 113.85 1.056 . . . . 3.52 113.85 -177.306 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 30.8 t 117.27 147.22 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 129.031 2.933 . . . . 1.85 108.352 -168.397 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -42.47 -37.79 1.72 Allowed 'General case' 0 C--N 1.34 0.155 0 C-N-CA 123.826 0.85 . . . . 0.58 111.644 169.825 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 73.8 m-20 -59.5 -63.12 1.42 Allowed 'General case' 0 CA--C 1.529 0.16 0 CA-C-O 121.683 0.754 . . . . 1.82 109.502 -178.796 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 20.8 mm100 -60.7 -40.3 91.72 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 115.755 -0.657 . . . . 3.02 110.479 -179.241 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 97.1 t -62.77 -42.54 96.63 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 CA-C-N 118.548 0.613 . . . . 0.65 109.879 -179.762 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 21.7 ttmm -59.74 -41.47 90.99 Favored 'General case' 0 CA--C 1.533 0.299 0 O-C-N 121.426 -0.796 . . . . 3.1 110.064 174.063 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -59.49 -58.89 6.61 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 117.729 0.24 . . . . 3.06 111.135 174.989 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.574 HG12 HG22 ' A' ' 3' ' ' ILE . 4.1 m -56.6 -40.78 71.09 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 O-C-N 121.631 -0.668 . . . . 0.68 110.955 -177.631 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 5.9 t80 -44.11 -44.8 7.83 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.942 0.897 . . . . 5.09 111.884 172.993 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.54 -38.49 77.9 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 118.816 0.735 . . . . 4.51 110.868 178.253 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -72.41 -34.54 67.94 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.027 0.531 . . . . 3.57 110.173 178.221 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 5.1 mm -65.61 -54.45 27.97 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.166 0 C-N-CA 122.742 0.417 . . . . 1.8 110.325 177.753 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -75.85 67.45 2.25 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 108.478 -0.934 . . . . 2.0 108.478 -178.594 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 5.4 t30 -50.64 -40.36 52.95 Favored 'General case' 0 C--N 1.333 -0.14 0 C-N-CA 126.6 1.96 . . . . 1.92 111.99 -172.821 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -78.79 -22.65 46.02 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 126.781 2.032 . . . . 2.33 112.348 178.394 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 7.5 mt-30 62.4 31.53 17.19 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 126.183 1.793 . . . . 3.06 113.473 -177.783 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 97.0 p -60.29 -35.85 76.51 Favored 'General case' 0 C--N 1.339 0.135 0 O-C-N 120.907 -1.121 . . . . 1.41 111.236 167.555 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 88.61 -4.3 85.1 Favored Glycine 0 CA--C 1.531 1.085 0 CA-C-O 119.128 -0.818 . . . . 1.32 111.787 -167.6 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 46.1 m-85 -109.77 140.94 43.09 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 124.012 0.925 . . . . 2.71 109.084 168.764 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.3 mt -118.23 76.61 1.09 Allowed 'General case' 0 N--CA 1.44 -0.934 0 C-N-CA 127.649 2.38 . . . . 2.72 106.949 177.091 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -66.06 157.35 31.26 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 126.272 1.829 . . . . 2.7 111.203 170.549 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -52.15 -44.02 64.35 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 123.524 0.73 . . . . 3.76 112.813 -176.297 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -59.59 -37.01 77.4 Favored 'General case' 0 CA--C 1.535 0.386 0 O-C-N 121.537 -0.727 . . . . 3.47 111.971 176.753 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 64.6 mt-10 -66.09 -42.87 88.74 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 118.922 0.783 . . . . 2.0 109.901 172.022 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 8.9 mp -57.01 -31.64 65.32 Favored 'General case' 0 CA--C 1.533 0.305 0 O-C-N 121.523 -0.736 . . . . 2.73 111.207 173.816 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 14.4 ttpt -73.62 0.73 11.86 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 113.046 0.758 . . . . 2.9 113.046 175.808 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 66.7 t80 -150.91 68.88 0.95 Allowed 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 107.97 -1.122 . . . . 5.2 107.97 167.991 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -117.01 -61.33 1.73 Allowed 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 128.529 2.732 . . . . 2.16 108.463 -177.806 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -65.95 -21.4 66.42 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 123.858 0.863 . . . . 3.5 111.488 -178.182 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 77.8 mm-40 -62.58 -10.3 11.68 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 119.615 1.098 . . . . 2.24 111.688 177.775 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.6 mptp? -67.98 -46.57 70.97 Favored 'General case' 0 C--N 1.342 0.247 0 O-C-N 120.51 -1.369 . . . . 2.85 110.395 165.218 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 8.3 m-30 -74.37 -42.64 58.98 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 123.503 0.721 . . . . 3.07 110.535 -169.239 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -142.73 -178.17 5.67 Favored 'General case' 0 C--O 1.226 -0.177 0 C-N-CA 124.561 1.145 . . . . 4.75 108.601 -176.704 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 10.2 m -116.92 22.7 12.42 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 123.079 0.552 . . . . 2.21 111.957 -178.111 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -168.19 45.3 0.23 Allowed Glycine 0 C--N 1.336 0.536 0 N-CA-C 111.157 -0.777 . . . . 1.03 111.157 -177.579 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.426 ' HB3' ' OE2' ' A' ' 77' ' ' GLU . . . -76.67 -150.27 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 121.292 0.568 . . . . 1.37 111.073 -179.463 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -115.74 -6.77 12.13 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 123.997 0.919 . . . . 3.13 112.801 -174.729 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.426 ' OE2' ' HB3' ' A' ' 75' ' ' ALA . 1.0 OUTLIER -49.18 -33.92 13.4 Favored 'General case' 0 C--O 1.226 -0.181 0 N-CA-C 113.348 0.869 . . . . 4.06 113.348 -175.407 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.449 ' H ' HD22 ' A' ' 78' ' ' LEU . 0.2 OUTLIER -39.26 -53.02 1.96 Allowed 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 125.307 1.443 . . . . 0.96 111.168 169.503 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 6.0 m -77.95 120.61 23.04 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-O 122.706 1.241 . . . . 1.13 110.752 -176.375 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 56.4 mp0 -66.85 -33.42 75.57 Favored 'General case' 0 N--CA 1.441 -0.899 0 CA-C-N 114.025 -1.443 . . . . 3.92 111.25 -174.967 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 5.9 t -57.75 -59.08 5.76 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 119.644 1.111 . . . . 1.84 110.891 178.761 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 15.5 mp0 -56.28 -45.59 80.1 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 123.621 0.768 . . . . 3.45 111.217 177.273 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -55.36 -48.67 73.91 Favored 'General case' 0 N--CA 1.457 -0.096 0 N-CA-C 109.298 -0.63 . . . . 0.59 109.298 176.861 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 7.8 tmtt? -67.8 -32.79 73.6 Favored 'General case' 0 N--CA 1.443 -0.803 0 C-N-CA 123.661 0.785 . . . . 5.73 110.611 -174.71 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 20.3 m -58.08 -44.83 87.8 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 124.025 0.93 . . . . 1.47 110.183 171.223 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -63.32 -54.99 28.33 Favored 'General case' 0 C--O 1.236 0.374 0 O-C-N 122.065 -0.397 . . . . 3.46 110.646 172.43 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 3.7 ttp -45.62 -45.14 13.66 Favored 'General case' 0 C--O 1.223 -0.332 0 C-N-CA 123.361 0.664 . . . . 3.5 111.486 177.458 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -55.58 -44.77 77.23 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 125.646 1.578 . . . . 0.72 112.058 -173.405 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -84.8 -43.03 14.58 Favored 'General case' 0 N--CA 1.461 0.088 0 CA-C-O 120.626 0.25 . . . . 0.8 110.822 179.405 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -58.3 -42.33 86.41 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 123.027 0.531 . . . . 0.45 111.07 -178.404 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -74.34 87.0 2.0 Allowed 'General case' 0 N--CA 1.445 -0.714 0 N-CA-C 109.131 -0.692 . . . . 0.84 109.131 178.497 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 9.3 m-80 -82.2 39.8 0.6 Allowed 'General case' 0 CA--C 1.535 0.379 0 O-C-N 121.18 -0.95 . . . . 3.22 109.99 -177.233 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 45.8 m-20 -127.98 -58.23 1.22 Allowed 'General case' 0 C--N 1.339 0.119 0 C-N-CA 124.829 1.252 . . . . 1.37 109.039 -178.146 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 100.78 44.98 2.0 Allowed Glycine 0 CA--C 1.53 1.028 0 N-CA-C 109.61 -1.396 . . . . 0.9 109.61 -162.197 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -127.54 -51.9 1.37 Allowed 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.669 1.188 . . . . 1.94 110.041 174.872 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 124.17 -36.73 2.86 Favored Glycine 0 CA--C 1.525 0.699 0 C-N-CA 124.527 1.06 . . . . 0.68 111.543 175.224 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 51.7 mttm -70.29 116.28 10.46 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 107.806 -1.183 . . . . 4.73 107.806 175.608 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 4.0 mt -89.18 166.4 1.86 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.334 0 N-CA-C 107.459 -1.312 . . . . 1.39 107.459 173.71 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -144.58 178.79 22.24 Favored Glycine 0 N--CA 1.446 -0.663 0 N-CA-C 107.177 -2.369 . . . . 0.87 107.177 172.08 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -55.01 -46.04 75.17 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 109.62 -0.511 . . . . 0.82 109.62 -176.575 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 22.9 tt0 -58.86 -63.25 1.37 Allowed 'General case' 0 N--CA 1.444 -0.766 0 O-C-N 124.24 0.962 . . . . 2.49 109.538 -176.613 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -46.21 -47.54 17.82 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 123.455 0.702 . . . . 1.27 112.205 174.971 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -61.61 -53.76 51.91 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-O 121.405 0.621 . . . . 2.91 109.858 -176.771 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -62.28 -32.64 73.38 Favored 'General case' 0 C--O 1.218 -0.594 0 C-N-CA 124.066 0.947 . . . . 2.55 110.717 178.995 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 30.5 mm-40 -64.22 -54.02 39.97 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-N 120.07 1.304 . . . . 3.48 109.931 175.646 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.05 -52.6 62.68 Favored 'General case' 0 CA--C 1.531 0.237 0 N-CA-C 108.029 -1.101 . . . . 2.99 108.029 -179.938 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 71.7 t -70.0 -34.07 58.12 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.607 0 CA-C-N 115.594 -0.73 . . . . 1.17 112.821 -174.19 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 6.7 t-80 -86.66 8.12 23.71 Favored 'General case' 0 CA--C 1.534 0.356 0 O-C-N 119.734 -1.853 . . . . 3.34 111.269 -178.037 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 32.2 t . . . . . 0 C--O 1.254 1.311 0 CA-C-O 115.518 -2.182 . . . . 2.39 111.386 178.55 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.614 HG22 HG12 ' A' ' 47' ' ' VAL . 0.2 OUTLIER . . . . . 0 CA--C 1.536 0.404 0 N-CA-C 112.899 0.704 . . . . 1.51 112.899 . . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -44.06 -50.27 8.49 Favored 'General case' 0 N--CA 1.442 -0.84 0 C-N-CA 125.697 1.599 . . . . 2.34 110.106 170.982 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -86.02 46.41 1.32 Allowed 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.462 1.105 . . . . 3.38 110.418 -173.273 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 25.3 t -142.01 -58.96 0.21 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.1 0 C-N-CA 123.905 0.882 . . . . 1.52 108.936 177.248 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 9.8 tp -171.41 -51.82 0.02 OUTLIER 'General case' 0 C--O 1.232 0.159 0 N-CA-C 106.943 -1.502 . . . . 1.25 106.943 -174.201 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 18.7 m -48.67 -21.14 0.55 Allowed 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 116.052 1.871 . . . . 1.02 116.052 -166.527 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -50.47 -49.09 56.15 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 120.286 1.403 . . . . 0.69 111.46 171.461 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -65.45 -42.94 91.81 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-O 122.086 0.946 . . . . 1.84 109.596 -177.694 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 27.7 m-20 -62.06 -51.1 69.34 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 115.187 -0.915 . . . . 2.53 109.046 -176.889 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 16.9 pt -63.27 -39.58 85.79 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.916 0 O-C-N 121.683 -0.636 . . . . 0.81 111.601 178.661 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -54.66 -44.94 73.73 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 118.356 0.525 . . . . 0.56 110.774 173.956 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.41 -56.61 16.57 Favored 'General case' 0 CA--C 1.535 0.378 0 O-C-N 122.014 -0.429 . . . . 0.61 110.855 173.485 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.534 ' HB1' ' CE2' ' A' ' 30' ' ' PHE . . . -47.59 -48.35 28.18 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 125.89 1.676 . . . . 0.56 111.369 -177.052 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 14.3 tp -50.21 -42.29 51.31 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 126.166 1.786 . . . . 2.39 110.532 177.868 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 4.9 tm0? -86.44 -45.52 11.07 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 123.884 0.874 . . . . 3.59 109.163 -171.176 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -61.79 -44.44 96.87 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 120.737 0.303 . . . . 3.45 110.421 -178.804 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 69.5 m -104.83 67.16 0.79 Allowed 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 107.153 -1.425 . . . . 1.48 107.153 175.979 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 19.2 ttt-85 -102.89 -2.8 27.19 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 119.473 1.033 . . . . 5.27 113.27 178.545 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -103.11 155.18 36.97 Favored Pre-proline 0 CA--C 1.533 0.322 0 C-N-CA 124.277 1.031 . . . . 2.28 110.626 -173.577 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -66.07 126.88 16.56 Favored 'Trans proline' 0 N--CA 1.453 -0.876 0 C-N-CA 122.423 2.082 . . . . 1.41 111.121 -176.859 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 42.6 m-20 63.19 53.28 2.29 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 127.907 2.483 . . . . 2.51 110.107 175.963 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.5 m -118.73 -18.44 8.96 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 124.326 1.05 . . . . 0.76 112.828 179.738 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 19.4 t80 -60.74 106.05 0.52 Allowed 'General case' 0 N--CA 1.446 -0.655 0 C-N-CA 124.326 1.05 . . . . 3.16 109.856 -174.686 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -86.99 142.78 34.22 Favored Pre-proline 0 CA--C 1.534 0.354 0 N-CA-C 108.572 -0.899 . . . . 2.69 108.572 165.637 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -65.34 -67.97 0.04 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.107 0 C-N-CA 123.169 2.579 . . . . 0.58 110.476 -179.337 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 40.5 mt-30 -55.39 -41.86 73.22 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.302 0.641 . . . . 2.27 110.73 -176.926 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 12.4 tptp -51.87 -69.71 0.11 Allowed 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 109.629 -0.508 . . . . 3.3 109.629 172.716 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.534 ' CE2' ' HB1' ' A' ' 15' ' ' ALA . 40.2 t80 -55.72 -37.09 67.95 Favored 'General case' 0 C--O 1.221 -0.44 0 C-N-CA 123.329 0.652 . . . . 2.89 111.043 -173.967 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.49 ' CE1' ' HA ' ' A' ' 107' ' ' VAL . 0.7 OUTLIER -55.82 -59.14 5.3 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 126.138 1.775 . . . . 4.67 110.297 177.459 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 42.1 mt-30 -61.1 -44.24 97.65 Favored 'General case' 0 CA--C 1.517 -0.312 0 N-CA-C 108.697 -0.853 . . . . 3.03 108.697 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -65.21 -30.56 71.46 Favored 'General case' 0 N--CA 1.434 -1.274 0 N-CA-C 113.094 0.776 . . . . 0.76 113.094 -175.228 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 34.9 t -74.54 -0.73 18.61 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 123.712 0.805 . . . . 1.66 109.773 174.559 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 75.32 5.45 77.19 Favored Glycine 0 C--N 1.339 0.743 0 N-CA-C 111.039 -0.824 . . . . 0.67 111.039 178.381 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.484 HD21 HG21 ' A' ' 47' ' ' VAL . 5.0 mt -70.45 -25.12 63.04 Favored 'General case' 0 N--CA 1.447 -0.618 0 O-C-N 121.387 -1.067 . . . . 2.03 110.822 -170.7 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.442 ' HB3' ' CZ ' ' A' ' 31' ' ' PHE . 25.4 p -65.72 -27.96 68.71 Favored 'General case' 0 CA--C 1.529 0.139 0 C-N-CA 123.644 0.778 . . . . 2.35 110.775 171.413 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 12.5 tptt -86.86 -33.64 19.73 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 108.428 -0.952 . . . . 3.84 108.428 -178.582 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 30.0 mtt -58.54 131.39 50.62 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 118.789 -1.164 . . . . 2.86 111.044 172.63 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 82.2 p -70.6 158.15 36.68 Favored 'General case' 0 CA--C 1.533 0.298 0 O-C-N 121.675 -0.64 . . . . 2.6 110.11 178.29 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -43.59 -36.84 2.26 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.78 1.232 . . . . 0.78 113.082 177.337 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 9.3 m-80 -56.56 -61.8 2.17 Favored 'General case' 0 CA--C 1.527 0.091 0 C-N-CA 124.128 0.971 . . . . 1.58 109.21 175.045 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 23.5 mm100 -59.54 -45.61 91.29 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 115.804 -0.634 . . . . 2.88 110.076 -179.506 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.519 HG13 HG11 ' A' ' 107' ' ' VAL . 73.1 t -57.13 -46.15 84.51 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 CA-C-N 118.975 0.807 . . . . 0.7 110.0 -177.452 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 3.2 ttpm? -72.59 -29.64 63.69 Favored 'General case' 0 N--CA 1.448 -0.554 0 O-C-N 121.798 -0.564 . . . . 3.84 111.519 179.896 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -62.74 -58.51 7.22 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 118.939 0.791 . . . . 2.84 110.67 170.365 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.614 HG12 HG22 ' A' ' 3' ' ' ILE . 12.0 m -53.02 -44.67 51.13 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.174 0 O-C-N 121.8 -0.563 . . . . 0.56 110.224 -179.209 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.46 ' CZ ' ' HB2' ' A' ' 100' ' ' ALA . 13.5 t80 -42.3 -50.83 4.97 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 123.262 0.625 . . . . 4.67 111.827 171.111 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 65.4 mtp85 -65.8 -34.39 78.06 Favored 'General case' 0 CA--C 1.529 0.173 0 C-N-CA 122.895 0.478 . . . . 3.19 110.926 179.183 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -61.89 -40.55 95.8 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 109.802 -0.444 . . . . 3.75 109.802 175.445 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.504 HG21 ' CD1' ' A' ' 67' ' ' PHE . 25.5 mm -84.06 -47.49 17.65 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 CA-C-O 118.088 -0.958 . . . . 1.45 113.233 -173.648 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -72.46 71.47 0.94 Allowed 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 106.536 -1.653 . . . . 1.94 106.536 170.876 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -57.2 -36.74 71.21 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 126.842 2.057 . . . . 2.2 111.521 -173.476 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 12.0 p-10 -58.18 -27.24 63.67 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 126.748 2.019 . . . . 3.03 112.23 170.224 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 22.7 mt-30 49.95 57.89 6.06 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 126.047 1.739 . . . . 3.26 110.145 -172.795 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 78.3 p -80.1 -42.8 22.89 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 114.137 -1.392 . . . . 1.38 109.769 171.67 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 117.38 -26.98 7.89 Favored Glycine 0 CA--C 1.53 1.005 0 CA-C-O 119.343 -0.698 . . . . 1.55 111.718 -169.622 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 37.3 m-85 -118.96 138.76 52.57 Favored 'General case' 0 C--N 1.34 0.171 0 C-N-CA 123.898 0.879 . . . . 2.94 110.344 -178.24 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -84.7 76.07 10.25 Favored 'General case' 0 N--CA 1.456 -0.146 0 N-CA-C 107.036 -1.468 . . . . 1.75 107.036 167.725 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -54.83 155.77 4.13 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.718 1.207 . . . . 1.53 109.727 171.461 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -44.48 -54.35 6.06 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 123.647 0.779 . . . . 3.3 111.874 -177.73 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -56.09 -35.46 67.05 Favored 'General case' 0 CA--C 1.534 0.327 0 N-CA-C 114.132 1.16 . . . . 3.63 114.132 176.802 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -65.39 -37.47 87.07 Favored 'General case' 0 N--CA 1.462 0.127 0 CA-C-N 120.543 1.519 . . . . 3.25 109.622 174.608 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 60.1 mt -73.2 14.27 0.33 Allowed 'General case' 0 C--O 1.222 -0.393 0 CA-C-O 118.523 -0.751 . . . . 2.18 112.408 170.193 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 27.2 ttpt -97.31 0.04 47.35 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 120.084 1.311 . . . . 2.02 109.716 162.163 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 92.1 m-85 -149.11 32.77 0.74 Allowed 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.567 0.747 . . . . 4.58 111.795 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.504 ' CD1' HG21 ' A' ' 51' ' ' ILE . 46.0 t80 -64.77 -72.22 0.16 Allowed 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 119.625 1.102 . . . . 2.35 109.82 -179.869 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 15.7 mt -65.98 -16.92 64.31 Favored 'General case' 0 CA--C 1.534 0.33 0 O-C-N 120.494 -1.379 . . . . 2.41 113.205 177.48 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 74.1 mm-40 -57.25 -33.18 67.31 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 121.032 -1.042 . . . . 1.86 111.347 176.395 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 1.6 mptp? -83.47 -13.56 54.43 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 118.792 0.723 . . . . 3.73 112.227 174.957 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 24.5 m-85 -75.29 -56.48 4.68 Favored 'General case' 0 C--N 1.338 0.104 0 N-CA-C 108.702 -0.851 . . . . 3.22 108.702 171.309 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 28.2 tp10 -118.06 -63.76 1.38 Allowed 'General case' 0 CA--C 1.531 0.248 0 O-C-N 124.148 0.905 . . . . 3.82 110.416 -169.824 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 8.7 t 104.3 117.68 0.01 OUTLIER 'General case' 0 C--N 1.341 0.236 0 C-N-CA 127.68 2.392 . . . . 2.93 107.546 -170.014 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 90.36 24.9 27.54 Favored Glycine 0 CA--C 1.529 0.958 0 C-N-CA 124.59 1.09 . . . . 1.51 111.943 -176.853 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -87.19 173.42 9.24 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.742 0.817 . . . . 1.88 110.744 176.673 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.76 -13.84 1.96 Allowed 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 126.913 2.085 . . . . 3.75 115.765 -167.048 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 73.8 mm-40 -37.71 -41.66 0.51 Allowed 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 126.494 1.917 . . . . 3.61 114.424 -173.251 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.605 ' H ' HD22 ' A' ' 78' ' ' LEU . 1.1 mm? -48.86 -41.65 33.92 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 123.584 0.753 . . . . 0.95 112.522 177.368 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 31.5 m -71.59 110.09 5.94 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 121.836 0.827 . . . . 0.76 110.585 178.602 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 24.6 mp0 -59.55 -42.99 93.64 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 114.786 -1.097 . . . . 3.6 110.09 -178.84 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 2.6 m -52.32 -55.18 23.2 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.836 0.854 . . . . 1.58 112.278 177.168 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -67.39 -41.65 84.63 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 108.505 -0.924 . . . . 2.78 108.505 -173.089 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -53.01 -52.16 59.34 Favored 'General case' 0 CA--C 1.517 -0.307 0 C-N-CA 123.496 0.718 . . . . 0.58 109.151 171.718 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 12.5 tttt -73.56 -23.14 59.93 Favored 'General case' 0 N--CA 1.438 -1.039 0 CA-C-N 116.05 -0.523 . . . . 4.59 110.465 -171.209 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 21.9 m -63.49 -43.64 96.68 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.599 0.76 . . . . 1.62 110.22 167.232 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.6 tt -59.33 -61.77 2.38 Favored 'General case' 0 CA--C 1.533 0.3 0 N-CA-C 108.6 -0.889 . . . . 2.32 108.6 169.957 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 35.3 ttp -47.18 -49.27 22.99 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 112.412 0.523 . . . . 2.49 112.412 -177.616 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -52.42 -40.7 62.49 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 125.851 1.66 . . . . 0.49 112.274 -173.604 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -90.83 -36.98 13.9 Favored 'General case' 0 C--O 1.226 -0.155 0 C-N-CA 122.355 0.262 . . . . 0.5 111.351 179.52 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -57.7 -44.44 85.88 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 122.319 0.248 . . . . 0.37 111.044 177.897 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 8.8 t0 -66.45 120.6 13.64 Favored 'General case' 0 N--CA 1.442 -0.845 0 N-CA-C 108.292 -1.003 . . . . 1.75 108.292 174.461 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 49.1 p30 -104.35 11.13 35.05 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 112.63 0.604 . . . . 3.31 112.63 176.022 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -95.01 -52.89 4.03 Favored 'General case' 0 C--N 1.342 0.279 0 CA-C-N 118.731 0.696 . . . . 1.39 110.414 173.626 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 97.38 47.94 2.1 Favored Glycine 0 CA--C 1.53 1.025 0 N-CA-C 108.676 -1.77 . . . . 0.89 108.676 -156.383 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 36.2 p30 -128.29 -64.78 0.93 Allowed 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 126.355 1.862 . . . . 1.94 110.055 175.036 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 140.13 -49.39 0.8 Allowed Glycine 0 CA--C 1.522 0.516 0 C-N-CA 125.31 1.433 . . . . 0.86 109.52 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 23.2 pttm -53.22 128.39 27.84 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 109.473 -0.565 . . . . 5.27 109.473 174.455 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 5.6 mt -118.6 107.94 22.94 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.325 0 C-N-CA 125.518 1.527 . . . . 0.72 108.233 -175.912 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -66.97 163.8 44.3 Favored Glycine 0 CA--C 1.532 1.102 0 N-CA-C 110.993 -0.843 . . . . 0.59 110.993 172.477 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' ALA . . . . . 0.46 ' HB2' ' CZ ' ' A' ' 48' ' ' PHE . . . -51.93 -38.78 57.65 Favored 'General case' 0 C--N 1.339 0.13 0 O-C-N 122.104 -0.645 . . . . 0.72 109.631 168.215 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -59.59 -55.63 32.03 Favored 'General case' 0 N--CA 1.444 -0.758 0 CA-C-N 115.142 -0.935 . . . . 2.45 109.91 178.788 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -52.66 -46.37 67.16 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.616 0.766 . . . . 2.23 110.679 175.357 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 85.4 t80 -56.51 -57.64 11.46 Favored 'General case' 0 CA--C 1.536 0.406 0 O-C-N 121.816 -0.553 . . . . 4.17 111.349 177.548 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 30.8 tt0 -55.97 -37.81 69.56 Favored 'General case' 0 CA--C 1.533 0.299 0 O-C-N 121.748 -0.595 . . . . 2.18 110.294 177.183 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -56.8 -60.8 3.04 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 123.42 0.688 . . . . 4.58 109.872 178.531 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 12.0 ptm -57.47 -43.41 84.02 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 119.822 -0.751 . . . . 5.7 109.65 178.543 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 107' ' ' VAL . . . . . 0.519 HG11 HG13 ' A' ' 44' ' ' VAL . 57.1 t -69.65 -16.88 20.88 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 N-CA-C 112.126 0.417 . . . . 1.39 112.126 -175.297 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -76.01 -23.52 55.22 Favored 'General case' 0 CA--C 1.538 0.483 0 O-C-N 120.123 -1.61 . . . . 2.6 110.903 175.981 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 15.5 t . . . . . 0 C--O 1.252 1.216 0 CA-C-O 116.36 -1.781 . . . . 2.46 114.017 -164.456 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 2.3 pp . . . . . 0 CA--C 1.535 0.37 0 CA-C-O 121.451 0.643 . . . . 1.2 111.392 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 2.3 t -51.88 -44.03 63.56 Favored 'General case' 0 N--CA 1.436 -1.142 0 C-N-CA 125.401 1.48 . . . . 1.73 111.14 174.319 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 23.3 t0 -98.18 42.25 1.1 Allowed 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 126.538 1.935 . . . . 3.41 109.423 -173.132 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 97.4 t -136.73 -59.95 0.44 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.101 0 C-N-CA 124.997 1.319 . . . . 1.72 108.611 177.646 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -170.87 -47.24 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.116 0 N-CA-C 107.395 -1.335 . . . . 1.36 107.395 -177.432 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 20.3 m -49.08 -22.84 1.01 Allowed 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 116.639 2.088 . . . . 1.09 116.639 -166.92 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -49.35 -42.16 40.99 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 119.823 1.192 . . . . 0.88 112.291 169.107 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -68.42 -40.05 81.35 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 121.829 0.823 . . . . 2.07 110.41 176.593 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -61.28 -47.19 87.15 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 115.797 -0.638 . . . . 4.96 109.834 -177.788 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 34.6 pt -65.57 -38.22 81.87 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.11 0 CA-C-O 119.163 -0.446 . . . . 1.11 109.797 -177.711 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.93 -46.46 78.46 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 118.341 0.519 . . . . 0.61 111.274 173.378 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.95 -61.04 2.93 Favored 'General case' 0 C--O 1.234 0.262 0 O-C-N 121.961 -0.462 . . . . 0.65 111.012 174.273 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -51.27 -44.79 61.89 Favored 'General case' 0 CA--C 1.528 0.099 0 C-N-CA 123.56 0.744 . . . . 0.52 111.167 -176.892 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.438 HD23 ' HG2' ' A' ' 17' ' ' GLN . 0.8 OUTLIER -48.72 -44.41 38.23 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 125.54 1.536 . . . . 3.3 111.903 177.907 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.438 ' HG2' HD23 ' A' ' 16' ' ' LEU . 2.9 mm100 -86.67 -49.39 7.53 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 119.222 0.919 . . . . 3.3 110.946 178.616 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 55.3 tp10 -50.63 -47.45 58.37 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.978 0.911 . . . . 3.9 110.803 -177.682 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 74.6 m -112.52 58.86 0.64 Allowed 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 124.757 1.223 . . . . 1.62 108.031 177.262 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 56.8 ttt180 -82.82 -54.17 5.31 Favored 'General case' 0 CA--C 1.52 -0.176 0 O-C-N 121.522 -0.736 . . . . 4.04 109.701 178.257 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 36.6 m-20 -58.73 143.41 82.37 Favored Pre-proline 0 N--CA 1.449 -0.476 0 CA-C-N 115.171 -0.922 . . . . 2.14 110.285 -173.5 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -64.57 134.89 43.11 Favored 'Trans proline' 0 N--CA 1.449 -1.137 0 C-N-CA 122.406 2.07 . . . . 1.2 110.402 -173.817 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 69.5 m-20 63.15 36.87 11.8 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 127.643 2.377 . . . . 2.67 111.699 178.457 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 6.1 m -102.64 0.35 33.08 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 123.907 0.883 . . . . 0.65 110.88 173.51 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -70.89 138.12 49.89 Favored 'General case' 0 N--CA 1.449 -0.487 0 O-C-N 121.35 -0.844 . . . . 2.29 110.582 -174.482 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -131.84 148.49 70.11 Favored Pre-proline 0 N--CA 1.452 -0.328 0 C-N-CA 123.965 0.906 . . . . 2.51 109.395 170.731 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_endo -65.67 -71.64 0.02 OUTLIER 'Trans proline' 0 N--CA 1.451 -0.973 0 C-N-CA 123.741 2.961 . . . . 0.62 111.007 -178.856 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 53.7 mt-30 -51.8 -46.22 64.15 Favored 'General case' 0 C--O 1.233 0.205 0 C-N-CA 123.879 0.872 . . . . 2.17 110.982 -178.725 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 16.9 tptt -47.75 -60.33 2.65 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 123.418 0.687 . . . . 2.74 110.007 171.689 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.475 ' CE1' HD21 ' A' ' 68' ' ' LEU . 82.3 t80 -56.34 -47.06 79.57 Favored 'General case' 0 C--O 1.222 -0.362 0 C-N-CA 122.805 0.442 . . . . 2.23 110.846 -179.425 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 9.0 m-30 -54.34 -40.54 68.13 Favored 'General case' 0 CA--C 1.531 0.233 0 O-C-N 121.166 -0.959 . . . . 4.86 111.411 -178.956 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 33.4 mt-30 -73.1 -54.75 7.73 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 110.331 -0.248 . . . . 3.16 110.331 176.263 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -57.85 -39.07 76.87 Favored 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 123.15 0.58 . . . . 0.71 110.332 -172.213 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 10.9 m -86.1 6.72 27.81 Favored 'General case' 0 N--CA 1.444 -0.744 0 C-N-CA 124.815 1.246 . . . . 2.14 111.558 -177.748 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 75.23 -16.53 3.58 Favored Glycine 0 CA--C 1.531 1.063 0 O-C-N 119.366 -2.084 . . . . 0.67 113.093 169.186 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 12.7 mt -56.15 -29.55 60.92 Favored 'General case' 0 N--CA 1.441 -0.89 0 C-N-CA 126.425 1.89 . . . . 1.64 112.995 178.615 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 8.1 t -70.34 -32.96 70.91 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 123.521 0.728 . . . . 1.79 111.41 170.523 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 2.4 tptt -74.79 -36.7 62.5 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 108.397 -0.964 . . . . 5.11 108.397 178.76 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 41.2 mtt -66.5 119.86 12.39 Favored 'General case' 0 N--CA 1.443 -0.788 0 N-CA-C 109.223 -0.658 . . . . 2.31 109.223 173.512 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 16.4 t -63.46 161.97 13.44 Favored 'General case' 0 N--CA 1.453 -0.293 0 O-C-N 121.804 -0.56 . . . . 3.09 109.651 174.454 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -37.7 -44.14 0.69 Allowed 'General case' 0 CA--C 1.527 0.091 0 C-N-CA 126.095 1.758 . . . . 0.84 112.055 178.427 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 39.5 m-20 -39.92 -56.87 1.72 Allowed 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 125.937 1.695 . . . . 2.12 111.565 174.761 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 9.1 mm100 -75.98 -36.68 59.15 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 122.991 0.516 . . . . 2.52 110.177 -176.589 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 4.2 t -61.17 -35.31 64.91 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.584 0 N-CA-C 108.721 -0.844 . . . . 0.96 108.721 179.029 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 80.4 tttt -56.56 -50.03 73.11 Favored 'General case' 0 CA--C 1.531 0.235 0 O-C-N 121.157 -0.964 . . . . 3.4 111.589 172.843 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -55.08 -52.51 62.98 Favored 'General case' 0 C--O 1.233 0.206 0 N-CA-C 110.072 -0.344 . . . . 2.62 110.072 176.92 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 2.4 m -59.53 -45.3 94.05 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 C-N-CA 119.151 -1.019 . . . . 0.77 110.803 179.688 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 10.9 m-85 -47.43 -48.96 26.22 Favored 'General case' 0 C--N 1.34 0.165 0 C-N-CA 124.072 0.949 . . . . 4.57 111.912 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 4.4 mtt180 -61.01 -28.41 69.02 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 120.199 -0.601 . . . . 3.3 111.877 179.638 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 7.6 t80 -72.18 -40.81 67.64 Favored 'General case' 0 N--CA 1.452 -0.343 0 O-C-N 121.955 -0.465 . . . . 4.18 110.067 170.568 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 5.0 mm -66.82 -51.55 54.35 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-O 118.356 -0.831 . . . . 1.62 111.654 -176.047 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -66.4 76.36 0.1 Allowed 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 107.361 -1.348 . . . . 2.26 107.361 171.312 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -66.95 -30.25 70.33 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 123.665 0.786 . . . . 2.15 109.621 178.819 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 38.5 p-10 -65.63 -44.01 87.78 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 123.545 0.738 . . . . 2.5 110.689 169.69 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . 0.297 0.0 OUTLIER 101.54 10.76 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 130.031 3.332 . . . . 4.88 112.809 173.74 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 7.7 p -71.7 -39.77 69.97 Favored 'General case' 0 CA--C 1.528 0.133 0 N-CA-C 112.488 0.551 . . . . 1.71 112.488 -170.68 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 113.37 -26.39 10.34 Favored Glycine 0 CA--C 1.527 0.81 0 N-CA-C 111.61 -0.596 . . . . 1.81 111.61 -179.444 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 86.5 m-85 -79.58 134.81 36.48 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 107.734 -1.209 . . . . 3.15 107.734 166.927 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -92.62 71.94 5.01 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 105.526 -2.027 . . . . 2.67 105.526 172.367 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.42 157.23 11.52 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-N 113.981 -1.463 . . . . 1.61 108.979 179.544 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -45.0 -51.18 10.14 Favored 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 123.642 0.777 . . . . 4.24 111.578 -172.976 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 20.2 mp0 -59.06 -30.6 68.18 Favored 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 114.427 1.269 . . . . 4.32 114.427 178.708 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -59.35 -41.66 89.72 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 121.354 1.888 . . . . 2.66 109.013 169.865 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -74.45 12.12 0.84 Allowed 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 123.632 0.773 . . . . 2.34 112.44 174.905 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 32.2 ttpt -104.08 2.7 32.37 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 125.298 1.439 . . . . 2.64 109.644 166.344 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 34.4 p90 -151.17 27.78 0.68 Allowed 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 119.126 0.875 . . . . 5.6 113.342 171.881 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -56.54 -64.24 0.93 Allowed 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 119.209 0.913 . . . . 2.52 109.962 -179.585 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.475 HD21 ' CE1' ' A' ' 30' ' ' PHE . 7.1 mp -81.3 -17.02 50.74 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 112.873 0.694 . . . . 2.37 112.873 -179.657 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 68.3 mm-40 -54.62 -33.17 60.08 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 119.653 1.115 . . . . 1.61 110.31 174.856 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.2 mtpt -62.85 -23.43 67.3 Favored 'General case' 0 CA--C 1.535 0.383 0 O-C-N 121.962 -0.461 . . . . 3.39 112.239 176.317 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 2.1 m-30 -98.31 -49.31 4.74 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 125.144 1.378 . . . . 3.16 110.162 -174.983 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -137.47 135.71 37.07 Favored 'General case' 0 C--N 1.341 0.202 0 C-N-CA 125.12 1.368 . . . . 4.23 108.769 -169.76 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 2.1 p -61.86 -32.95 73.34 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 124.805 1.242 . . . . 3.41 113.978 -165.849 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -119.88 27.15 6.9 Favored Glycine 0 CA--C 1.524 0.599 0 C-N-CA 125.114 1.34 . . . . 1.55 110.761 -173.392 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.37 153.53 38.23 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 117.408 0.604 . . . . 2.0 110.77 179.182 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.48 17.14 0.07 Allowed 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 115.823 1.786 . . . . 3.29 115.823 -161.349 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 68.5 mm-40 -55.47 -35.38 65.44 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-O 122.271 1.034 . . . . 3.71 111.623 -176.603 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.414 ' H ' HD22 ' A' ' 78' ' ' LEU . 0.0 OUTLIER -56.75 -37.56 71.21 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 115.11 -0.95 . . . . 0.76 111.507 177.242 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 54.2 m -74.57 107.63 6.82 Favored 'General case' 0 C--N 1.344 0.338 0 CA-C-N 118.994 0.815 . . . . 0.76 109.295 -178.804 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 15.9 pt-20 -56.68 -41.48 77.37 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 114.513 -1.222 . . . . 2.68 110.834 -178.221 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 66.1 m -59.39 -54.36 47.55 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 122.976 0.51 . . . . 1.39 112.096 177.404 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 -59.48 -45.51 91.46 Favored 'General case' 0 C--O 1.232 0.171 0 O-C-N 121.423 -0.798 . . . . 3.03 110.631 178.509 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -53.94 -47.86 70.84 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 121.696 0.76 . . . . 0.55 109.71 174.529 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 14.8 mmtp -65.4 -29.71 70.45 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 123.892 0.877 . . . . 4.85 111.357 -177.078 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.2 t -56.47 -46.61 80.32 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 119.285 0.948 . . . . 1.98 110.314 170.449 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 28.3 mt -64.2 -57.41 9.59 Favored 'General case' 0 C--O 1.235 0.319 0 O-C-N 121.761 -0.587 . . . . 2.58 109.914 174.798 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 2.0 tpt -40.82 -52.89 2.97 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 123.675 0.79 . . . . 2.98 111.39 176.811 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -53.6 -48.4 69.3 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 126.792 2.037 . . . . 0.51 111.875 -170.634 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -80.25 -47.44 14.59 Favored 'General case' 0 N--CA 1.457 -0.108 0 C-N-CA 121.186 -0.206 . . . . 0.61 110.752 178.206 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -54.66 -38.38 66.87 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 120.664 0.269 . . . . 0.58 110.996 -176.1 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -78.27 103.79 8.44 Favored 'General case' 0 N--CA 1.442 -0.842 0 CA-C-N 116.436 -0.347 . . . . 1.09 110.197 178.191 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 9.4 m-80 -95.71 27.66 3.38 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 123.558 0.743 . . . . 2.87 110.339 -177.664 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 45.2 m-20 -119.49 -51.07 2.3 Favored 'General case' 0 N--CA 1.46 0.041 0 C-N-CA 124.558 1.143 . . . . 1.44 109.332 178.095 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 91.84 42.28 4.78 Favored Glycine 0 CA--C 1.527 0.829 0 N-CA-C 108.771 -1.732 . . . . 0.94 108.771 -158.343 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 33.5 p30 -121.36 -63.21 1.35 Allowed 'General case' 0 C--N 1.342 0.253 0 C-N-CA 124.035 0.934 . . . . 2.26 110.586 172.88 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 126.79 -31.91 3.8 Favored Glycine 0 CA--C 1.521 0.46 0 N-CA-C 111.261 -0.735 . . . . 1.0 111.261 177.745 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 25.7 pttm -58.29 101.11 0.07 Allowed 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 107.92 -1.141 . . . . 5.12 107.92 162.954 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 98' ' ' ILE . . . . . 0.413 HG21 ' CD2' ' A' ' 103' ' ' PHE . 26.7 mt -94.57 147.99 5.3 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 N-CA-C 107.106 -1.442 . . . . 1.28 107.106 176.102 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -117.01 170.33 13.38 Favored Glycine 0 CA--C 1.523 0.572 0 N-CA-C 109.683 -1.367 . . . . 0.54 109.683 175.927 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -59.59 -48.93 79.73 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 108.691 -0.855 . . . . 0.69 108.691 178.783 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -54.22 -54.73 36.01 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 111.86 0.319 . . . . 3.02 111.86 177.201 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -47.65 -53.99 13.27 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.525 1.13 . . . . 1.64 110.439 175.931 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 103' ' ' PHE . . . . . 0.413 ' CD2' HG21 ' A' ' 98' ' ' ILE . 0.1 OUTLIER -70.67 -38.83 73.82 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 119.37 -0.932 . . . . 3.86 111.305 -177.548 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -57.53 -49.79 75.2 Favored 'General case' 0 C--O 1.221 -0.404 0 C-N-CA 124.133 0.973 . . . . 2.79 108.652 -179.154 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -50.53 -54.19 24.36 Favored 'General case' 0 CA--C 1.528 0.129 0 CA-C-N 118.819 0.736 . . . . 3.89 110.367 176.887 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.12 -56.89 16.12 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 116.529 -0.305 . . . . 3.66 111.013 -178.018 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 42.5 t -50.23 -45.71 24.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 C-N-CA 124.299 1.04 . . . . 1.53 111.359 177.878 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 10.9 t-160 -72.44 -11.12 60.55 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 125.053 1.341 . . . . 3.05 111.016 -172.295 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 30.0 t . . . . . 0 C--O 1.252 1.188 0 C-N-CA 122.986 0.514 . . . . 3.33 112.035 178.394 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 2.6 pp . . . . . 0 CA--C 1.535 0.384 0 CA-C-O 121.419 0.628 . . . . 2.45 111.947 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.434 HG22 ' H ' ' A' ' 4' ' ' THR . 0.6 OUTLIER -81.22 57.69 3.28 Favored 'General case' 0 N--CA 1.439 -1.015 0 C-N-CA 126.322 1.849 . . . . 2.29 107.099 178.227 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 174.42 -48.92 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 126.324 1.85 . . . . 3.82 108.952 176.161 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -46.13 -41.89 4.37 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.307 0 C-N-CA 125.766 1.626 . . . . 1.89 112.224 -170.642 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -175.71 -60.11 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 105.867 -1.901 . . . . 1.64 105.867 -171.556 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 2.6 m -50.83 -29.18 11.07 Favored 'General case' 0 N--CA 1.445 -0.694 0 C-N-CA 124.736 1.214 . . . . 1.1 113.617 -170.12 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -49.73 -46.44 50.35 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 119.547 1.067 . . . . 0.86 113.14 171.415 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 42.5 t0 -66.18 -43.39 87.0 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-O 122.707 1.241 . . . . 1.87 108.911 179.921 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -64.38 -50.21 68.57 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 115.399 -0.819 . . . . 2.28 109.581 -175.486 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 9.5 pt -60.18 -41.17 85.79 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.677 0 O-C-N 121.249 -0.907 . . . . 1.21 111.341 176.477 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -54.74 -42.27 71.4 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 118.999 0.818 . . . . 1.1 111.014 174.181 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.84 -54.08 44.41 Favored 'General case' 0 CA--C 1.533 0.299 0 O-C-N 121.61 -0.681 . . . . 1.09 111.064 171.373 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.403 ' HB2' HG23 ' A' ' 33' ' ' THR . . . -51.9 -44.64 63.86 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 124.89 1.276 . . . . 1.15 111.379 -174.855 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.9 tp -48.12 -48.37 34.04 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 125.483 1.513 . . . . 2.59 109.958 174.557 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 23.7 mt-30 -82.46 -28.01 31.51 Favored 'General case' 0 CA--C 1.528 0.125 0 N-CA-C 113.381 0.882 . . . . 3.17 113.381 -178.921 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . 0.275 0.2 OUTLIER -71.82 -37.65 70.29 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 119.942 1.246 . . . . 3.69 109.386 176.865 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 44.4 m -92.36 38.22 1.01 Allowed 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.184 1.394 . . . . 2.5 112.407 174.153 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.93 -37.39 67.2 Favored 'General case' 0 N--CA 1.47 0.534 0 O-C-N 120.444 -1.41 . . . . 8.26 109.78 172.41 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -83.92 142.05 41.48 Favored Pre-proline 0 N--CA 1.447 -0.592 0 C-N-CA 124.092 0.957 . . . . 2.03 108.889 -176.27 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -69.46 150.73 70.41 Favored 'Trans proline' 0 N--CA 1.46 -0.498 0 C-N-CA 123.489 2.792 . . . . 1.39 112.008 -176.747 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 55.68 19.35 3.31 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.923 1.689 . . . . 2.29 112.945 178.57 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 55.5 m -91.82 -25.67 18.88 Favored 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 124.639 1.176 . . . . 0.95 111.087 -173.913 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 3.8 t80 -49.29 122.81 6.49 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 123.769 0.828 . . . . 3.46 109.731 178.002 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -114.79 152.52 46.46 Favored Pre-proline 0 CA--C 1.536 0.422 0 C-N-CA 124.354 1.062 . . . . 2.73 108.984 168.692 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_endo -66.42 -70.61 0.02 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.819 0 C-N-CA 123.434 2.756 . . . . 1.03 111.545 -175.948 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 -54.07 -45.72 71.81 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 123.574 0.75 . . . . 2.57 110.492 -179.196 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 22.3 tptt -45.77 -64.46 0.73 Allowed 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 123.666 0.786 . . . . 2.9 109.15 172.455 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.432 ' CZ ' HD11 ' A' ' 68' ' ' LEU . 75.4 t80 -59.32 -44.32 92.61 Favored 'General case' 0 N--CA 1.447 -0.616 0 C-N-CA 122.485 0.314 . . . . 2.26 111.455 -175.921 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 34.3 m-85 -57.17 -38.81 74.15 Favored 'General case' 0 N--CA 1.453 -0.29 0 O-C-N 121.394 -0.816 . . . . 5.02 111.054 -178.741 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 4.3 mt-30 -71.37 -51.55 23.56 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 118.643 0.656 . . . . 2.7 110.607 170.64 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.403 HG23 ' HB2' ' A' ' 15' ' ' ALA . 0.4 OUTLIER -58.67 -31.43 68.19 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 123.94 0.896 . . . . 1.3 111.804 -172.069 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.6 t -91.29 1.65 56.95 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 126.485 1.914 . . . . 1.88 110.497 -176.876 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 90.37 -36.78 3.48 Favored Glycine 0 C--N 1.335 0.523 0 O-C-N 120.682 -1.262 . . . . 1.34 110.192 170.477 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 3.3 mp -33.57 -52.57 0.4 Allowed 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 126.537 1.935 . . . . 3.05 114.865 179.158 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 10.3 t -69.39 -27.31 65.19 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 119.523 1.056 . . . . 2.47 111.49 -176.3 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 5.6 tmtp? -79.7 -39.27 31.61 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 108.994 -0.743 . . . . 3.25 108.994 176.419 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 9.6 mtt -57.67 143.31 42.02 Favored 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 123.532 0.733 . . . . 2.71 110.629 176.684 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 3.8 m -62.09 149.32 41.56 Favored 'General case' 0 N--CA 1.446 -0.627 0 O-C-N 121.873 -0.517 . . . . 1.96 109.878 172.909 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -37.89 -43.51 0.7 Allowed 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 125.054 1.342 . . . . 0.61 111.913 171.076 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -53.29 -60.99 2.59 Favored 'General case' 0 C--O 1.227 -0.087 0 C-N-CA 124.249 1.02 . . . . 2.42 110.061 178.038 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 28.7 mm100 -60.81 -39.08 87.63 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 123.092 0.557 . . . . 3.14 109.893 -178.313 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 60.1 t -60.85 -44.63 98.09 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.29 0 CA-C-N 118.823 0.738 . . . . 0.53 109.855 177.668 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 62.0 tttt -68.84 -39.64 79.85 Favored 'General case' 0 N--CA 1.451 -0.4 0 O-C-N 121.642 -0.661 . . . . 2.97 110.692 -178.061 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -59.71 -58.2 9.6 Favored 'General case' 0 C--O 1.232 0.153 0 C-N-CA 122.749 0.419 . . . . 3.22 110.2 173.211 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 14.0 m -55.63 -44.92 78.5 Favored 'Isoleucine or valine' 0 C--N 1.34 0.195 0 N-CA-C 109.59 -0.522 . . . . 0.52 109.59 -179.189 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.557 ' CZ ' HD23 ' A' ' 59' ' ' LEU . 43.3 t80 -46.43 -64.23 0.81 Allowed 'General case' 0 C--N 1.341 0.229 0 N-CA-C 109.449 -0.574 . . . . 4.15 109.449 171.723 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 63.8 mtt180 -54.67 -37.04 65.28 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 114.005 1.113 . . . . 4.56 114.005 -178.711 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 27.1 m-85 -64.08 -52.97 56.72 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 119.282 0.946 . . . . 4.97 109.981 175.991 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 35.8 mm -76.2 -20.63 15.29 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.691 0 O-C-N 121.816 -0.552 . . . . 2.78 111.773 -171.409 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 43.7 t0 -48.53 -28.64 3.51 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 128.759 2.824 . . . . 2.6 113.015 173.983 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 11.2 t-20 79.14 -56.09 0.43 Allowed 'General case' 0 C--N 1.339 0.144 0 C-N-CA 126.318 1.847 . . . . 3.55 112.65 162.624 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 29.4 p30 -69.57 -39.14 77.54 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.966 0.907 . . . . 3.02 110.08 168.086 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . 0.278 1.2 pt20 83.95 24.09 0.12 Allowed 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 129.641 3.176 . . . . 3.63 111.021 -171.922 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 89.0 p -77.14 -27.2 53.8 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 113.607 0.966 . . . . 2.38 113.607 -174.069 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 98.44 24.47 11.15 Favored Glycine 0 CA--C 1.534 1.247 0 C-N-CA 125.28 1.419 . . . . 1.99 112.397 -173.175 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 44.7 m-85 -143.22 128.05 18.3 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 118.338 1.069 . . . . 3.04 111.112 -177.543 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.557 HD23 ' CZ ' ' A' ' 48' ' ' PHE . 1.6 mm? -109.19 70.19 0.73 Allowed 'General case' 0 C--N 1.339 0.125 0 C-N-CA 127.148 2.179 . . . . 2.03 108.588 -179.685 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -54.28 159.05 2.08 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.563 1.545 . . . . 1.61 111.076 173.268 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -36.55 -54.53 0.87 Allowed 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 125.852 1.661 . . . . 4.32 112.082 176.19 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 -63.81 -45.48 89.47 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 115.957 -0.565 . . . . 3.21 110.337 -173.345 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 81.7 mt-10 -62.89 -40.23 96.9 Favored 'General case' 0 N--CA 1.449 -0.517 0 O-C-N 121.506 -0.746 . . . . 2.57 110.513 178.547 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 6.2 mt -57.18 -50.57 72.43 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 120.921 0.391 . . . . 2.28 110.294 171.122 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 14.7 ttpt -60.76 -16.06 36.21 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 126.04 1.736 . . . . 4.26 112.441 178.694 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 69.6 m-85 -130.97 49.28 2.34 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.009 0.924 . . . . 6.31 110.354 170.089 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 68.3 t80 -85.77 -76.88 0.32 Allowed 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 124.419 1.088 . . . . 3.45 110.716 -178.214 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.432 HD11 ' CZ ' ' A' ' 30' ' ' PHE . 90.9 mt -61.15 -9.09 4.14 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 113.171 0.804 . . . . 2.52 113.171 -176.643 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 80.8 mm-40 -47.96 -61.97 1.7 Allowed 'General case' 0 N--CA 1.452 -0.353 0 O-C-N 121.492 -0.755 . . . . 1.65 110.346 168.617 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -83.79 48.01 1.38 Allowed 'General case' 0 CA--C 1.537 0.448 0 O-C-N 121.22 -0.925 . . . . 3.83 110.252 -177.267 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -153.12 -58.21 0.13 Allowed 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.165 0.986 . . . . 3.11 108.352 -167.712 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -108.55 -37.24 5.99 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 126.176 1.79 . . . . 3.76 109.904 175.291 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 1.4 p 78.81 107.8 0.07 Allowed 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 125.154 1.381 . . . . 3.24 108.734 -172.984 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 72.81 48.83 19.97 Favored Glycine 0 CA--C 1.527 0.8 0 N-CA-C 110.323 -1.111 . . . . 1.4 110.323 -176.118 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -79.11 -146.9 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.758 0.823 . . . . 1.45 109.795 173.68 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 7.2 tpt180 -102.7 -30.91 10.61 Favored 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 113.317 0.858 . . . . 3.53 113.317 -171.249 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -31.02 -33.19 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 129.717 3.207 . . . . 3.75 115.907 -175.302 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.409 ' H ' HD22 ' A' ' 78' ' ' LEU . 0.3 OUTLIER -39.94 -46.05 1.98 Allowed 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.727 1.211 . . . . 1.36 110.856 171.636 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 7.3 m -72.17 125.64 27.81 Favored 'General case' 0 C--N 1.343 0.311 0 C-N-CA 119.541 -0.864 . . . . 0.85 110.936 176.136 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -69.33 -38.52 78.23 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-O 118.086 -0.959 . . . . 2.9 111.738 177.904 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 19.1 m -48.47 -69.73 0.11 Allowed 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 119.768 1.167 . . . . 1.15 111.365 168.458 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -48.84 -45.46 40.69 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 123.757 0.823 . . . . 3.29 110.524 -176.514 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 1.2 m -60.31 -49.88 75.86 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 121.693 0.759 . . . . 1.05 110.276 177.043 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 24.2 ttpp -64.76 -29.8 70.78 Favored 'General case' 0 N--CA 1.439 -0.997 0 CA-C-N 115.966 -0.561 . . . . 4.73 110.696 -173.432 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 9.5 m -56.7 -33.75 66.77 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 119.476 1.034 . . . . 1.34 112.083 169.615 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.2 tt -71.68 -61.76 1.66 Allowed 'General case' 0 C--O 1.236 0.356 0 N-CA-C 108.25 -1.018 . . . . 2.58 108.25 169.832 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 2.1 ttm -46.11 -53.71 9.85 Favored 'General case' 0 C--O 1.221 -0.414 0 C-N-CA 123.335 0.654 . . . . 2.86 111.105 -174.003 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -42.96 -37.85 2.02 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 127.579 2.351 . . . . 0.81 113.34 179.92 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -97.62 -44.78 6.64 Favored 'General case' 0 C--O 1.227 -0.103 0 CA-C-O 120.897 0.38 . . . . 0.62 110.676 -175.746 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -53.9 -43.09 69.41 Favored 'General case' 0 N--CA 1.456 -0.15 0 C-N-CA 123.863 0.865 . . . . 0.55 110.926 176.792 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -73.72 72.84 1.51 Allowed 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 124.772 1.229 . . . . 1.18 109.541 -178.749 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 48.8 p-10 -77.17 51.83 0.86 Allowed 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.752 1.221 . . . . 2.76 112.313 -172.68 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 31.9 p30 -163.29 -46.26 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 126.281 1.833 . . . . 3.7 109.847 -175.017 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 99.98 55.05 1.01 Allowed Glycine 0 CA--C 1.525 0.699 0 N-CA-C 110.183 -1.167 . . . . 0.72 110.183 173.739 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -123.84 -46.97 1.95 Allowed 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 126.33 1.852 . . . . 2.35 109.918 175.01 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 123.5 -36.64 2.97 Favored Glycine 0 CA--C 1.529 0.953 0 C-N-CA 125.436 1.493 . . . . 0.66 111.342 178.042 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 39.9 mmtt -71.8 128.86 37.11 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 108.501 -0.926 . . . . 6.11 108.501 177.875 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 23.0 mt -119.39 116.31 50.4 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.253 0 C-N-CA 124.256 1.022 . . . . 0.73 108.644 -173.916 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -81.28 167.45 49.19 Favored Glycine 0 CA--C 1.528 0.878 0 N-CA-C 110.863 -0.895 . . . . 0.48 110.863 174.072 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -57.99 -37.81 74.94 Favored 'General case' 0 C--O 1.224 -0.28 0 N-CA-C 109.572 -0.529 . . . . 0.6 109.572 172.737 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 60.2 mt-10 -56.65 -67.08 0.34 Allowed 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 124.064 0.946 . . . . 2.94 109.49 175.013 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -40.04 -50.07 2.56 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.142 0.977 . . . . 1.38 111.393 175.551 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -66.89 -55.45 14.66 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 112.01 0.374 . . . . 2.91 112.01 -176.371 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 10.8 tt0 -53.58 -44.43 69.33 Favored 'General case' 0 C--O 1.221 -0.41 0 C-N-CA 124.212 1.005 . . . . 2.08 109.28 178.826 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -50.86 -62.46 1.59 Allowed 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 119.266 0.939 . . . . 3.98 110.426 173.721 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.03 -42.6 94.72 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 120.726 -0.389 . . . . 3.17 110.9 -173.67 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 57.2 t -58.85 -48.63 85.68 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.327 0 C-N-CA 124.103 0.961 . . . . 1.28 111.3 176.171 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 50.5 t-80 -72.81 -18.19 61.49 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 125.445 1.498 . . . . 2.44 110.834 -170.761 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 22.9 t . . . . . 0 C--O 1.254 1.332 0 CA-C-O 114.989 -2.434 . . . . 2.58 113.41 -179.856 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.637 HG22 HG12 ' A' ' 47' ' ' VAL . 1.5 pp . . . . . 0 CA--C 1.532 0.278 0 CA-C-O 121.803 0.811 . . . . 1.4 111.514 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 10.2 t -69.03 -7.03 31.8 Favored 'General case' 0 N--CA 1.426 -1.653 0 C-N-CA 126.284 1.834 . . . . 1.79 111.662 -175.242 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 52.1 t0 -148.08 60.63 1.11 Allowed 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 108.026 -1.102 . . . . 2.64 108.026 -179.474 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 3.1 p -145.38 -48.71 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.192 0 C-N-CA 123.842 0.857 . . . . 1.8 110.477 174.945 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -178.78 -48.83 0.01 OUTLIER 'General case' 0 CA--C 1.528 0.12 0 C-N-CA 126.121 1.768 . . . . 1.36 106.536 -175.267 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 2.3 m -50.94 -24.02 3.31 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 115.67 1.729 . . . . 0.94 115.67 -170.858 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -53.98 -41.51 67.96 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 119.543 1.065 . . . . 0.71 112.273 172.124 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -74.4 -36.89 63.52 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 121.391 0.615 . . . . 1.97 109.931 178.546 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -56.26 -52.84 63.0 Favored 'General case' 0 C--O 1.234 0.263 0 C-N-CA 124.253 1.021 . . . . 2.84 108.277 179.18 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 34.0 pt -63.14 -39.99 87.35 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.401 0 CA-C-N 115.087 -0.96 . . . . 0.9 110.153 -177.278 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -52.43 -45.8 66.14 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 118.999 0.818 . . . . 0.9 110.971 175.645 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.58 -59.6 5.19 Favored 'General case' 0 CA--C 1.533 0.322 0 O-C-N 122.144 -0.347 . . . . 0.79 110.949 174.06 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -47.83 -44.3 28.77 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 124.055 0.942 . . . . 0.67 111.933 -179.488 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -55.23 -37.04 66.66 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 125.058 1.343 . . . . 3.39 110.831 -179.146 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -87.55 -42.73 12.54 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 122.478 0.311 . . . . 5.2 110.368 -178.869 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -68.36 -36.99 80.03 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 118.073 0.397 . . . . 2.5 110.878 -174.189 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 39.5 m -116.83 69.05 0.75 Allowed 'General case' 0 C--N 1.339 0.119 0 C-N-CA 124.573 1.149 . . . . 1.44 108.445 172.634 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 48.8 ttt180 -88.71 -55.19 3.81 Favored 'General case' 0 N--CA 1.456 -0.151 0 N-CA-C 109.352 -0.611 . . . . 5.3 109.352 -179.247 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.419 ' O ' ' NH2' ' A' ' 76' ' ' ARG . 0.1 OUTLIER -60.53 138.03 92.59 Favored Pre-proline 0 C--O 1.224 -0.253 0 C-N-CA 124.43 1.092 . . . . 3.25 110.167 175.935 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -71.81 148.44 52.19 Favored 'Trans proline' 0 N--CA 1.458 -0.608 0 C-N-CA 123.462 2.775 . . . . 2.32 111.294 -176.683 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.4 t70 82.83 4.14 1.01 Allowed 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 127.396 2.278 . . . . 2.45 111.27 179.176 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 18.2 m -87.13 -7.28 58.17 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.621 1.168 . . . . 0.78 112.935 -177.89 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -86.09 82.97 7.88 Favored 'General case' 0 CA--C 1.534 0.356 0 O-C-N 120.041 -1.662 . . . . 2.99 113.196 -155.594 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -65.31 139.93 97.62 Favored Pre-proline 0 CA--C 1.534 0.364 0 O-C-N 121.64 -0.662 . . . . 2.19 110.364 175.0 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -68.06 -63.18 0.05 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.17 0 C-N-CA 122.605 2.204 . . . . 0.83 111.53 -176.263 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -53.94 -42.63 69.04 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 124.21 1.004 . . . . 2.7 110.88 179.446 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -54.32 -61.56 2.23 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 123.052 0.541 . . . . 4.51 109.714 174.858 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 8.4 t80 -53.72 -53.88 45.85 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-O 122.252 1.025 . . . . 2.16 110.839 -177.238 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.548 ' CE1' ' HA ' ' A' ' 107' ' ' VAL . 2.7 t80 -40.0 -56.32 1.87 Allowed 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.275 1.43 . . . . 4.77 111.81 175.2 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -70.55 -41.51 72.37 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 123.55 0.74 . . . . 2.59 110.27 -179.457 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.2 t -63.86 -38.38 90.88 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 118.403 0.547 . . . . 1.46 110.926 -170.512 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 38.5 m -60.33 -57.09 14.26 Favored 'General case' 0 N--CA 1.443 -0.789 0 N-CA-C 107.656 -1.239 . . . . 3.33 107.656 170.777 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 116.92 21.13 4.67 Favored Glycine 0 CA--C 1.525 0.708 0 N-CA-C 110.266 -1.134 . . . . 1.5 110.266 -172.896 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 1.8 mt -65.72 -24.6 67.02 Favored 'General case' 0 N--CA 1.451 -0.4 0 O-C-N 121.199 -1.177 . . . . 1.89 109.587 176.203 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.406 ' HB2' ' CZ ' ' A' ' 31' ' ' PHE . 21.5 t -63.49 -18.6 63.97 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.196 0.598 . . . . 2.43 110.4 173.07 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.24 -27.41 16.17 Favored 'General case' 0 N--CA 1.447 -0.585 0 O-C-N 121.665 -0.647 . . . . 5.52 110.0 176.814 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 27.4 mmt -69.11 134.23 49.06 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 121.425 0.631 . . . . 3.58 111.231 176.189 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 73.8 m -65.6 151.28 46.84 Favored 'General case' 0 N--CA 1.452 -0.326 0 O-C-N 121.876 -0.515 . . . . 1.63 110.715 175.892 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -39.25 -41.2 0.85 Allowed 'General case' 0 C--O 1.224 -0.241 0 C-N-CA 125.595 1.558 . . . . 0.51 111.998 172.488 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 65.6 m-20 -50.13 -59.83 3.54 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 124.049 0.94 . . . . 1.44 110.744 175.864 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -72.11 -35.03 69.06 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 109.181 -0.674 . . . . 3.51 109.181 -173.357 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 79.0 t -59.64 -43.04 90.3 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 O-C-N 121.584 -0.698 . . . . 0.46 109.869 174.084 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 60.6 tttt -69.5 -42.02 75.29 Favored 'General case' 0 CA--C 1.536 0.417 0 O-C-N 120.809 -1.182 . . . . 2.55 110.573 178.961 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -50.82 -61.41 2.23 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.33 0.652 . . . . 3.22 110.349 171.475 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.637 HG12 HG22 ' A' ' 3' ' ' ILE . 18.0 m -54.85 -46.99 75.67 Favored 'Isoleucine or valine' 0 C--N 1.34 0.178 0 CA-C-O 118.214 -0.898 . . . . 0.5 110.821 178.499 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 25.6 t80 -43.99 -52.72 6.81 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 119.127 0.876 . . . . 4.34 111.175 174.704 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 78.2 mtp180 -60.55 -37.38 81.04 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 120.499 -0.481 . . . . 3.4 111.451 179.569 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 11.5 t80 -64.64 -34.19 77.71 Favored 'General case' 0 CA--C 1.534 0.348 0 O-C-N 122.274 -0.266 . . . . 3.94 110.479 175.837 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.445 HG22 HD21 ' A' ' 59' ' ' LEU . 6.4 mm -68.58 -53.4 27.87 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 N-CA-C 109.909 -0.404 . . . . 1.42 109.909 175.503 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -78.06 60.6 2.43 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.754 0.822 . . . . 2.15 111.507 -172.026 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -52.05 -32.32 33.95 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 126.916 2.086 . . . . 1.97 113.334 -172.466 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 11.3 p-10 -72.25 -33.46 67.51 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.813 1.245 . . . . 2.57 111.728 178.278 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . 0.279 0.8 OUTLIER 75.33 22.18 1.73 Allowed 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 127.166 2.187 . . . . 4.77 114.698 -179.616 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 99.3 p -50.2 -29.13 8.7 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 120.039 1.291 . . . . 1.74 112.467 173.851 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 107.59 -24.99 22.66 Favored Glycine 0 C--N 1.338 0.681 0 N-CA-C 109.335 -1.506 . . . . 1.47 109.335 -172.595 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 96.8 m-85 -115.35 135.04 54.55 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 124.274 1.03 . . . . 2.53 108.813 -179.63 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.445 HD21 HG22 ' A' ' 51' ' ' ILE . 6.6 mt -71.72 75.7 0.84 Allowed 'General case' 0 N--CA 1.448 -0.552 0 N-CA-C 106.896 -1.52 . . . . 2.69 106.896 160.318 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -66.02 160.77 23.0 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 108.635 -0.876 . . . . 2.86 108.635 172.63 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -52.38 -39.01 60.28 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.91 0.884 . . . . 3.8 113.269 -170.199 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -66.2 -49.8 66.06 Favored 'General case' 0 N--CA 1.453 -0.31 0 O-C-N 121.714 -0.616 . . . . 3.49 110.293 -175.517 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -61.25 -31.76 71.56 Favored 'General case' 0 C--N 1.329 -0.317 0 O-C-N 121.25 -0.907 . . . . 3.02 110.816 174.08 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -53.78 -36.58 62.57 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 117.867 0.303 . . . . 2.44 111.558 168.996 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 33.0 ttpt -61.53 -9.18 5.28 Favored 'General case' 0 CA--C 1.54 0.564 0 O-C-N 121.292 -0.88 . . . . 2.31 112.487 173.612 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 76.8 m-85 -128.56 28.63 5.39 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 124.301 1.04 . . . . 4.43 111.424 171.43 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -59.08 -62.85 1.58 Allowed 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 118.652 0.66 . . . . 3.46 109.856 -177.031 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 47.1 mt -92.44 -9.42 41.64 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.442 0.697 . . . . 3.03 112.14 -178.249 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 43.9 mm-40 -54.19 -33.42 58.12 Favored 'General case' 0 N--CA 1.463 0.193 0 O-C-N 121.514 -0.741 . . . . 1.64 110.989 171.423 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.45 -28.69 63.56 Favored 'General case' 0 CA--C 1.533 0.311 0 O-C-N 122.155 -0.341 . . . . 3.24 111.294 176.376 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 4.4 m-30 -85.82 -58.59 2.59 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 108.501 -0.925 . . . . 3.12 108.501 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -140.73 127.85 20.87 Favored 'General case' 0 C--N 1.34 0.174 0 N-CA-C 109.141 -0.688 . . . . 3.34 109.141 -171.302 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 5.9 p -55.33 -27.1 44.84 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 123.973 0.909 . . . . 3.02 112.269 -179.096 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -106.1 22.84 30.47 Favored Glycine 0 CA--C 1.526 0.722 0 CA-C-O 118.54 -1.144 . . . . 1.84 112.04 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -54.48 -68.29 0.2 Allowed 'General case' 0 C--N 1.343 0.289 0 CA-C-N 118.805 1.303 . . . . 3.44 111.819 -174.12 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' ARG . . . . . 0.419 ' NH2' ' O ' ' A' ' 21' ' ' ASP . 1.2 tpt180 -173.52 -47.73 0.01 OUTLIER 'General case' 0 C--N 1.339 0.136 0 N-CA-C 112.735 0.643 . . . . 3.2 112.735 178.7 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -39.71 -31.31 0.1 Allowed 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 129.191 2.996 . . . . 3.7 114.598 -163.135 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.409 ' H ' HD22 ' A' ' 78' ' ' LEU . 0.3 OUTLIER -31.03 -51.95 0.17 Allowed 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 126.353 1.861 . . . . 1.36 112.158 165.322 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -82.89 121.78 27.4 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 122.91 0.484 . . . . 2.7 110.304 178.576 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -55.62 -31.03 61.93 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 116.215 -0.448 . . . . 3.17 111.617 176.414 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 7.9 t -58.58 -60.58 3.59 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 108.711 -0.848 . . . . 1.28 108.711 -176.659 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -65.42 -41.88 93.11 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 122.799 0.44 . . . . 2.92 110.216 -174.315 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 1.2 m -49.01 -52.1 27.04 Favored 'General case' 0 C--N 1.344 0.333 0 N-CA-C 109.709 -0.478 . . . . 0.98 109.709 169.816 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 51.5 mtmt -70.37 -29.1 65.67 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-O 118.311 -0.852 . . . . 4.63 112.729 -178.779 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 10.8 m -57.6 -46.41 84.1 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 120.783 1.628 . . . . 1.98 110.085 168.691 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -60.48 -57.39 12.96 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 109.202 -0.666 . . . . 2.2 109.202 175.271 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 17.0 ttp -47.78 -52.51 18.47 Favored 'General case' 0 C--O 1.225 -0.224 0 C-N-CA 124.026 0.93 . . . . 3.09 111.477 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -51.89 -44.27 63.67 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 126.407 1.883 . . . . 0.65 111.524 -172.01 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -80.58 -52.49 7.54 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-O 119.619 -0.229 . . . . 0.68 110.595 175.964 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -48.54 -44.6 36.55 Favored 'General case' 0 C--N 1.339 0.122 0 C-N-CA 123.876 0.87 . . . . 0.47 111.858 -175.682 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -72.72 80.39 1.12 Allowed 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 109.286 -0.635 . . . . 0.93 109.286 177.624 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 45.3 p-10 -76.97 50.4 0.72 Allowed 'General case' 0 CA--C 1.537 0.457 0 O-C-N 121.399 -0.813 . . . . 2.58 110.972 176.095 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 37.5 m-20 -137.01 -61.63 0.66 Allowed 'General case' 0 C--N 1.341 0.214 0 C-N-CA 126.381 1.872 . . . . 1.46 109.412 178.398 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 105.04 45.8 1.33 Allowed Glycine 0 CA--C 1.534 1.247 0 C-N-CA 125.263 1.411 . . . . 1.01 110.339 -161.618 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -127.18 -57.69 1.3 Allowed 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 125.359 1.464 . . . . 2.16 110.554 172.696 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 123.5 -25.19 6.32 Favored Glycine 0 CA--C 1.531 1.056 0 C-N-CA 124.83 1.205 . . . . 0.66 111.734 176.505 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 19.1 mtpp -78.98 112.83 16.57 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 106.459 -1.682 . . . . 4.1 106.459 175.824 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 5.9 mt -100.15 140.76 18.52 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.292 0 N-CA-C 107.95 -1.13 . . . . 0.72 107.95 -175.723 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -114.45 177.41 17.56 Favored Glycine 0 C--N 1.334 0.418 0 N-CA-C 110.82 -0.912 . . . . 0.61 110.82 176.952 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -61.17 -39.07 88.76 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 109.511 -0.551 . . . . 0.65 109.511 176.564 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -55.91 -63.71 1.09 Allowed 'General case' 0 N--CA 1.449 -0.509 0 O-C-N 123.536 0.523 . . . . 2.3 109.987 173.432 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -49.1 -47.77 44.94 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.012 0.925 . . . . 2.2 110.837 -179.718 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 58.2 t80 -62.16 -55.86 24.55 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 123.114 0.565 . . . . 4.28 111.162 -179.088 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 14.2 tt0 -52.58 -42.42 64.48 Favored 'General case' 0 C--O 1.219 -0.544 0 C-N-CA 123.558 0.743 . . . . 2.56 109.379 175.542 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -53.02 -57.32 10.76 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 124.16 0.984 . . . . 3.96 110.093 178.438 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -55.19 -51.59 66.05 Favored 'General case' 0 C--O 1.23 0.071 0 CA-C-O 121.493 0.663 . . . . 3.36 109.499 175.564 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 107' ' ' VAL . . . . . 0.548 ' HA ' ' CE1' ' A' ' 31' ' ' PHE . 92.2 t -73.03 -5.97 7.34 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 CA-C-N 115.533 -0.758 . . . . 1.47 112.978 -172.369 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 78.8 t60 -91.41 -8.63 47.35 Favored 'General case' 0 CA--C 1.536 0.436 0 O-C-N 120.721 -1.237 . . . . 3.02 110.421 174.096 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 21.1 t . . . . . 0 C--O 1.252 1.208 0 CA-C-O 114.39 -2.719 . . . . 2.37 113.91 -168.89 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.473 HG21 HG12 ' A' ' 47' ' ' VAL . 1.6 pp . . . . . 0 CA--C 1.537 0.459 0 CA-C-O 121.247 0.546 . . . . 1.82 110.469 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 1.5 t -86.41 53.43 2.8 Favored 'General case' 0 N--CA 1.44 -0.942 0 C-N-CA 126.202 1.801 . . . . 3.09 108.094 -168.77 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -174.65 -56.51 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.144 0 N-CA-C 107.494 -1.298 . . . . 4.55 107.494 -170.595 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 13.9 t -46.97 -40.67 5.15 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.236 0 C-N-CA 126.081 1.752 . . . . 1.59 110.942 -175.914 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.578 HD23 ' CE ' ' A' ' 39' ' ' MET . 4.5 tp -164.62 -55.1 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 105.823 -1.917 . . . . 1.51 105.823 175.381 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -52.09 -15.96 0.68 Allowed 'General case' 0 N--CA 1.445 -0.69 0 N-CA-C 115.482 1.66 . . . . 0.81 115.482 -168.118 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -50.72 -49.39 57.79 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 120.63 1.559 . . . . 0.81 111.36 168.179 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -64.55 -40.33 95.39 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-O 122.462 1.125 . . . . 2.22 109.753 -178.739 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -67.5 -49.57 62.87 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-N 115.395 -0.82 . . . . 2.67 109.247 -175.705 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 19.1 pt -60.1 -40.78 84.33 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.802 0 O-C-N 121.634 -0.666 . . . . 0.76 110.764 174.972 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -54.28 -47.8 71.94 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 119.179 0.899 . . . . 0.78 111.019 174.302 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.45 -58.49 8.37 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 121.861 -0.524 . . . . 0.74 110.739 174.583 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.459 ' HB2' ' CG2' ' A' ' 33' ' ' THR . . . -46.91 -47.06 21.62 Favored 'General case' 0 C--O 1.232 0.165 0 C-N-CA 126.81 2.044 . . . . 0.72 111.736 -178.322 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -55.75 -41.7 74.33 Favored 'General case' 0 N--CA 1.445 -0.709 0 C-N-CA 125.751 1.621 . . . . 2.72 108.883 -179.121 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 17.1 tt0 -83.06 -50.95 7.98 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 108.991 -0.744 . . . . 2.91 108.991 -175.093 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.9 pp20? -61.88 -34.55 76.22 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 115.835 -0.62 . . . . 2.3 110.937 -170.849 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 96.6 m -121.39 67.04 0.88 Allowed 'General case' 0 C--O 1.235 0.305 0 C-N-CA 123.802 0.841 . . . . 2.07 109.189 168.238 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 16.6 ttp180 -84.23 -3.07 57.95 Favored 'General case' 0 N--CA 1.469 0.491 0 O-C-N 121.102 -0.999 . . . . 4.28 112.908 174.809 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -113.28 152.17 44.94 Favored Pre-proline 0 CA--C 1.537 0.464 0 C-N-CA 123.798 0.839 . . . . 2.69 112.064 -162.961 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -63.67 123.83 12.66 Favored 'Trans proline' 0 N--CA 1.453 -0.894 0 C-N-CA 122.891 2.394 . . . . 1.28 111.21 -169.549 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.9 t0 67.78 19.0 9.71 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 125.328 1.451 . . . . 3.26 112.336 173.654 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 26.6 m -83.14 -16.62 46.03 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.318 1.047 . . . . 0.94 111.784 176.986 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' PHE . . . . . 0.416 ' HZ ' ' HB1' ' A' ' 15' ' ' ALA . 0.1 OUTLIER -94.53 98.36 10.78 Favored 'General case' 0 CA--C 1.539 0.538 0 O-C-N 121.922 -0.486 . . . . 4.06 111.116 -155.87 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -78.8 155.61 77.94 Favored Pre-proline 0 CA--C 1.535 0.381 0 O-C-N 121.725 -0.61 . . . . 2.81 110.667 -179.073 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -71.28 -61.2 0.05 OUTLIER 'Trans proline' 0 N--CA 1.45 -1.072 0 C-N-CA 122.595 2.197 . . . . 0.77 111.666 -176.632 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 -59.39 -38.06 79.55 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 118.317 0.508 . . . . 2.46 110.646 -179.212 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 1.1 tptp -55.09 -62.55 1.59 Allowed 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 109.635 -0.506 . . . . 4.12 109.635 170.7 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -53.74 -55.25 27.97 Favored 'General case' 0 C--O 1.218 -0.555 0 C-N-CA 124.335 1.054 . . . . 2.43 109.947 -174.845 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.466 ' CE1' ' HA ' ' A' ' 107' ' ' VAL . 3.4 t80 -33.03 -66.71 0.13 Allowed 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 128.774 2.83 . . . . 4.76 112.4 176.47 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 24.6 mt-30 -61.22 -46.31 90.96 Favored 'General case' 0 C--O 1.226 -0.16 0 N-CA-C 109.574 -0.528 . . . . 3.06 109.574 179.668 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.459 ' CG2' ' HB2' ' A' ' 15' ' ' ALA . 0.7 OUTLIER -59.08 -30.5 68.12 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 113.239 0.829 . . . . 0.67 113.239 -178.411 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 23.6 t -84.06 -2.67 57.13 Favored 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 125.082 1.353 . . . . 1.46 109.961 179.932 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 79.68 2.59 88.33 Favored Glycine 0 C--N 1.337 0.633 0 N-CA-C 110.728 -0.949 . . . . 0.68 110.728 174.726 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.438 ' HB3' HG13 ' A' ' 107' ' ' VAL . 96.0 mt -68.06 -22.08 64.96 Favored 'General case' 0 N--CA 1.442 -0.833 0 O-C-N 121.507 -0.996 . . . . 1.39 110.941 -172.338 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 13.9 t -71.49 -28.03 63.63 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 123.716 0.806 . . . . 2.15 109.871 172.697 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 12.9 tttt -84.56 -36.49 22.09 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 124.012 0.925 . . . . 4.31 108.899 -179.642 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.578 ' CE ' HD23 ' A' ' 7' ' ' LEU . 0.0 OUTLIER -55.69 128.51 35.13 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 121.228 0.537 . . . . 2.55 110.139 176.02 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 28.8 t -64.11 154.69 33.78 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 109.152 -0.684 . . . . 2.34 109.152 176.457 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -40.21 -43.45 1.68 Allowed 'General case' 0 C--N 1.34 0.174 0 C-N-CA 124.654 1.182 . . . . 1.06 111.368 173.396 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 50.6 m-80 -45.92 -64.11 0.82 Allowed 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.617 1.167 . . . . 2.35 110.764 172.874 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' GLN . . . . . 0.652 ' O ' HG13 ' A' ' 47' ' ' VAL . 46.2 mt-30 -64.71 -39.35 93.5 Favored 'General case' 0 C--O 1.219 -0.504 0 C-N-CA 124.028 0.931 . . . . 3.48 110.555 -176.803 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.434 HG13 HG11 ' A' ' 107' ' ' VAL . 75.6 t -61.73 -46.45 96.5 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 CA-C-N 119.592 1.087 . . . . 0.55 110.007 179.613 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 12.3 tttt -63.26 -36.48 83.81 Favored 'General case' 0 CA--C 1.535 0.382 0 O-C-N 121.834 -0.541 . . . . 3.08 109.983 177.312 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -62.03 -52.44 63.95 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 122.555 0.342 . . . . 3.12 111.081 174.003 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.652 HG13 ' O ' ' A' ' 43' ' ' GLN . 1.5 m -57.41 -47.37 84.91 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.306 0 O-C-N 121.563 -0.711 . . . . 1.36 109.275 -179.526 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.541 ' CZ ' ' HB2' ' A' ' 100' ' ' ALA . 40.6 t80 -43.41 -58.86 2.38 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.285 1.034 . . . . 4.54 111.159 171.116 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 67.7 mtp180 -63.99 -36.31 83.57 Favored 'General case' 0 N--CA 1.465 0.312 0 O-C-N 121.558 -0.714 . . . . 3.29 112.867 178.626 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -55.49 -44.8 76.87 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 118.822 0.737 . . . . 3.59 109.556 175.976 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.494 HD11 ' CE1' ' A' ' 71' ' ' PHE . 3.1 mp -70.53 -48.07 61.35 Favored 'Isoleucine or valine' 0 C--O 1.236 0.357 0 CA-C-O 117.914 -1.041 . . . . 1.97 112.01 176.791 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 26.4 t0 -70.29 68.4 0.34 Allowed 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 123.537 0.735 . . . . 1.9 110.453 -178.04 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 20.1 t30 -56.53 -41.17 76.33 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 126.794 2.038 . . . . 2.16 110.976 -177.341 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -67.61 -14.65 63.13 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.273 1.029 . . . . 2.29 112.116 175.433 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 8.9 mt-30 49.36 57.44 6.48 Favored 'General case' 0 C--N 1.341 0.205 0 C-N-CA 125.223 1.409 . . . . 2.84 110.342 -179.195 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 95.9 p -89.86 -18.74 25.62 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 115.434 -0.803 . . . . 1.55 110.314 176.242 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 80.96 19.9 66.46 Favored Glycine 0 CA--C 1.529 0.941 0 N-CA-C 110.652 -0.979 . . . . 1.35 110.652 -169.532 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 77.0 m-85 -145.49 131.5 19.26 Favored 'General case' 0 CA--C 1.515 -0.389 0 C-N-CA 123.982 0.913 . . . . 2.14 109.336 179.26 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.487 HD23 ' CE1' ' A' ' 48' ' ' PHE . 0.4 OUTLIER -77.89 81.04 4.32 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 104.618 -2.364 . . . . 1.88 104.618 160.672 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -67.8 166.86 14.54 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 114.098 -1.41 . . . . 2.63 108.176 168.596 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -53.22 -48.1 68.44 Favored 'General case' 0 N--CA 1.452 -0.338 0 O-C-N 121.286 -0.884 . . . . 3.89 112.332 -172.394 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.58 -39.34 80.07 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 111.646 0.239 . . . . 4.77 111.646 -172.09 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -53.03 -36.96 61.11 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 118.692 0.678 . . . . 2.38 112.386 173.333 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 25.4 mt -67.46 -29.23 68.63 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 118.187 0.449 . . . . 2.34 110.204 176.816 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 27.5 ttpt -69.31 -2.39 10.63 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 118.515 -0.755 . . . . 2.5 111.306 170.172 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 17.1 p90 -148.26 44.01 1.04 Allowed 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 119.96 1.255 . . . . 5.15 113.97 166.59 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 50.8 t80 -71.99 -68.54 0.45 Allowed 'General case' 0 CA--C 1.538 0.499 0 O-C-N 120.894 -1.129 . . . . 2.28 110.393 -172.154 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 3.0 mp -73.38 -9.99 59.27 Favored 'General case' 0 C--O 1.234 0.242 0 C-N-CA 124.437 1.095 . . . . 2.05 112.33 173.863 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.66 -26.27 61.41 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 119.007 0.821 . . . . 2.64 111.326 178.622 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -92.47 -17.03 25.07 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.473 1.109 . . . . 2.67 111.061 178.631 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.494 ' CE1' HD11 ' A' ' 51' ' ' ILE . 9.9 m-30 -82.05 -69.43 0.62 Allowed 'General case' 0 C--O 1.224 -0.275 0 N-CA-C 107.496 -1.298 . . . . 3.13 107.496 175.256 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 25.9 tp10 -97.79 -49.44 4.82 Favored 'General case' 0 C--O 1.227 -0.094 0 C-N-CA 123.451 0.7 . . . . 3.42 109.148 -173.486 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 82.62 109.12 0.06 Allowed 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 124.751 1.22 . . . . 3.17 110.161 -172.417 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 93.58 32.53 7.62 Favored Glycine 0 CA--C 1.53 0.984 0 C-N-CA 124.541 1.067 . . . . 1.3 111.123 -174.933 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -85.92 -156.39 0.28 Allowed 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 123.922 0.889 . . . . 1.46 109.34 171.088 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.25 1.07 55.32 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 113.685 0.995 . . . . 3.52 113.685 -164.232 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -42.5 -37.41 1.62 Allowed 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 126.711 2.004 . . . . 2.86 113.443 -168.07 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.823 ' H ' HD22 ' A' ' 78' ' ' LEU . 0.2 OUTLIER -57.97 -45.47 86.67 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.24 1.416 . . . . 0.98 112.017 177.094 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 88.2 m -64.0 108.32 1.48 Allowed 'General case' 0 C--O 1.235 0.319 0 C-N-CA 124.064 0.946 . . . . 0.81 110.679 -179.434 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 8.5 mp0 -69.24 -38.83 78.67 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-N 114.644 -1.162 . . . . 3.44 110.572 -173.516 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 16.0 m -51.2 -52.61 42.71 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 119.455 1.025 . . . . 1.32 111.172 176.692 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 18.4 tt0 -67.3 -48.81 66.54 Favored 'General case' 0 N--CA 1.446 -0.643 0 C-N-CA 124.084 0.954 . . . . 4.33 109.709 -176.064 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -52.87 -46.22 67.78 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 122.164 0.983 . . . . 0.72 108.938 178.089 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 17.1 tttt -69.73 -33.6 72.69 Favored 'General case' 0 N--CA 1.444 -0.766 0 C-N-CA 125.55 1.54 . . . . 4.24 111.316 -179.545 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.6 t -58.73 -48.11 82.29 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 119.71 1.141 . . . . 1.64 109.145 172.464 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -57.16 -55.43 34.9 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 108.905 -0.776 . . . . 2.38 108.905 173.984 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 5.9 ttt -47.39 -47.0 26.48 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 112.341 0.497 . . . . 3.85 112.341 177.151 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -60.19 -46.12 90.82 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 125.592 1.557 . . . . 0.49 111.193 -169.912 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -84.84 -33.56 22.86 Favored 'General case' 0 C--O 1.227 -0.11 0 N-CA-C 111.776 0.287 . . . . 0.71 111.776 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -63.63 -39.19 93.72 Favored 'General case' 0 N--CA 1.456 -0.15 0 CA-C-N 117.982 0.356 . . . . 0.38 111.114 176.362 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 24.0 t0 -67.26 117.46 9.29 Favored 'General case' 0 N--CA 1.446 -0.651 0 N-CA-C 108.808 -0.812 . . . . 1.69 108.808 176.806 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 9.7 m-20 -100.1 10.76 40.76 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 118.649 -0.691 . . . . 2.72 111.369 178.51 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 25.9 m-20 -103.62 -56.25 2.24 Favored 'General case' 0 C--N 1.343 0.301 0 CA-C-N 119.017 0.826 . . . . 1.38 111.004 175.089 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 99.57 48.47 1.66 Allowed Glycine 0 CA--C 1.53 1.023 0 N-CA-C 108.751 -1.74 . . . . 0.94 108.751 -156.604 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 58.6 p-10 -128.97 -48.65 1.22 Allowed 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 127.119 2.168 . . . . 2.01 109.815 177.705 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 127.55 -66.01 0.57 Allowed Glycine 0 CA--C 1.523 0.585 0 C-N-CA 126.862 2.172 . . . . 1.27 108.129 -177.791 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 60.6 pttt -48.35 135.24 14.01 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.368 1.067 . . . . 4.49 111.233 -178.863 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 4.1 mt -117.76 108.28 24.19 Favored 'Isoleucine or valine' 0 C--O 1.232 0.176 0 C-N-CA 124.54 1.136 . . . . 0.82 109.41 -173.351 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -68.7 168.24 43.68 Favored Glycine 0 CA--C 1.534 1.25 0 N-CA-C 111.572 -0.611 . . . . 0.79 111.572 171.025 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 100' ' ' ALA . . . . . 0.541 ' HB2' ' CZ ' ' A' ' 48' ' ' PHE . . . -62.39 -38.34 89.25 Favored 'General case' 0 C--N 1.34 0.192 0 O-C-N 121.569 -0.959 . . . . 0.88 109.893 175.375 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -53.48 -54.88 30.77 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 123.25 0.62 . . . . 2.47 110.208 172.751 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -55.46 -50.92 68.6 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.254 0.621 . . . . 1.3 111.011 178.743 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 77.5 t80 -57.12 -57.13 13.91 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.389 -0.369 . . . . 3.95 110.902 -179.704 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -54.78 -44.33 73.62 Favored 'General case' 0 C--O 1.219 -0.504 0 C-N-CA 124.17 0.988 . . . . 2.19 110.122 177.765 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -52.44 -59.32 4.58 Favored 'General case' 0 CA--C 1.523 -0.068 0 CA-C-N 119.761 1.164 . . . . 3.1 110.464 176.733 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.76 -50.66 69.81 Favored 'General case' 0 CA--C 1.531 0.236 0 N-CA-C 108.39 -0.967 . . . . 2.78 108.39 -179.215 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 107' ' ' VAL . . . . . 0.466 ' HA ' ' CE1' ' A' ' 31' ' ' PHE . 85.4 t -69.53 -13.09 16.83 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.794 0 N-CA-C 113.001 0.741 . . . . 1.48 113.001 -175.784 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 41.6 t-80 -88.09 -5.12 58.63 Favored 'General case' 0 CA--C 1.539 0.555 0 O-C-N 120.43 -1.419 . . . . 2.69 110.542 175.329 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 23.0 t . . . . . 0 C--O 1.253 1.262 0 CA-C-O 115.307 -2.283 . . . . 2.45 113.275 -175.039 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.685 HG22 HG12 ' A' ' 47' ' ' VAL . 1.6 pp . . . . . 0 N--CA 1.453 -0.285 0 CA-C-O 121.649 0.738 . . . . 1.5 111.068 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.476 ' O ' ' HB2' ' A' ' 9' ' ' ALA . 16.6 p -73.67 -2.68 24.14 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 112.53 0.567 . . . . 3.4 112.53 -173.51 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -104.23 -35.03 8.15 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 118.668 0.667 . . . . 3.72 111.417 177.702 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 17.1 m -71.57 -44.73 70.01 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.246 0 N-CA-C 112.453 0.538 . . . . 2.44 112.453 -169.476 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -175.66 -58.14 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.161 0 N-CA-C 106.16 -1.793 . . . . 1.13 106.16 -172.94 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 4.9 m -44.63 -22.81 0.09 Allowed 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 127.072 2.149 . . . . 1.07 115.84 -168.625 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.476 ' HB2' ' O ' ' A' ' 4' ' ' THR . . . -47.67 -51.15 22.69 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 120.298 1.408 . . . . 0.57 112.523 168.047 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -64.6 -39.31 93.49 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-O 122.545 1.164 . . . . 1.95 109.514 -177.961 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -67.97 -45.36 74.4 Favored 'General case' 0 N--CA 1.442 -0.849 0 C-N-CA 124.463 1.105 . . . . 2.26 109.196 -174.291 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 37.7 pt -63.37 -38.06 81.17 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.803 0 O-C-N 121.458 -0.776 . . . . 0.74 110.591 174.845 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.8 -46.32 81.65 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 118.994 0.816 . . . . 0.68 110.487 173.247 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.12 -57.51 12.51 Favored 'General case' 0 CA--C 1.533 0.314 0 O-C-N 122.032 -0.417 . . . . 0.63 110.843 173.785 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -47.48 -49.07 26.53 Favored 'General case' 0 C--O 1.232 0.15 0 C-N-CA 125.577 1.551 . . . . 0.62 110.71 -178.941 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -53.22 -45.09 68.54 Favored 'General case' 0 N--CA 1.444 -0.762 0 C-N-CA 125.185 1.394 . . . . 2.8 109.731 179.638 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -79.3 -46.84 16.93 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 109.903 -0.406 . . . . 3.67 109.903 -174.187 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -63.56 -38.08 89.76 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 110.435 -0.209 . . . . 3.56 110.435 -175.542 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 85.5 m -101.81 46.54 0.93 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.717 0.807 . . . . 1.5 110.331 175.806 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 19.1 mtp85 -69.83 -52.74 22.37 Favored 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 108.499 -0.926 . . . . 4.21 108.499 173.803 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -61.95 138.26 95.62 Favored Pre-proline 0 N--CA 1.441 -0.899 0 CA-C-N 114.174 -1.375 . . . . 2.08 110.398 -175.88 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -60.46 150.99 78.14 Favored 'Trans proline' 0 N--CA 1.452 -0.955 0 C-N-CA 122.623 2.215 . . . . 1.25 110.498 -176.672 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 16.9 t70 56.85 15.93 2.5 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.502 1.521 . . . . 3.37 114.033 176.976 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 21.0 m -87.52 -12.52 45.63 Favored 'General case' 0 CA--C 1.534 0.364 0 O-C-N 121.004 -1.06 . . . . 0.99 110.789 177.842 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -73.78 117.41 15.53 Favored 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 123.791 0.836 . . . . 2.45 110.449 -171.758 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -115.21 147.1 37.77 Favored Pre-proline 0 CA--C 1.538 0.507 0 C-N-CA 125.222 1.409 . . . . 3.34 110.943 178.037 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_endo -62.71 -76.97 0.02 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.478 0 C-N-CA 124.669 3.579 . . . . 0.71 112.557 -175.645 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.4 tt0 -50.64 -45.2 57.69 Favored 'General case' 0 N--CA 1.445 -0.703 0 C-N-CA 124.886 1.274 . . . . 3.19 111.092 -175.505 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 40.4 tptt -47.32 -68.51 0.18 Allowed 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 124.023 0.929 . . . . 2.85 108.631 170.381 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -50.41 -41.76 52.78 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.358 1.063 . . . . 2.19 112.501 -177.668 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 14.8 m-30 -54.38 -52.29 62.14 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 118.48 0.582 . . . . 4.87 110.317 179.718 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -74.27 -37.96 63.56 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 120.338 -0.545 . . . . 3.43 110.622 -179.278 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -62.58 -34.63 77.38 Favored 'General case' 0 N--CA 1.442 -0.847 0 C-N-CA 124.052 0.941 . . . . 0.81 112.457 -178.686 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 14.9 m -82.65 -0.99 49.8 Favored 'General case' 0 N--CA 1.451 -0.412 0 O-C-N 123.468 0.48 . . . . 1.77 111.382 174.024 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 76.45 -2.5 57.62 Favored Glycine 0 CA--C 1.527 0.831 0 N-CA-C 111.511 -0.636 . . . . 0.73 111.511 -177.277 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -65.29 -31.46 72.61 Favored 'General case' 0 N--CA 1.445 -0.68 0 O-C-N 121.306 -1.114 . . . . 2.31 111.819 -172.709 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 83.0 p -77.3 -15.19 59.55 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 119.392 0.996 . . . . 1.98 112.368 172.998 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.93 -35.67 21.94 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 108.804 -0.813 . . . . 5.32 108.804 175.194 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 31.8 mmt -55.94 131.51 47.36 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-O 121.834 0.826 . . . . 3.17 110.646 171.564 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 2.0 m -70.56 159.84 33.59 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 115.398 -0.819 . . . . 1.85 109.676 178.956 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -41.33 -43.82 2.58 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.363 1.065 . . . . 0.58 112.138 177.543 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 66.8 m-20 -48.52 -61.57 1.95 Allowed 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 123.959 0.904 . . . . 1.52 110.304 175.906 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 22.5 mm-40 -62.15 -44.52 96.44 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 115.568 -0.742 . . . . 2.69 109.382 -179.169 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 57.8 t -59.55 -35.35 58.66 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.63 0 CA-C-N 119.079 0.854 . . . . 0.61 110.116 -178.237 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 3.8 tttp -67.42 -44.56 78.46 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.646 0.778 . . . . 2.76 111.201 174.196 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 73.5 m-20 -60.61 -54.87 40.17 Favored 'General case' 0 C--O 1.233 0.219 0 O-C-N 121.986 -0.446 . . . . 2.97 110.216 177.902 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.685 HG12 HG22 ' A' ' 3' ' ' ILE . 3.9 m -58.15 -46.52 88.39 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.241 0 CA-C-O 118.575 -0.726 . . . . 0.57 109.567 179.237 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 4.2 t80 -41.87 -55.15 3.18 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 123.95 0.9 . . . . 4.96 110.99 170.505 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 35.9 mtt85 -59.29 -37.99 79.09 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 118.177 0.444 . . . . 3.77 111.834 177.822 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 14.5 t80 -63.94 -30.2 71.3 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 122.143 -0.348 . . . . 3.77 110.544 177.292 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.3 mm -79.7 -50.01 18.56 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 CA-C-O 118.43 -0.795 . . . . 1.5 111.212 179.519 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -69.26 72.61 0.3 Allowed 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 123.862 0.865 . . . . 2.27 108.853 -176.212 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -61.4 -31.85 71.78 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 125.684 1.594 . . . . 2.01 111.407 -168.464 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 13.5 p-10 -69.64 -32.52 71.25 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 125.395 1.478 . . . . 2.49 111.815 171.237 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 59.23 80.04 0.21 Allowed 'General case' 0 N--CA 1.445 -0.677 0 CA-C-O 122.228 1.013 . . . . 3.06 109.084 -177.577 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 4.9 p -118.08 -70.25 0.8 Allowed 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 107.844 -1.169 . . . . 2.38 107.844 175.176 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 147.68 35.04 0.05 OUTLIER Glycine 0 CA--C 1.53 1.004 0 C-N-CA 126.781 2.134 . . . . 1.78 111.589 -179.831 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 33.0 m-85 -159.71 129.38 5.38 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 105.451 -2.055 . . . . 2.14 105.451 -178.803 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -86.42 75.58 9.76 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 105.202 -2.148 . . . . 2.01 105.202 166.302 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -55.77 133.3 50.91 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 113.874 -1.512 . . . . 1.62 107.724 175.797 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -48.51 -46.07 38.0 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 119.073 0.851 . . . . 5.59 113.151 -164.411 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -56.12 -31.42 63.3 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 122.705 0.402 . . . . 3.05 111.487 -176.923 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 92.4 mt-10 -66.82 -34.34 77.59 Favored 'General case' 0 N--CA 1.453 -0.3 0 O-C-N 120.964 -1.085 . . . . 1.88 110.954 176.66 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 86.9 mt -62.78 -29.21 70.53 Favored 'General case' 0 N--CA 1.456 -0.17 0 O-C-N 122.05 -0.406 . . . . 2.74 110.459 176.343 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 65.9 tttt -60.9 -7.37 2.35 Favored 'General case' 0 CA--C 1.543 0.675 0 O-C-N 121.75 -0.594 . . . . 4.1 112.426 171.438 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 11.8 t80 -137.96 37.42 2.36 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.145 0.978 . . . . 5.73 110.596 168.214 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -75.84 -79.12 0.1 Allowed 'General case' 0 N--CA 1.464 0.231 0 O-C-N 121.434 -0.791 . . . . 2.76 110.074 178.257 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.448 ' HB3' ' HB1' ' A' ' 75' ' ' ALA . 3.7 tt -62.75 -20.03 64.55 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.258 1.023 . . . . 2.45 110.427 -169.349 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 93.7 mm-40 -46.71 -37.62 8.69 Favored 'General case' 0 CA--C 1.541 0.632 0 O-C-N 121.051 -1.03 . . . . 2.17 112.013 166.154 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.68 -38.22 69.34 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 118.977 0.808 . . . . 2.76 111.204 173.47 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 9.0 m-30 -79.4 -52.25 8.32 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 123.999 0.92 . . . . 3.21 109.698 -177.386 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -150.79 134.79 16.75 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 123.491 0.716 . . . . 3.33 109.942 -175.325 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 15.5 t -58.86 -30.33 67.65 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.584 1.154 . . . . 3.61 111.607 -179.551 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -87.72 16.29 51.06 Favored Glycine 0 CA--C 1.525 0.678 0 C-N-CA 125.515 1.531 . . . . 2.77 111.446 -174.95 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.448 ' HB1' ' HB3' ' A' ' 68' ' ' LEU . . . -59.17 171.32 0.75 Allowed 'General case' 0 N--CA 1.444 -0.767 0 C-N-CA 123.544 0.738 . . . . 1.59 112.178 171.462 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 20.5 mmm180 -89.02 -27.32 20.93 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-O 118.396 -0.811 . . . . 3.82 112.795 -176.554 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -28.15 -43.49 0.02 OUTLIER 'General case' 0 N--CA 1.461 0.088 0 C-N-CA 128.694 2.797 . . . . 3.39 115.799 -166.822 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.492 ' H ' HD22 ' A' ' 78' ' ' LEU . 0.2 OUTLIER -40.37 -55.75 2.16 Favored 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 126.491 1.916 . . . . 1.2 110.199 174.513 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.68 133.18 42.12 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-O 122.7 1.238 . . . . 1.56 109.432 176.058 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 48.5 mp0 -74.14 -32.39 63.12 Favored 'General case' 0 N--CA 1.436 -1.131 0 CA-C-N 113.623 -1.626 . . . . 3.46 110.513 -179.021 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 19.8 m -54.27 -66.12 0.45 Allowed 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 119.751 1.16 . . . . 1.3 111.009 176.36 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -49.53 -53.15 25.09 Favored 'General case' 0 N--CA 1.452 -0.342 0 O-C-N 122.151 -0.343 . . . . 3.41 111.375 177.07 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -61.9 -43.5 98.72 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-O 121.813 0.816 . . . . 1.11 110.455 -173.743 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 46.9 mmtt -64.59 -28.03 69.35 Favored 'General case' 0 C--O 1.218 -0.599 0 CA-C-O 118.6 -0.714 . . . . 5.17 110.076 179.329 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -53.72 -44.86 70.22 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 119.467 1.031 . . . . 1.75 110.151 170.411 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.5 tt -64.29 -60.0 3.71 Favored 'General case' 0 C--N 1.342 0.249 0 O-C-N 121.85 -0.531 . . . . 3.16 109.718 172.848 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 8.5 tmm? -48.06 -58.14 4.87 Favored 'General case' 0 CA--C 1.536 0.429 0 O-C-N 123.94 0.775 . . . . 2.76 110.734 -173.772 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -38.64 -49.19 1.53 Allowed 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 128.105 2.562 . . . . 0.5 112.45 179.315 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -82.56 -51.79 7.45 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 110.162 -0.31 . . . . 0.53 110.162 -178.14 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -48.83 -40.12 28.09 Favored 'General case' 0 CA--C 1.528 0.128 0 C-N-CA 124.267 1.027 . . . . 0.38 112.221 -179.528 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -72.97 83.43 1.24 Allowed 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 109.79 -0.448 . . . . 0.91 109.79 179.121 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 46.3 m-80 -74.79 37.39 0.11 Allowed 'General case' 0 CA--C 1.539 0.526 0 O-C-N 121.383 -0.823 . . . . 2.94 111.772 177.761 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 20.5 m-20 -121.92 -55.48 1.89 Allowed 'General case' 0 N--CA 1.458 -0.054 0 C-N-CA 124.872 1.269 . . . . 1.24 108.392 174.398 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 93.2 43.53 4.03 Favored Glycine 0 CA--C 1.531 1.071 0 N-CA-C 109.008 -1.637 . . . . 0.76 109.008 -159.28 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -122.05 -55.73 1.87 Allowed 'General case' 0 C--N 1.34 0.182 0 C-N-CA 125.069 1.347 . . . . 2.44 109.655 174.701 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 135.51 -58.49 0.67 Allowed Glycine 0 CA--C 1.528 0.875 0 N-CA-C 110.901 -0.879 . . . . 0.7 110.901 -174.136 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 18.8 mttt -63.78 113.59 3.49 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 109.089 -0.708 . . . . 4.07 109.089 -176.957 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 6.7 mt -90.8 150.78 3.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 N-CA-C 107.427 -1.323 . . . . 1.0 107.427 174.959 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -126.94 -178.35 15.27 Favored Glycine 0 CA--C 1.522 0.495 0 N-CA-C 109.711 -1.355 . . . . 0.54 109.711 171.734 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -62.95 -42.67 99.89 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-N 117.288 0.544 . . . . 0.84 109.976 -174.146 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -58.39 -63.51 1.25 Allowed 'General case' 0 N--CA 1.449 -0.515 0 CA-C-O 118.237 -0.887 . . . . 2.62 110.282 177.37 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -45.48 -50.79 12.43 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 119.126 0.876 . . . . 1.24 111.949 175.399 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 57.6 t80 -60.98 -54.07 49.49 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 109.628 -0.508 . . . . 3.27 109.628 -175.407 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 24.9 tt0 -59.34 -46.13 89.46 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 123.769 0.828 . . . . 2.48 110.68 -179.259 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -49.58 -58.84 4.48 Favored 'General case' 0 C--O 1.23 0.038 0 CA-C-N 119.214 0.916 . . . . 3.74 110.416 175.298 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.61 -50.2 68.09 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 120.669 -0.412 . . . . 2.71 110.589 -176.318 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 55.3 t -54.43 -39.29 44.12 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.304 0 C-N-CA 123.02 0.528 . . . . 1.28 111.227 177.912 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 13.1 t60 -66.31 -19.93 65.95 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 124.247 1.019 . . . . 2.13 110.536 -178.161 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 4.3 t . . . . . 0 C--O 1.253 1.261 0 CA-C-O 117.506 -1.235 . . . . 3.58 110.406 -179.989 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.451 ' CG2' HG12 ' A' ' 47' ' ' VAL . 5.3 pt . . . . . 0 CA--C 1.531 0.223 0 N-CA-C 112.877 0.695 . . . . 2.73 112.877 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 8.2 t -51.02 -27.9 8.89 Favored 'General case' 0 N--CA 1.425 -1.687 0 C-N-CA 129.326 3.05 . . . . 2.48 113.734 178.136 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 24.8 t0 -152.72 52.1 0.76 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.662 0.785 . . . . 3.56 110.547 -178.762 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 4.5 t -118.98 -56.46 3.61 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.194 0 C-N-CA 125.139 1.376 . . . . 1.6 109.612 175.856 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 2.4 tp -167.67 -55.92 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 105.703 -1.962 . . . . 1.09 105.703 -177.004 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 70.1 m -51.53 -29.0 15.27 Favored 'General case' 0 N--CA 1.442 -0.871 0 N-CA-C 114.894 1.442 . . . . 1.03 114.894 -167.148 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -50.29 -42.86 53.14 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 121.151 -0.968 . . . . 0.89 112.171 173.132 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -69.09 -38.03 78.75 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-O 121.48 0.657 . . . . 2.07 110.462 176.293 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -58.96 -49.35 78.19 Favored 'General case' 0 C--O 1.234 0.257 0 C-N-CA 122.941 0.497 . . . . 4.94 109.716 -179.914 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 11.5 pt -65.35 -38.88 83.62 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.41 0 N-CA-C 109.277 -0.638 . . . . 1.11 109.277 -176.703 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -53.86 -47.7 70.77 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 118.321 0.509 . . . . 0.63 110.595 175.56 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.66 -59.22 5.73 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-O 120.512 0.196 . . . . 0.63 111.088 175.606 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -50.65 -46.83 58.61 Favored 'General case' 0 CA--C 1.528 0.117 0 C-N-CA 124.111 0.964 . . . . 0.58 111.637 -176.827 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 5.1 mp -51.34 -37.6 48.7 Favored 'General case' 0 C--N 1.333 -0.146 0 C-N-CA 124.417 1.087 . . . . 4.01 111.477 178.722 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -82.39 -46.62 13.31 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 109.519 -0.549 . . . . 5.28 109.519 178.306 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -70.56 -31.16 68.09 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 112.112 0.412 . . . . 2.42 112.112 -167.681 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 65.9 m -118.05 47.97 1.48 Allowed 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 125.572 1.549 . . . . 1.62 108.571 171.345 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 37.9 ttt85 -68.88 -32.22 71.72 Favored 'General case' 0 CA--C 1.534 0.339 0 O-C-N 121.673 -0.642 . . . . 5.17 109.983 173.586 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 91.8 m-20 -80.79 150.12 68.76 Favored Pre-proline 0 CA--C 1.539 0.522 0 C-N-CA 125.591 1.556 . . . . 2.25 110.924 -166.542 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -66.05 141.06 62.38 Favored 'Trans proline' 0 N--CA 1.455 -0.747 0 C-N-CA 123.105 2.537 . . . . 1.35 110.21 -174.89 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 63.97 9.18 4.4 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.583 1.553 . . . . 2.31 113.417 177.034 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 24.2 m -92.6 -9.52 40.74 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 119.568 1.077 . . . . 0.89 113.221 -171.666 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -58.43 115.21 2.84 Favored 'General case' 0 N--CA 1.448 -0.569 0 O-C-N 121.764 -0.585 . . . . 2.89 109.672 176.436 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -102.98 148.19 35.23 Favored Pre-proline 0 CA--C 1.532 0.288 0 N-CA-C 108.859 -0.793 . . . . 3.7 108.859 164.07 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -67.23 -65.94 0.04 OUTLIER 'Trans proline' 0 N--CA 1.451 -0.998 0 C-N-CA 123.254 2.636 . . . . 1.01 111.02 -177.062 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 35.4 mt-30 -58.8 -32.33 69.24 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 124.15 0.98 . . . . 2.33 110.841 -178.478 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 18.6 tptm -61.37 -66.56 0.52 Allowed 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 123.5 0.72 . . . . 2.84 109.943 173.093 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 51.3 t80 -54.38 -47.69 72.38 Favored 'General case' 0 C--O 1.221 -0.402 0 C-N-CA 122.975 0.51 . . . . 2.36 109.896 -176.93 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 3.8 t80 -39.01 -58.47 1.11 Allowed 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 126.514 1.926 . . . . 5.19 112.078 172.566 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 30.8 tt0 -72.09 -47.02 54.44 Favored 'General case' 0 N--CA 1.45 -0.458 0 N-CA-C 109.291 -0.633 . . . . 3.09 109.291 -176.803 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -57.63 -34.42 69.29 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 123.197 0.599 . . . . 0.83 110.977 -177.043 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 26.1 t -81.4 -5.03 57.46 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 125.942 1.697 . . . . 1.45 109.876 -177.862 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 74.69 4.13 69.65 Favored Glycine 0 CA--C 1.527 0.841 0 O-C-N 119.11 -2.244 . . . . 0.91 111.608 171.912 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.419 ' HB3' HG13 ' A' ' 107' ' ' VAL . 89.8 mt -60.78 -33.98 73.8 Favored 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 124.814 1.246 . . . . 1.75 109.16 178.147 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 21.1 t -61.64 -33.97 74.86 Favored 'General case' 0 N--CA 1.462 0.156 0 C-N-CA 123.952 0.901 . . . . 2.34 111.229 172.72 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 25.9 tttt -80.6 -36.86 32.18 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 108.403 -0.962 . . . . 4.58 108.403 -176.747 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 25.8 mmt -69.36 135.45 50.37 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-O 121.689 0.757 . . . . 3.9 111.832 -179.573 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 2.6 m -69.89 154.19 42.29 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 123.356 0.662 . . . . 1.82 110.671 179.593 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -42.27 -40.02 2.29 Favored 'General case' 0 C--O 1.222 -0.359 0 C-N-CA 123.853 0.861 . . . . 0.48 112.099 175.301 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 62.8 m-20 -47.52 -59.46 3.23 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.232 1.013 . . . . 1.56 110.94 175.259 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 2.6 mm100 -69.19 -40.17 78.24 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 109.441 -0.577 . . . . 2.61 109.441 -176.977 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 89.6 t -62.58 -36.6 75.85 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.525 0 CA-C-N 118.748 0.704 . . . . 0.49 109.53 -178.386 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 48.2 tttm -66.26 -46.09 78.3 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 123.213 0.605 . . . . 3.06 109.824 174.372 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -55.31 -57.83 10.19 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 117.93 0.332 . . . . 3.1 110.935 176.141 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.451 HG12 ' CG2' ' A' ' 3' ' ' ILE . 4.7 m -55.77 -46.08 79.67 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.239 0 CA-C-O 118.858 -0.592 . . . . 0.49 109.929 179.218 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -45.24 -53.69 7.97 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 118.603 0.638 . . . . 4.84 110.677 172.017 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 68.3 mtp180 -61.39 -43.42 98.89 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 119.057 0.844 . . . . 3.22 111.721 -179.868 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 13.6 m-85 -62.52 -38.63 90.69 Favored 'General case' 0 C--O 1.235 0.313 0 O-C-N 121.835 -0.541 . . . . 4.76 110.751 179.678 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.405 HG21 ' CD1' ' A' ' 67' ' ' PHE . 38.6 mm -82.65 -39.93 16.3 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 CA-C-O 118.053 -0.975 . . . . 2.14 112.005 -174.988 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 60.8 t0 -64.12 74.62 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 125.313 1.445 . . . . 1.98 108.141 169.097 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -54.49 155.38 4.02 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 106.612 -1.625 . . . . 3.21 106.612 164.647 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 76.22 -47.15 0.55 Allowed 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 118.757 0.708 . . . . 3.11 111.97 -173.686 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 8.3 mt-30 61.12 45.83 8.73 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.578 0.751 . . . . 3.63 110.351 -174.087 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 34.3 p -53.6 -33.02 53.51 Favored 'General case' 0 C--N 1.34 0.156 0 C-N-CA 124.703 1.201 . . . . 1.65 111.24 173.938 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 121.34 -23.78 7.5 Favored Glycine 0 CA--C 1.528 0.872 0 N-CA-C 109.633 -1.387 . . . . 1.43 109.633 -167.152 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 65.9 m-85 -126.38 151.89 47.03 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 123.785 0.834 . . . . 2.37 110.107 -176.165 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 18.6 mt -80.56 82.33 6.6 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 105.316 -2.105 . . . . 2.61 105.316 152.516 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -65.17 146.89 54.39 Favored 'General case' 0 CA--C 1.549 0.909 0 CA-C-N 113.268 -1.787 . . . . 2.38 108.416 173.122 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -45.22 -55.87 5.39 Favored 'General case' 0 C--O 1.234 0.287 0 O-C-N 120.668 -1.27 . . . . 3.89 114.324 -171.34 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -51.35 -30.69 19.52 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.781 0.832 . . . . 3.62 111.547 179.041 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -68.34 -45.82 71.85 Favored 'General case' 0 N--CA 1.444 -0.754 0 O-C-N 121.749 -0.595 . . . . 2.9 110.465 178.532 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.74 -30.21 71.34 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 119.556 -0.858 . . . . 2.9 110.156 178.236 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 12.1 ttpp -57.5 -5.96 0.41 Allowed 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.772 1.229 . . . . 2.05 113.465 171.111 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 36.7 p90 -137.67 27.72 2.73 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 119.864 1.211 . . . . 5.02 112.395 165.476 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.405 ' CD1' HG21 ' A' ' 51' ' ' ILE . 63.8 t80 -53.99 -73.38 0.05 OUTLIER 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 124.543 1.137 . . . . 2.81 112.263 -176.136 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.81 -26.0 65.86 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 108.909 -0.774 . . . . 3.87 108.909 -171.636 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -52.22 -38.43 57.98 Favored 'General case' 0 C--O 1.226 -0.151 0 C-N-CA 126.861 2.065 . . . . 2.82 111.231 174.313 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 20.8 mtpt -63.34 -29.29 70.62 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 117.997 0.362 . . . . 3.18 111.744 176.383 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -79.59 -56.18 4.49 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 124.126 0.97 . . . . 5.37 108.875 -178.5 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -104.24 -123.52 0.21 Allowed 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 108.023 -1.102 . . . . 4.16 108.023 -173.971 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 21.8 p -157.29 -5.64 0.1 Allowed 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 116.577 2.066 . . . . 2.73 116.577 175.608 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -169.33 66.25 0.17 Allowed Glycine 0 C--N 1.334 0.465 0 N-CA-C 108.222 -1.951 . . . . 1.87 108.222 175.528 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -89.02 -106.46 0.08 Allowed 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 117.385 0.593 . . . . 1.74 109.557 -171.16 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 9.4 tpt180 -151.11 50.49 0.84 Allowed 'General case' 0 N--CA 1.457 -0.109 0 CA-C-O 122.194 0.997 . . . . 4.68 110.474 -174.421 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -95.85 -18.05 20.66 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 126.008 1.723 . . . . 4.77 108.946 178.636 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -71.54 -42.86 67.37 Favored 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 124.375 1.07 . . . . 1.15 110.632 -179.204 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.91 126.5 28.73 Favored 'General case' 0 C--N 1.343 0.308 0 C-N-CA 118.401 -1.32 . . . . 1.11 109.47 179.485 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -61.91 -37.41 84.56 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 114.098 -1.41 . . . . 3.62 109.412 174.514 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -66.75 -60.16 2.93 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 117.994 0.361 . . . . 1.98 111.09 -179.083 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -52.94 -41.57 64.62 Favored 'General case' 0 N--CA 1.454 -0.246 0 O-C-N 121.135 -0.978 . . . . 3.11 110.797 177.071 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 4.4 m -59.44 -60.32 4.03 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 119.355 -0.938 . . . . 0.82 110.911 173.144 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 35.4 pttt -61.37 -27.52 68.58 Favored 'General case' 0 C--O 1.213 -0.848 0 C-N-CA 123.511 0.724 . . . . 6.27 110.603 -168.732 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 34.8 m -48.26 -47.3 36.2 Favored 'General case' 0 C--N 1.326 -0.426 0 O-C-N 121.251 -0.906 . . . . 1.48 110.832 170.822 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 11.6 mt -75.09 -54.42 7.18 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 109.183 -0.673 . . . . 2.31 109.183 171.349 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 1.6 tpt -54.67 -20.09 7.49 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 115.178 1.547 . . . . 5.62 115.178 -175.808 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -83.12 -61.17 1.93 Allowed 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 127.057 2.143 . . . . 0.84 109.457 -179.128 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -80.89 -34.14 33.76 Favored 'General case' 0 N--CA 1.455 -0.213 0 O-C-N 121.903 -0.498 . . . . 0.9 111.917 -171.654 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -60.2 -38.94 84.82 Favored 'General case' 0 C--O 1.227 -0.086 0 CA-C-N 118.418 0.554 . . . . 0.51 109.69 172.256 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -66.18 -62.67 1.36 Allowed 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 109.549 -0.538 . . . . 1.9 109.549 176.842 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 10.1 p30 43.59 23.13 0.04 OUTLIER 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 126.553 1.941 . . . . 3.55 115.038 -173.668 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 52.4 m-20 -95.78 -45.44 6.99 Favored 'General case' 0 C--N 1.338 0.091 0 C-N-CA 124.373 1.069 . . . . 1.93 108.339 171.947 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 97.75 41.49 3.34 Favored Glycine 0 CA--C 1.53 0.97 0 N-CA-C 109.463 -1.455 . . . . 1.26 109.463 -158.604 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . 0.252 1.7 p30 -127.74 -54.81 1.32 Allowed 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 118.416 1.108 . . . . 2.08 111.917 171.604 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 114.49 -34.37 4.94 Favored Glycine 0 CA--C 1.53 1.009 0 C-N-CA 124.611 1.101 . . . . 0.87 112.46 176.868 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 52.8 pttt -70.1 127.85 34.26 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-N 118.858 1.329 . . . . 3.98 108.058 173.105 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 8.7 mt -117.46 107.45 22.24 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.156 0 N-CA-C 108.307 -0.998 . . . . 1.08 108.307 -173.185 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -61.88 163.59 24.22 Favored Glycine 0 CA--C 1.526 0.752 0 N-CA-C 111.04 -0.824 . . . . 0.48 111.04 172.967 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -51.01 -42.86 60.68 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 109.039 -0.726 . . . . 0.62 109.039 168.359 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 8.8 tt0 -57.64 -56.74 18.01 Favored 'General case' 0 N--CA 1.445 -0.68 0 C-N-CA 124.121 0.968 . . . . 2.73 110.044 179.003 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -50.87 -48.07 60.29 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.68 0.792 . . . . 1.5 110.98 176.22 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 79.5 t80 -58.31 -54.56 45.67 Favored 'General case' 0 CA--C 1.538 0.492 0 O-C-N 121.745 -0.597 . . . . 4.04 110.896 179.052 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 13.0 mt-30 -61.96 -29.0 69.94 Favored 'General case' 0 C--O 1.221 -0.422 0 CA-C-O 118.001 -0.999 . . . . 4.05 112.534 177.519 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 23.5 mm-40 -63.01 -59.37 4.91 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 120.288 1.404 . . . . 3.29 107.778 172.374 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 5.6 tpt -54.99 -41.6 71.42 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 110.231 -0.285 . . . . 3.21 110.231 -176.378 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 107' ' ' VAL . . . . . 0.419 HG13 ' HB3' ' A' ' 36' ' ' LEU . 52.8 t -78.4 -54.86 11.35 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.51 0 N-CA-C 113.153 0.797 . . . . 1.3 113.153 -177.142 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 4.5 t-80 -72.05 -8.77 56.47 Favored 'General case' 0 C--N 1.326 -0.425 0 O-C-N 119.508 -1.995 . . . . 3.65 111.057 -175.702 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 33.2 t . . . . . 0 C--O 1.254 1.319 0 CA-C-O 115.084 -2.389 . . . . 2.79 113.643 167.14 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.521 HG22 HG12 ' A' ' 47' ' ' VAL . 1.3 pp . . . . . 0 CA--C 1.536 0.413 0 N-CA-C 112.393 0.516 . . . . 1.24 112.393 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 9.1 t -64.87 -8.96 17.49 Favored 'General case' 0 N--CA 1.432 -1.361 0 C-N-CA 127.542 2.337 . . . . 1.64 111.541 -176.087 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 29.8 t0 -132.83 7.35 4.05 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 126.681 1.992 . . . . 2.4 109.477 -175.838 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 77.7 t -90.6 -61.31 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.344 0.347 0 O-C-N 121.574 -0.704 . . . . 1.51 109.827 174.361 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -166.26 -60.32 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.196 0 N-CA-C 107.517 -1.29 . . . . 1.1 107.517 -174.116 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 27.5 m -41.45 -25.89 0.05 Allowed 'General case' 0 C--O 1.221 -0.437 0 C-N-CA 126.959 2.103 . . . . 1.18 115.969 -169.846 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -48.09 -47.33 34.26 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 119.81 1.186 . . . . 0.88 112.387 171.416 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -64.71 -41.32 96.08 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-O 122.477 1.132 . . . . 1.75 109.716 179.838 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -68.88 -45.49 70.82 Favored 'General case' 0 N--CA 1.445 -0.683 0 C-N-CA 124.285 1.034 . . . . 2.39 109.384 -172.674 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 32.4 pt -60.93 -37.46 77.02 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.807 0 O-C-N 121.256 -0.902 . . . . 1.0 111.076 175.564 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.85 -43.95 77.58 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 118.68 0.673 . . . . 0.88 110.626 173.52 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.02 -57.12 14.22 Favored 'General case' 0 CA--C 1.534 0.363 0 O-C-N 121.946 -0.471 . . . . 0.78 110.524 172.803 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -47.31 -43.57 22.75 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.845 1.258 . . . . 0.77 111.222 -179.596 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.62 -36.99 77.43 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 126.16 1.784 . . . . 3.3 110.9 -177.614 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -91.38 -42.98 10.02 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 122.818 0.447 . . . . 2.79 110.005 -175.047 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -69.58 -32.9 71.94 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-O 119.792 -0.146 . . . . 3.54 110.973 -176.531 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 62.1 m -109.15 55.83 0.63 Allowed 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.927 0.891 . . . . 1.6 108.615 175.312 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.88 -53.67 12.48 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 121.608 0.718 . . . . 5.23 109.977 -168.156 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -69.66 140.28 89.32 Favored Pre-proline 0 N--CA 1.445 -0.709 0 CA-C-N 114.266 -1.334 . . . . 3.18 107.592 176.934 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -51.16 -70.92 0.05 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.659 0 C-N-CA 124.386 3.391 . . . . 4.12 112.089 -164.225 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 12.3 p-10 -77.08 49.35 0.66 Allowed 'General case' 0 CA--C 1.543 0.675 0 O-C-N 121.493 -0.754 . . . . 3.32 112.582 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 2.8 m -122.13 27.76 7.85 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 124.367 1.067 . . . . 1.42 110.151 174.851 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 12.0 t80 -109.1 135.91 49.46 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 124.695 1.198 . . . . 4.3 108.704 -179.869 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 -122.13 142.86 37.61 Favored Pre-proline 0 N--CA 1.451 -0.422 0 N-CA-C 107.696 -1.224 . . . . 3.82 107.696 169.639 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -64.86 -59.03 0.18 Allowed 'Trans proline' 0 N--CA 1.452 -0.963 0 C-N-CA 123.601 2.868 . . . . 0.77 111.296 -177.054 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -52.44 -50.66 62.18 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.307 0.643 . . . . 2.54 110.818 -179.179 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 12.6 tptp -45.53 -65.14 0.58 Allowed 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.433 1.093 . . . . 2.86 108.852 170.105 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -50.49 -44.36 55.86 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 124.879 1.272 . . . . 2.91 112.873 -176.957 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 13.5 m-85 -56.35 -46.54 79.92 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-N 120.036 1.289 . . . . 4.61 111.006 -178.189 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 -70.32 -46.53 64.03 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 109.454 -0.573 . . . . 2.89 109.454 178.019 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -63.8 -33.39 75.56 Favored 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 124.764 1.226 . . . . 0.89 113.137 -174.073 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.4 t -85.67 -1.32 57.04 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 125.319 1.448 . . . . 1.44 109.669 178.843 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 76.95 -11.83 13.61 Favored Glycine 0 CA--C 1.531 1.054 0 O-C-N 121.396 -0.815 . . . . 0.72 112.238 179.309 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 32.6 mt -55.93 -33.84 65.07 Favored 'General case' 0 N--CA 1.444 -0.728 0 C-N-CA 126.518 1.927 . . . . 1.38 112.525 -177.654 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 46.9 t -69.23 -32.95 72.52 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 118.803 0.729 . . . . 2.03 111.301 173.292 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 10.6 tttt -75.43 -34.79 61.02 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 108.563 -0.903 . . . . 4.24 108.563 -179.078 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 36.3 mtt -57.34 124.69 19.75 Favored 'General case' 0 N--CA 1.442 -0.848 0 N-CA-C 109.601 -0.518 . . . . 2.78 109.601 171.946 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 6.0 m -63.34 160.48 15.89 Favored 'General case' 0 N--CA 1.452 -0.337 0 O-C-N 121.537 -0.727 . . . . 1.86 110.73 176.46 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -41.6 -41.99 2.34 Favored 'General case' 0 C--O 1.224 -0.253 0 C-N-CA 125.005 1.322 . . . . 0.49 112.332 176.22 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 75.8 m-20 -48.69 -61.13 2.19 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.223 0.609 . . . . 1.54 109.886 175.514 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 9.0 mm-40 -62.84 -46.43 87.95 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 115.83 -0.623 . . . . 2.66 109.682 -178.997 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 62.6 t -58.82 -39.07 76.19 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 CA-C-N 119.789 1.177 . . . . 0.45 110.77 -176.836 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 6.7 ttmt -64.27 -48.43 75.77 Favored 'General case' 0 CA--C 1.536 0.432 0 O-C-N 121.366 -0.834 . . . . 4.55 110.707 172.861 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 78.1 m-20 -61.19 -51.1 70.45 Favored 'General case' 0 CA--C 1.535 0.387 0 O-C-N 121.807 -0.558 . . . . 3.41 110.06 -176.178 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.521 HG12 HG22 ' A' ' 3' ' ' ILE . 9.0 m -58.8 -46.65 90.8 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.27 0 CA-C-O 118.412 -0.804 . . . . 0.59 110.105 174.485 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 11.8 t80 -45.65 -48.71 14.82 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 119.291 0.951 . . . . 4.36 111.233 173.257 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 86.3 mtt-85 -61.19 -36.28 79.44 Favored 'General case' 0 CA--C 1.532 0.277 0 O-C-N 121.608 -0.682 . . . . 4.26 112.169 176.377 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 25.1 t80 -64.89 -33.76 76.78 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 118.805 0.729 . . . . 3.71 110.071 173.158 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 14.1 mm -67.25 -58.0 7.83 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.284 0 CA-C-O 117.895 -1.05 . . . . 1.55 111.721 176.583 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -73.18 70.97 1.15 Allowed 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 119.21 0.914 . . . . 2.37 109.457 -173.663 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 15.5 t30 -59.9 -32.63 70.93 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 125.967 1.707 . . . . 2.01 111.887 -170.791 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 17.2 p-10 -74.3 -21.05 59.91 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.473 1.109 . . . . 2.34 111.607 174.494 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 8.1 mt-30 49.92 63.07 2.33 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 126.496 1.919 . . . . 3.15 111.389 -178.103 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.2 p -93.71 -38.82 11.11 Favored 'General case' 0 CA--C 1.521 -0.149 0 CA-C-N 115.698 -0.683 . . . . 1.38 109.978 167.572 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 99.72 18.49 22.82 Favored Glycine 0 CA--C 1.53 0.971 0 CA-C-O 119.71 -0.494 . . . . 1.6 111.925 -169.329 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 36.7 m-85 -135.14 137.64 42.96 Favored 'General case' 0 C--O 1.238 0.454 0 N-CA-C 108.717 -0.846 . . . . 2.61 108.717 163.991 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -90.91 70.79 6.48 Favored 'General case' 0 C--O 1.231 0.099 0 C-N-CA 126.067 1.747 . . . . 1.73 107.87 168.89 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -63.56 165.64 7.78 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 123.314 0.646 . . . . 1.77 110.59 177.411 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -48.93 -47.38 43.64 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.147 0.979 . . . . 4.32 111.601 -176.837 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -73.74 -18.8 60.94 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 115.679 -0.691 . . . . 3.09 112.56 -177.03 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -70.51 -48.79 53.88 Favored 'General case' 0 CA--C 1.522 -0.105 0 N-CA-C 108.58 -0.896 . . . . 2.67 108.58 165.445 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.622 HD11 HD23 ' A' ' 86' ' ' LEU . 0.2 OUTLIER -49.37 -41.96 40.65 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 115.642 -0.708 . . . . 2.6 110.208 176.861 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 30.3 ttpt -55.02 -8.15 0.25 Allowed 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 114.5 1.296 . . . . 2.16 114.5 176.636 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 32.2 p90 -136.46 18.94 3.12 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 120.584 1.538 . . . . 5.6 113.564 168.37 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 2.7 t80 -42.48 -75.92 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.042 1.337 . . . . 2.52 114.107 -172.562 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.504 HD23 ' CD2' ' A' ' 71' ' ' PHE . 1.5 mt -73.89 -0.2 15.3 Favored 'General case' 0 CA--C 1.532 0.267 0 O-C-N 121.251 -0.905 . . . . 2.23 111.529 178.223 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -72.34 -19.17 61.69 Favored 'General case' 0 CA--C 1.532 0.257 0 O-C-N 120.599 -1.313 . . . . 2.7 110.714 -176.552 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.0 -29.6 68.58 Favored 'General case' 0 CA--C 1.534 0.332 0 O-C-N 122.006 -0.434 . . . . 2.89 111.321 163.654 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.504 ' CD2' HD23 ' A' ' 68' ' ' LEU . 2.5 m-30 -90.56 -65.02 1.05 Allowed 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 108.576 -0.898 . . . . 3.25 108.576 -176.479 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -117.33 119.47 35.25 Favored 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 107.922 -1.14 . . . . 3.08 107.922 -172.79 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 4.2 p -49.22 -34.45 14.91 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 123.73 0.812 . . . . 2.28 112.324 179.536 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -111.81 36.69 4.04 Favored Glycine 0 CA--C 1.524 0.643 0 C-N-CA 124.903 1.239 . . . . 1.1 110.925 -178.92 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.77 175.68 1.08 Allowed 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 117.617 0.708 . . . . 1.69 110.602 169.397 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.63 3.63 28.1 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 114.523 1.305 . . . . 5.19 114.523 -164.989 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -55.26 -26.51 40.42 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.092 0.957 . . . . 3.05 112.639 -162.702 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.44 ' H ' HD22 ' A' ' 78' ' ' LEU . 0.2 OUTLIER -62.73 -41.81 99.36 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.324 1.45 . . . . 0.88 112.155 173.86 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 53.9 m -64.06 106.29 1.03 Allowed 'General case' 0 C--O 1.236 0.36 0 N-CA-C 108.862 -0.792 . . . . 1.5 108.862 175.059 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -56.54 -37.33 70.35 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-N 115.611 -0.722 . . . . 3.06 110.478 174.945 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -49.85 -69.72 0.11 Allowed 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 119.394 0.997 . . . . 2.16 112.153 176.129 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 21.6 mt-10 -53.95 -48.18 70.56 Favored 'General case' 0 C--N 1.343 0.285 0 CA-C-N 119.357 0.981 . . . . 4.66 110.611 178.557 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -54.76 -51.82 64.49 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-O 121.658 0.742 . . . . 0.66 109.392 -175.036 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.93 -34.64 73.72 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 124.624 1.17 . . . . 5.02 110.29 -176.268 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 73.4 m -61.07 -48.73 80.34 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 120.14 1.336 . . . . 1.23 110.82 174.039 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.622 HD23 HD11 ' A' ' 64' ' ' LEU . 6.3 tp -54.02 -59.26 4.88 Favored 'General case' 0 C--N 1.342 0.271 0 N-CA-C 108.254 -1.017 . . . . 3.27 108.254 172.981 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 1.7 ttt -47.99 -50.47 27.39 Favored 'General case' 0 CA--C 1.538 0.501 0 O-C-N 123.771 0.669 . . . . 3.61 111.818 -179.014 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -54.92 -51.79 64.98 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 126.141 1.777 . . . . 0.68 111.275 -173.031 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -73.58 -49.08 28.1 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 120.112 -0.635 . . . . 0.51 110.29 177.43 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -48.99 -33.97 12.11 Favored 'General case' 0 C--N 1.339 0.14 0 C-N-CA 123.537 0.735 . . . . 0.56 111.598 -178.781 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 17.3 t0 -79.75 112.13 16.73 Favored 'General case' 0 N--CA 1.439 -0.995 0 C-N-CA 124.41 1.084 . . . . 1.18 112.483 -179.574 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 10.0 m120 -80.41 35.4 0.34 Allowed 'General case' 0 CA--C 1.539 0.534 0 O-C-N 120.958 -1.089 . . . . 2.54 112.312 176.85 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -142.92 -55.04 0.41 Allowed 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 119.727 1.148 . . . . 1.94 111.783 -174.465 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 88.25 40.4 6.52 Favored Glycine 0 CA--C 1.533 1.206 0 N-CA-C 109.283 -1.527 . . . . 1.44 109.283 -152.066 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 20.5 p30 -113.63 -65.03 1.23 Allowed 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 126.087 1.755 . . . . 1.9 109.227 169.254 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 129.45 -32.61 3.18 Favored Glycine 0 CA--C 1.524 0.598 0 C-N-CA 124.751 1.167 . . . . 0.84 111.001 -177.575 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 19.2 pttm -63.03 121.71 14.25 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 107.549 -1.278 . . . . 5.65 107.549 173.994 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 14.4 mt -123.57 118.56 54.73 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 C-N-CA 124.996 1.318 . . . . 0.71 107.726 -172.945 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -86.31 174.0 46.69 Favored Glycine 0 CA--C 1.531 1.041 0 N-CA-C 110.9 -0.88 . . . . 0.63 110.9 172.607 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -60.51 -42.22 95.94 Favored 'General case' 0 C--O 1.224 -0.271 0 O-C-N 122.222 -0.575 . . . . 0.87 109.643 175.915 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 -57.08 -57.46 12.48 Favored 'General case' 0 N--CA 1.447 -0.575 0 C-N-CA 123.39 0.676 . . . . 2.19 109.726 177.031 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 -48.36 -51.25 27.24 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 121.669 0.747 . . . . 1.31 110.213 177.017 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 12.5 t80 -61.24 -54.31 45.77 Favored 'General case' 0 CA--C 1.534 0.334 0 O-C-N 121.944 -0.473 . . . . 2.84 111.632 -176.992 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 23.9 tt0 -58.59 -45.27 89.45 Favored 'General case' 0 C--O 1.225 -0.185 0 C-N-CA 125.487 1.515 . . . . 2.64 110.885 -178.085 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 55.1 mt-10 -49.2 -54.21 17.64 Favored 'General case' 0 C--N 1.34 0.168 0 CA-C-N 119.219 0.918 . . . . 3.16 110.154 175.042 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 2.5 tpp -64.61 -52.84 55.39 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 116.088 -0.506 . . . . 4.58 110.117 -177.649 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 50.1 t -53.62 -37.72 32.07 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.225 0 C-N-CA 123.493 0.717 . . . . 1.37 111.647 -179.912 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 10.4 t-80 -63.9 -21.35 66.42 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 124.967 1.307 . . . . 3.39 110.487 -178.904 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 18.4 t . . . . . 0 C--O 1.252 1.193 0 N-CA-C 112.564 0.579 . . . . 3.7 112.564 -177.96 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.483 HG22 HG12 ' A' ' 47' ' ' VAL . 0.2 OUTLIER . . . . . 0 CA--C 1.535 0.366 0 N-CA-C 112.932 0.716 . . . . 1.92 112.932 . . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -56.04 -40.16 73.08 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-O 122.04 0.924 . . . . 2.13 108.985 178.49 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 41.9 t0 -89.7 42.46 1.09 Allowed 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 128.04 2.536 . . . . 3.34 109.248 -172.793 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 40.3 t -144.94 -63.96 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.341 0.21 0 C-N-CA 125.075 1.35 . . . . 1.53 109.319 -176.926 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 10.8 tp -166.52 -57.16 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.131 0 N-CA-C 107.074 -1.454 . . . . 1.19 107.074 -174.858 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 1.6 m -42.01 -29.27 0.21 Allowed 'General case' 0 N--CA 1.446 -0.638 0 C-N-CA 128.553 2.741 . . . . 0.99 115.465 -165.3 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -45.89 -49.08 15.94 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.925 0.89 . . . . 0.61 112.139 173.798 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -61.52 -45.16 95.38 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 122.419 1.104 . . . . 1.79 109.283 -179.076 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -67.04 -47.28 71.85 Favored 'General case' 0 N--CA 1.445 -0.708 0 C-N-CA 124.608 1.163 . . . . 2.3 109.044 -171.768 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 19.2 pt -63.62 -39.59 85.92 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.801 0 O-C-N 121.774 -0.578 . . . . 0.97 111.175 176.221 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.44 -46.54 83.48 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 118.733 0.697 . . . . 0.67 110.779 173.852 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.59 -53.16 61.5 Favored 'General case' 0 CA--C 1.531 0.232 0 O-C-N 121.752 -0.593 . . . . 0.61 110.642 173.744 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.477 ' HB1' ' CZ ' ' A' ' 30' ' ' PHE . . . -51.81 -43.92 63.28 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 124.683 1.193 . . . . 0.57 111.172 -178.818 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -54.6 -35.74 63.7 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 124.539 1.136 . . . . 2.88 111.079 176.972 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 4.7 mt-30 -86.43 -43.89 12.45 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 118.238 0.472 . . . . 3.03 111.383 179.326 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.12 -45.5 92.79 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-O 121.689 0.757 . . . . 3.48 109.608 179.94 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 4.2 t -99.01 36.91 1.61 Allowed 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 126.216 1.806 . . . . 2.53 110.035 -175.229 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 57.7 ttp180 -74.14 -45.98 45.39 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 108.895 -0.78 . . . . 5.82 108.895 -178.719 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -81.56 147.88 60.68 Favored Pre-proline 0 N--CA 1.446 -0.665 0 N-CA-C 108.008 -1.108 . . . . 2.28 108.008 -163.111 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -65.1 146.7 87.63 Favored 'Trans proline' 0 N--CA 1.452 -0.951 0 C-N-CA 121.803 1.669 . . . . 1.27 110.923 -168.053 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 53.02 46.08 27.49 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 126.102 1.761 . . . . 2.6 112.203 177.043 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 3.0 m -118.01 6.5 12.14 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.147 1.379 . . . . 0.78 112.79 -179.172 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 2.8 t80 -81.7 83.98 6.95 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 119.86 -1.775 . . . . 2.61 110.358 -172.748 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -69.77 138.31 88.07 Favored Pre-proline 0 CA--C 1.539 0.522 0 N-CA-C 109.051 -0.722 . . . . 2.71 109.051 166.798 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -64.54 -60.97 0.12 Allowed 'Trans proline' 0 N--CA 1.45 -1.042 0 C-N-CA 122.674 2.249 . . . . 0.6 111.21 -179.393 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -59.6 -45.74 91.03 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 122.914 0.486 . . . . 2.12 110.456 -177.425 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -49.36 -60.44 2.82 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 109.769 -0.456 . . . . 4.37 109.769 174.389 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.477 ' CZ ' ' HB1' ' A' ' 15' ' ' ALA . 7.6 t80 -63.25 -41.53 99.08 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-O 120.783 0.325 . . . . 3.82 111.176 -173.068 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -46.0 -54.81 7.75 Favored 'General case' 0 C--O 1.235 0.297 0 C-N-CA 125.243 1.417 . . . . 5.28 110.257 173.388 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -72.2 -49.29 36.57 Favored 'General case' 0 N--CA 1.443 -0.811 0 N-CA-C 108.426 -0.953 . . . . 2.49 108.426 -173.348 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -54.99 -36.23 65.19 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 124.193 0.997 . . . . 0.67 111.164 -179.5 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 22.3 t -85.17 -2.33 57.91 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 123.577 0.751 . . . . 1.5 111.932 -176.143 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 82.79 0.8 90.41 Favored Glycine 0 C--N 1.339 0.736 0 CA-C-N 119.216 0.916 . . . . 0.75 112.253 168.997 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -59.33 -30.33 68.29 Favored 'General case' 0 CA--C 1.536 0.43 0 O-C-N 121.65 -0.912 . . . . 2.44 109.609 175.13 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 28.9 p -52.58 -42.31 64.39 Favored 'General case' 0 CA--C 1.523 -0.085 0 C-N-CA 124.73 1.212 . . . . 3.18 112.153 168.217 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 9.5 tttt -91.71 -28.45 17.42 Favored 'General case' 0 N--CA 1.444 -0.736 0 N-CA-C 109.52 -0.548 . . . . 5.88 109.52 -168.25 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 8.2 mmt -52.9 -46.5 68.04 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 113.599 0.963 . . . . 3.37 113.599 -175.484 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 19.4 m 93.19 147.79 0.03 OUTLIER 'General case' 0 C--N 1.34 0.164 0 C-N-CA 128.323 2.649 . . . . 2.19 109.675 -176.958 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -41.21 -36.72 0.8 Allowed 'General case' 0 N--CA 1.463 0.189 0 C-N-CA 125.682 1.593 . . . . 0.79 113.233 -174.665 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -67.76 -60.96 2.12 Favored 'General case' 0 N--CA 1.456 -0.136 0 N-CA-C 108.406 -0.961 . . . . 2.06 108.406 -174.594 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 23.3 mm100 -53.45 -49.98 66.25 Favored 'General case' 0 C--O 1.22 -0.49 0 CA-C-N 115.349 -0.841 . . . . 2.71 108.85 175.677 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 74.2 t -54.15 -46.93 67.61 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.503 0 CA-C-N 118.404 0.547 . . . . 0.65 111.222 -178.066 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 10.2 tmtt? -62.71 -43.14 99.58 Favored 'General case' 0 CA--C 1.535 0.402 0 O-C-N 121.034 -1.041 . . . . 4.17 110.801 176.881 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 80.5 m-20 -65.24 -48.13 74.37 Favored 'General case' 0 CA--C 1.537 0.449 0 O-C-N 121.483 -0.761 . . . . 3.78 110.297 -179.012 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.483 HG12 HG22 ' A' ' 3' ' ' ILE . 3.4 m -57.01 -43.87 81.76 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.213 0 O-C-N 121.241 -0.912 . . . . 0.67 110.31 174.99 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.414 ' CE2' ' HA ' ' A' ' 100' ' ' ALA . 6.9 t80 -47.87 -52.95 17.23 Favored 'General case' 0 C--N 1.344 0.327 0 N-CA-C 109.358 -0.608 . . . . 4.31 109.358 172.652 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 11.8 mtt180 -66.53 -32.72 74.25 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 113.733 1.012 . . . . 5.5 113.733 179.526 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 20.0 m-85 -56.21 -40.0 73.36 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 119.937 1.244 . . . . 4.37 110.715 170.451 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.9 mp -78.65 -44.56 25.77 Favored 'Isoleucine or valine' 0 C--O 1.241 0.607 0 O-C-N 121.82 -0.55 . . . . 1.97 111.923 -178.325 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 20.6 t0 -65.61 79.31 0.07 Allowed 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 125.131 1.372 . . . . 1.76 109.106 178.749 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 13.5 t30 -44.78 -56.86 4.12 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 126.516 1.926 . . . . 2.12 112.433 -173.474 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -60.94 -15.68 34.01 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.984 1.714 . . . . 2.52 113.421 177.188 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 13.9 mt-30 57.04 29.79 17.09 Favored 'General case' 0 C--O 1.235 0.3 0 C-N-CA 125.092 1.357 . . . . 3.11 111.331 -175.374 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.4 p -64.05 -20.77 66.17 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.541 0.737 . . . . 1.57 111.636 178.55 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 86.64 15.66 63.24 Favored Glycine 0 CA--C 1.53 0.979 0 N-CA-C 110.38 -1.088 . . . . 1.58 110.38 -172.459 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 76.6 m-85 -136.99 124.77 22.5 Favored 'General case' 0 CA--C 1.515 -0.375 0 C-N-CA 124.803 1.241 . . . . 2.83 108.612 -175.916 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -73.38 83.63 1.44 Allowed 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 104.064 -2.569 . . . . 2.62 104.064 151.972 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -66.75 164.85 16.22 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 107.206 -1.405 . . . . 3.07 107.206 166.204 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -42.07 -51.49 4.53 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 124.545 1.138 . . . . 5.94 112.347 -176.051 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -68.17 -24.31 64.95 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 113.012 0.745 . . . . 3.33 113.012 -173.226 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -57.67 -40.87 80.35 Favored 'General case' 0 C--N 1.341 0.224 0 CA-C-N 120.314 1.415 . . . . 2.35 110.218 172.152 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.2 mp -65.64 -17.95 64.97 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 120.191 -0.603 . . . . 2.64 111.514 179.858 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 29.5 ttpt -79.1 -14.3 59.21 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 118.956 0.798 . . . . 2.24 111.353 172.844 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 68.5 m-85 -145.17 61.34 1.3 Allowed 'General case' 0 C--O 1.241 0.612 0 C-N-CA 124.267 1.027 . . . . 4.87 109.996 175.054 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 18.4 t80 -91.84 -80.42 0.36 Allowed 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.974 1.31 . . . . 2.69 108.84 -175.3 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 8.2 mp -65.25 -4.79 5.68 Favored 'General case' 0 N--CA 1.465 0.301 0 O-C-N 120.683 -1.26 . . . . 2.12 113.379 170.871 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.13 -23.18 66.41 Favored 'General case' 0 N--CA 1.45 -0.466 0 O-C-N 121.262 -0.898 . . . . 2.83 111.4 171.213 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 6.8 mptt -91.52 -42.73 10.09 Favored 'General case' 0 C--N 1.342 0.277 0 CA-C-N 119.298 0.954 . . . . 3.62 110.886 167.992 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 45.0 m-85 -55.4 -50.23 70.3 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 118.447 0.567 . . . . 3.83 111.462 -177.377 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 25.2 tp10 -110.97 -66.78 1.05 Allowed 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 124.927 1.291 . . . . 3.47 108.904 -177.087 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 48.6 m 107.63 113.52 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 128.377 2.671 . . . . 3.16 109.026 -165.564 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 74.25 44.74 27.52 Favored Glycine 0 CA--C 1.527 0.842 0 N-CA-C 111.384 -0.686 . . . . 1.4 111.384 176.618 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -85.47 -118.59 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.537 0.735 . . . . 1.54 110.13 177.166 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.24 -7.08 12.41 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.242 1.017 . . . . 3.27 113.006 -169.239 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -54.38 -32.86 57.97 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 126.252 1.821 . . . . 2.93 112.871 -158.893 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.479 ' H ' HD22 ' A' ' 78' ' ' LEU . 0.5 OUTLIER -57.63 -41.72 81.94 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 124.26 1.024 . . . . 0.96 111.596 176.136 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 49.5 m -67.55 104.6 1.62 Allowed 'General case' 0 C--O 1.235 0.295 0 CA-C-N 118.957 0.799 . . . . 0.81 110.04 -178.846 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 13.9 mp0 -61.8 -36.5 81.29 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 115.66 -0.7 . . . . 3.41 110.508 -177.461 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 22.1 t -54.72 -55.68 27.32 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 118.828 0.74 . . . . 1.8 110.687 177.86 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -63.45 -47.89 79.97 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 123.991 0.917 . . . . 3.15 109.124 -178.193 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -52.96 -45.66 67.84 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 115.897 -0.592 . . . . 0.75 110.432 176.534 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 5.1 mmpt? -68.69 -37.74 79.79 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 124.249 1.02 . . . . 4.72 110.883 -178.971 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 22.7 t -51.89 -51.43 56.87 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 119.343 0.974 . . . . 1.79 109.129 171.373 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.436 HD22 ' HA ' ' A' ' 86' ' ' LEU . 1.4 tm? -62.85 -54.27 41.38 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 118.98 -0.533 . . . . 2.47 110.207 179.19 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 51.4 ttm -46.68 -50.95 17.03 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 118.254 0.479 . . . . 3.22 111.408 176.11 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -54.91 -46.66 74.9 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 125.735 1.614 . . . . 0.7 111.624 -171.009 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -82.16 -38.26 24.95 Favored 'General case' 0 CA--C 1.529 0.14 0 N-CA-C 111.779 0.289 . . . . 0.61 111.779 -179.79 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -63.98 -44.06 93.83 Favored 'General case' 0 N--CA 1.457 -0.115 0 N-CA-C 111.646 0.239 . . . . 0.41 111.646 -179.085 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -65.4 119.27 10.68 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 108.875 -0.787 . . . . 1.04 108.875 178.934 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -103.2 12.01 36.21 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 122.501 0.32 . . . . 3.14 111.508 -174.473 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 34.2 m-20 -103.45 -43.74 5.32 Favored 'General case' 0 C--N 1.34 0.159 0 C-N-CA 124.035 0.934 . . . . 1.59 109.803 179.811 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 90.33 40.17 5.82 Favored Glycine 0 CA--C 1.529 0.968 0 N-CA-C 108.95 -1.66 . . . . 0.85 108.95 -156.354 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -118.45 -59.7 1.85 Allowed 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 117.811 0.805 . . . . 2.46 110.322 177.688 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 131.11 -43.2 1.31 Allowed Glycine 0 CA--C 1.528 0.861 0 C-N-CA 123.827 0.727 . . . . 0.57 111.432 179.559 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 18.5 mtpt -69.36 123.91 22.47 Favored 'General case' 0 N--CA 1.451 -0.405 0 N-CA-C 108.771 -0.826 . . . . 5.54 108.771 176.892 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 9.7 mt -108.5 110.37 31.76 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.204 0 N-CA-C 109.854 -0.424 . . . . 0.79 109.854 -168.412 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -63.62 157.51 41.43 Favored Glycine 0 CA--C 1.532 1.113 0 N-CA-C 111.106 -0.798 . . . . 0.5 111.106 170.655 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 100' ' ' ALA . . . . . 0.414 ' HA ' ' CE2' ' A' ' 48' ' ' PHE . . . -55.24 -37.75 67.59 Favored 'General case' 0 C--N 1.339 0.137 0 O-C-N 121.936 -0.744 . . . . 0.66 109.745 169.798 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -55.48 -60.88 2.81 Favored 'General case' 0 N--CA 1.448 -0.53 0 C-N-CA 124.308 1.043 . . . . 2.85 109.672 176.582 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -47.87 -49.21 30.24 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.203 1.001 . . . . 1.3 111.279 176.225 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -61.34 -51.79 67.34 Favored 'General case' 0 N--CA 1.457 -0.117 0 CA-C-O 121.401 0.62 . . . . 3.08 110.99 -178.033 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 10.7 tm0? -58.61 -36.5 74.13 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-O 117.74 -1.124 . . . . 2.82 110.438 178.573 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -60.11 -61.46 2.59 Favored 'General case' 0 N--CA 1.457 -0.099 0 CA-C-N 120.012 1.278 . . . . 3.37 110.761 170.44 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 3.7 ttp -54.31 -38.73 66.28 Favored 'General case' 0 C--N 1.34 0.161 0 CA-C-O 120.881 0.372 . . . . 4.87 110.508 -173.569 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 54.6 t -70.56 -76.02 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.446 -0.673 0 C-N-CA 123.388 0.675 . . . . 1.63 110.085 174.363 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 52.8 t-80 -50.82 -44.32 59.13 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 123.668 0.787 . . . . 2.81 111.211 -167.964 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.251 1.151 0 O-C-N 124.622 1.202 . . . . 5.64 109.557 -174.425 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 51.4 mtt . . . . . 0 N--CA 1.476 0.831 0 N-CA-C 110.418 -0.215 . . . . 7.19 110.418 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.0 m -161.95 -66.92 0.05 Allowed 'General case' 0 C--O 1.225 -0.195 0 N-CA-C 108.616 -0.883 . . . . 2.5 108.616 176.356 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.512 HG22 HG12 ' A' ' 47' ' ' VAL . 1.6 pp -91.65 -30.06 4.72 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.206 0 C-N-CA 123.77 0.828 . . . . 1.24 110.567 -169.416 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 12.5 t -66.0 -9.85 34.12 Favored 'General case' 0 N--CA 1.426 -1.667 0 C-N-CA 127.673 2.389 . . . . 1.69 112.078 -174.386 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 26.4 t0 -138.59 28.46 2.44 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.14 0.976 . . . . 2.81 109.822 178.206 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 1.1 p -100.55 -46.74 11.77 Favored 'Isoleucine or valine' 0 C--N 1.344 0.327 0 O-C-N 121.682 -0.636 . . . . 1.93 109.907 173.554 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 173.24 -58.8 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 106.956 -1.498 . . . . 1.1 106.956 -165.742 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -43.48 -31.62 0.74 Allowed 'General case' 0 C--O 1.218 -0.556 0 C-N-CA 126.291 1.836 . . . . 1.31 114.478 -169.386 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -45.5 -47.9 14.08 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 119.235 0.925 . . . . 0.62 112.874 173.775 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -67.21 -42.31 84.31 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-O 122.239 1.019 . . . . 1.78 109.789 -179.86 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -64.86 -43.52 92.72 Favored 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 123.734 0.814 . . . . 2.41 109.425 -175.059 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 26.6 pt -67.1 -39.38 83.1 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.858 0 O-C-N 121.426 -0.796 . . . . 0.74 111.02 176.522 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.63 -40.56 72.31 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 118.649 0.659 . . . . 0.65 110.787 171.907 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.85 -57.09 10.91 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 121.914 -0.491 . . . . 0.57 111.057 171.557 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -46.81 -47.59 21.0 Favored 'General case' 0 N--CA 1.462 0.158 0 C-N-CA 125.895 1.678 . . . . 0.57 111.138 -177.862 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 16.0 tp -48.45 -48.54 37.42 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 125.941 1.696 . . . . 2.6 109.595 178.243 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 -82.94 -43.3 16.63 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 110.517 -0.179 . . . . 3.24 110.517 -174.297 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -66.87 -38.85 87.12 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 110.527 -0.175 . . . . 2.29 110.527 -173.561 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 56.6 m -106.92 62.55 0.63 Allowed 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 124.537 1.135 . . . . 1.52 108.084 166.905 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -74.95 -41.93 58.66 Favored 'General case' 0 N--CA 1.464 0.265 0 O-C-N 121.799 -0.563 . . . . 5.31 109.514 170.972 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -78.81 148.39 72.4 Favored Pre-proline 0 N--CA 1.45 -0.459 0 C-N-CA 123.741 0.816 . . . . 1.98 111.126 -160.238 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -66.3 130.11 23.18 Favored 'Trans proline' 0 N--CA 1.449 -1.114 0 C-N-CA 123.006 2.471 . . . . 1.3 110.915 -175.146 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 74.4 37.62 0.56 Allowed 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 127.689 2.396 . . . . 2.97 110.343 173.317 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 16.1 m -115.71 -6.56 12.14 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.214 1.006 . . . . 0.66 112.759 -173.945 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -80.62 83.42 6.4 Favored 'General case' 0 CA--C 1.535 0.393 0 O-C-N 120.694 -1.254 . . . . 2.3 111.248 -160.836 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -68.17 143.54 96.02 Favored Pre-proline 0 CA--C 1.534 0.332 0 O-C-N 121.596 -0.69 . . . . 2.57 110.183 178.143 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -71.6 -62.52 0.04 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.24 0 C-N-CA 122.562 2.175 . . . . 0.65 111.883 -175.095 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 37.1 mt-30 -55.07 -46.05 75.38 Favored 'General case' 0 C--O 1.233 0.193 0 C-N-CA 123.254 0.621 . . . . 2.4 109.801 179.336 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 42.8 tptt -49.96 -56.64 9.82 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 116.009 -0.541 . . . . 3.26 109.786 173.218 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 54.9 t80 -56.26 -50.97 69.84 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 111.534 0.198 . . . . 2.26 111.534 179.841 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 31.0 m-85 -56.67 -34.6 67.53 Favored 'General case' 0 CA--C 1.532 0.272 0 O-C-N 121.319 -0.863 . . . . 5.25 112.008 -178.963 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 5.5 mm-40 -71.93 -58.6 3.32 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 108.568 -0.901 . . . . 3.17 108.568 174.567 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -63.99 -25.28 68.06 Favored 'General case' 0 N--CA 1.439 -1.005 0 C-N-CA 123.945 0.898 . . . . 0.65 111.839 -169.401 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 18.5 t -85.02 -7.83 58.97 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 126.02 1.728 . . . . 1.48 111.44 179.318 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 86.24 -11.78 62.21 Favored Glycine 0 C--N 1.338 0.674 0 N-CA-C 111.376 -0.69 . . . . 0.7 111.376 174.512 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 93.5 mt -54.78 -42.83 72.23 Favored 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 125.516 1.526 . . . . 1.29 111.029 -179.654 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 5.3 t -72.02 -13.5 61.62 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.102 0.561 . . . . 1.87 111.977 177.159 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -89.45 -35.94 15.71 Favored 'General case' 0 N--CA 1.452 -0.345 0 O-C-N 121.337 -0.852 . . . . 3.49 109.863 174.469 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 59.9 mtt -57.13 152.39 13.57 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 121.603 0.716 . . . . 2.89 111.361 174.295 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 23.8 t -78.69 154.76 29.86 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 116.213 -0.449 . . . . 1.99 109.905 174.579 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -41.0 -44.57 2.4 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 125.602 1.561 . . . . 0.56 112.129 176.018 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 68.3 m-80 -54.33 -58.22 8.24 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.304 0.642 . . . . 1.59 110.339 178.85 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 3.6 mm-40 -59.82 -44.61 93.93 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 123.077 0.551 . . . . 2.67 109.849 -179.864 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.416 ' CG1' ' CZ ' ' A' ' 48' ' ' PHE . 53.1 t -57.91 -43.95 85.59 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 CA-C-O 121.293 0.568 . . . . 0.6 109.523 -179.264 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 21.6 tttt -63.27 -48.92 76.14 Favored 'General case' 0 N--CA 1.452 -0.37 0 O-C-N 121.289 -0.882 . . . . 2.98 110.922 176.288 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -51.54 -54.09 31.02 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 118.18 0.446 . . . . 3.07 110.671 176.363 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.512 HG12 HG22 ' A' ' 3' ' ' ILE 0.27 17.4 m -54.7 -44.34 70.04 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.206 0 CA-C-O 118.826 -0.607 . . . . 0.58 110.984 178.802 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.559 ' CZ ' ' HB3' ' A' ' 103' ' ' PHE . 15.1 m-30 -54.21 -40.39 67.6 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 119.153 0.888 . . . . 5.94 112.783 174.343 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 69.7 mtp85 -57.25 -42.02 80.72 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 118.613 0.642 . . . . 2.96 109.947 174.906 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 -68.64 -33.24 73.67 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 118.67 -0.681 . . . . 5.56 110.949 176.77 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 14.0 mm -63.65 -59.81 3.72 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 CA-C-O 118.433 -0.794 . . . . 1.5 110.89 175.718 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 55.6 t0 -74.13 71.18 1.63 Allowed 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 119.194 0.906 . . . . 1.87 110.554 -175.791 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 27.7 t30 -46.32 -47.24 18.49 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 125.888 1.675 . . . . 1.92 111.0 176.617 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -64.39 -19.26 65.38 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 126.639 1.976 . . . . 3.96 112.12 -177.905 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 59.64 12.64 2.97 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 127.08 2.152 . . . . 4.61 113.58 178.677 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 3.9 p -70.12 -10.32 58.39 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 113.83 1.048 . . . . 2.21 113.83 -170.138 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 85.71 34.89 12.4 Favored Glycine 0 CA--C 1.529 0.937 0 CA-C-N 118.933 0.788 . . . . 2.43 111.968 172.067 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -171.05 143.71 2.01 Favored 'General case' 0 CA--C 1.519 -0.233 0 C-N-CA 127.289 2.235 . . . . 2.75 105.001 175.625 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -102.93 68.54 1.0 Allowed 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 107.309 -1.367 . . . . 2.27 107.309 176.272 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -56.81 146.45 26.16 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.744 1.618 . . . . 1.67 110.761 179.362 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -44.89 -51.26 9.84 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 123.512 0.725 . . . . 3.54 112.953 -175.395 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -69.67 -19.62 63.59 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 121.968 -0.457 . . . . 3.28 111.917 -173.39 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 91.4 mt-10 -77.64 -44.57 27.77 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-O 121.293 0.568 . . . . 2.39 109.598 167.413 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 6.4 tp -53.23 -28.24 26.2 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.644 0.777 . . . . 2.63 110.978 174.191 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 30.2 ttpt -50.67 -16.71 0.42 Allowed 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 113.904 1.076 . . . . 2.47 113.904 169.326 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 27.5 p90 -127.48 33.93 4.76 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 120.097 1.317 . . . . 5.25 112.634 170.138 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 46.4 t80 -57.76 -67.36 0.34 Allowed 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.649 0.78 . . . . 2.45 110.794 178.431 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 2.9 tp -85.38 -9.27 57.79 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.473 -0.767 . . . . 2.39 112.066 -175.79 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 49.5 mm-40 -56.0 -18.72 10.11 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.098 0.959 . . . . 1.61 111.399 171.405 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -83.04 -16.39 47.22 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 121.196 -0.94 . . . . 3.55 111.476 177.969 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 6.3 m-30 -101.16 -53.87 2.92 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 124.674 1.189 . . . . 3.25 108.916 -179.1 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -112.83 161.2 17.21 Favored 'General case' 0 C--O 1.222 -0.371 0 N-CA-C 106.606 -1.627 . . . . 3.35 106.606 175.8 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 24.1 m -85.66 -34.62 21.27 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 118.896 0.771 . . . . 2.08 110.524 172.629 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -114.48 42.61 1.88 Allowed Glycine 0 CA--C 1.519 0.324 0 N-CA-C 109.568 -1.413 . . . . 1.04 109.568 -170.444 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.08 -171.57 0.92 Allowed 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 120.953 0.406 . . . . 1.28 111.01 177.552 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.7 -13.59 39.31 Favored 'General case' 0 N--CA 1.453 -0.287 0 O-C-N 121.696 -0.628 . . . . 3.0 112.545 -166.112 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -46.47 -40.59 12.64 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 126.842 2.057 . . . . 3.11 112.802 -163.445 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.401 HD22 ' H ' ' A' ' 78' ' ' LEU . 0.2 OUTLIER -49.04 -43.1 40.37 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.607 1.163 . . . . 0.81 112.144 175.584 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 91.8 m -69.26 104.77 2.31 Favored 'General case' 0 C--O 1.235 0.304 0 O-C-N 121.523 -0.736 . . . . 0.77 109.98 175.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -54.77 -41.98 71.14 Favored 'General case' 0 C--O 1.219 -0.542 0 CA-C-N 115.609 -0.723 . . . . 3.07 111.671 178.807 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 34.7 t -54.28 -53.91 47.37 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-O 121.463 0.649 . . . . 1.79 111.081 -178.463 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -63.36 -47.67 81.12 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 124.074 0.949 . . . . 2.89 108.577 -178.765 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -52.22 -44.91 65.03 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 116.177 -0.465 . . . . 0.55 111.229 174.232 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -76.42 -27.3 56.2 Favored 'General case' 0 C--O 1.221 -0.422 0 C-N-CA 124.219 1.007 . . . . 5.09 110.718 -175.793 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 24.6 m -61.6 -45.96 91.87 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 119.089 0.859 . . . . 1.5 109.798 168.667 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -59.3 -57.91 10.96 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 110.039 -0.356 . . . . 2.78 110.039 172.194 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 22.2 ttp -47.16 -52.64 15.05 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.22 0.608 . . . . 3.07 111.366 178.214 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -49.65 -51.37 38.41 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 126.117 1.767 . . . . 0.5 111.537 -172.028 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -78.02 -41.73 34.81 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-O 119.853 -0.118 . . . . 0.49 111.294 179.835 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -54.81 -41.36 70.54 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-O 120.682 0.277 . . . . 0.35 111.036 179.263 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -77.76 80.96 4.21 Favored 'General case' 0 N--CA 1.445 -0.688 0 C-N-CA 123.245 0.618 . . . . 0.93 111.083 -176.574 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 52.8 p-10 -76.26 41.31 0.23 Allowed 'General case' 0 CA--C 1.541 0.633 0 O-C-N 121.405 -0.809 . . . . 2.79 112.16 176.374 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 29.2 m-20 -126.11 -58.98 1.35 Allowed 'General case' 0 C--N 1.342 0.251 0 C-N-CA 126.193 1.797 . . . . 1.25 108.299 172.913 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 93.94 44.33 3.62 Favored Glycine 0 CA--C 1.53 0.971 0 N-CA-C 109.147 -1.581 . . . . 0.82 109.147 -157.304 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 41.0 p-10 -124.87 -47.43 1.8 Allowed 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 124.621 1.168 . . . . 2.05 110.318 172.395 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 115.7 -31.24 6.22 Favored Glycine 0 CA--C 1.524 0.638 0 C-N-CA 124.618 1.104 . . . . 0.64 111.227 170.655 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 21.5 pttp -69.34 114.22 7.39 Favored 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 107.692 -1.225 . . . . 5.16 107.692 168.715 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 19.7 mt -103.83 115.57 46.02 Favored 'Isoleucine or valine' 0 C--O 1.231 0.13 0 C-N-CA 123.551 0.74 . . . . 0.66 109.36 -171.842 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -72.28 162.15 54.48 Favored Glycine 0 CA--C 1.534 1.267 0 CA-C-O 121.831 0.684 . . . . 0.55 112.143 172.463 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -57.11 -40.09 76.38 Favored 'General case' 0 C--O 1.226 -0.184 0 O-C-N 121.78 -0.835 . . . . 0.6 109.673 172.106 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -56.19 -54.18 48.23 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.978 0.911 . . . . 2.57 110.274 177.262 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -51.66 -50.53 60.19 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.079 0.952 . . . . 1.27 110.422 176.954 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' PHE . . . . . 0.559 ' HB3' ' CZ ' ' A' ' 48' ' ' PHE . 3.4 m-85 -61.12 -44.22 97.68 Favored 'General case' 0 CA--C 1.534 0.364 0 O-C-N 121.87 -0.519 . . . . 3.78 111.709 177.847 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 30.9 tt0 -57.42 -49.83 74.95 Favored 'General case' 0 C--O 1.222 -0.384 0 N-CA-C 108.796 -0.816 . . . . 2.07 108.796 178.877 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -47.01 -60.39 2.48 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 123.521 0.729 . . . . 3.24 110.548 172.913 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.22 -43.42 98.87 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 120.378 -0.529 . . . . 2.85 110.976 -172.257 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 66.2 t -64.23 -38.93 83.78 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.428 0 CA-C-O 119.306 -0.378 . . . . 1.01 111.227 176.596 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 79.5 t60 -66.42 -22.48 66.23 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 124.376 1.07 . . . . 2.6 110.055 -173.899 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 22.7 t . . . . . 0 C--O 1.253 1.273 0 CA-C-O 115.343 -2.265 . . . . 2.58 112.986 176.886 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 110' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 111' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 51.4 mtt . . . . . 0 N--CA 1.476 0.831 0 N-CA-C 110.418 -0.215 . . . . 7.19 110.418 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.0 m -161.95 -66.92 0.05 Allowed 'General case' 0 C--O 1.225 -0.195 0 N-CA-C 108.616 -0.883 . . . . 2.5 108.616 176.356 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.512 HG22 HG12 ' A' ' 47' ' ' VAL . 1.6 pp -91.65 -30.06 4.72 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.206 0 C-N-CA 123.77 0.828 . . . . 1.24 110.567 -169.416 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 12.5 t -66.0 -9.85 34.12 Favored 'General case' 0 N--CA 1.426 -1.667 0 C-N-CA 127.673 2.389 . . . . 1.69 112.078 -174.386 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 26.4 t0 -138.59 28.46 2.44 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.14 0.976 . . . . 2.81 109.822 178.206 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 1.1 p -100.55 -46.74 11.77 Favored 'Isoleucine or valine' 0 C--N 1.344 0.327 0 O-C-N 121.682 -0.636 . . . . 1.93 109.907 173.554 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 173.24 -58.8 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 106.956 -1.498 . . . . 1.1 106.956 -165.742 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -43.48 -31.62 0.74 Allowed 'General case' 0 C--O 1.218 -0.556 0 C-N-CA 126.291 1.836 . . . . 1.31 114.478 -169.386 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -45.5 -47.9 14.08 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 119.235 0.925 . . . . 0.62 112.874 173.775 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -67.21 -42.31 84.31 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-O 122.239 1.019 . . . . 1.78 109.789 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -64.86 -43.52 92.72 Favored 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 123.734 0.814 . . . . 2.41 109.425 -175.059 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 26.6 pt -67.1 -39.38 83.1 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.858 0 O-C-N 121.426 -0.796 . . . . 0.74 111.02 176.522 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.63 -40.56 72.31 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 118.649 0.659 . . . . 0.65 110.787 171.907 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.85 -57.09 10.91 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 121.914 -0.491 . . . . 0.57 111.057 171.557 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -46.81 -47.59 21.0 Favored 'General case' 0 N--CA 1.462 0.158 0 C-N-CA 125.895 1.678 . . . . 0.57 111.138 -177.862 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 16.0 tp -48.45 -48.54 37.42 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 125.941 1.696 . . . . 2.6 109.595 178.243 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 -82.94 -43.3 16.63 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 110.517 -0.179 . . . . 3.24 110.517 -174.297 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -66.87 -38.85 87.12 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 110.527 -0.175 . . . . 2.29 110.527 -173.561 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 56.6 m -106.92 62.55 0.63 Allowed 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 124.537 1.135 . . . . 1.52 108.084 166.905 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -74.95 -41.93 58.66 Favored 'General case' 0 N--CA 1.464 0.265 0 O-C-N 121.799 -0.563 . . . . 5.31 109.514 170.972 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -78.81 148.39 72.4 Favored Pre-proline 0 N--CA 1.45 -0.459 0 C-N-CA 123.741 0.816 . . . . 1.98 111.126 -160.238 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -66.3 130.11 23.18 Favored 'Trans proline' 0 N--CA 1.449 -1.114 0 C-N-CA 123.006 2.471 . . . . 1.3 110.915 -175.146 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 74.4 37.62 0.56 Allowed 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 127.689 2.396 . . . . 2.97 110.343 173.317 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 16.1 m -115.71 -6.56 12.14 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.214 1.006 . . . . 0.66 112.759 -173.945 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -80.62 83.42 6.4 Favored 'General case' 0 CA--C 1.535 0.393 0 O-C-N 120.694 -1.254 . . . . 2.3 111.248 -160.836 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -68.17 143.54 96.02 Favored Pre-proline 0 CA--C 1.534 0.332 0 O-C-N 121.596 -0.69 . . . . 2.57 110.183 178.143 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -71.6 -62.52 0.04 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.24 0 C-N-CA 122.562 2.175 . . . . 0.65 111.883 -175.095 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 37.1 mt-30 -55.07 -46.05 75.38 Favored 'General case' 0 C--O 1.233 0.193 0 C-N-CA 123.254 0.621 . . . . 2.4 109.801 179.336 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 42.8 tptt -49.96 -56.64 9.82 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 116.009 -0.541 . . . . 3.26 109.786 173.218 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 54.9 t80 -56.26 -50.97 69.84 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 111.534 0.198 . . . . 2.26 111.534 179.841 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 31.0 m-85 -56.67 -34.6 67.53 Favored 'General case' 0 CA--C 1.532 0.272 0 O-C-N 121.319 -0.863 . . . . 5.25 112.008 -178.963 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 5.5 mm-40 -71.93 -58.6 3.32 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 108.568 -0.901 . . . . 3.17 108.568 174.567 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -63.99 -25.28 68.06 Favored 'General case' 0 N--CA 1.439 -1.005 0 C-N-CA 123.945 0.898 . . . . 0.65 111.839 -169.401 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 18.5 t -85.02 -7.83 58.97 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 126.02 1.728 . . . . 1.48 111.44 179.318 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 86.24 -11.78 62.21 Favored Glycine 0 C--N 1.338 0.674 0 N-CA-C 111.376 -0.69 . . . . 0.7 111.376 174.512 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 93.5 mt -54.78 -42.83 72.23 Favored 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 125.516 1.526 . . . . 1.29 111.029 -179.654 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 5.3 t -72.02 -13.5 61.62 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.102 0.561 . . . . 1.87 111.977 177.159 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -89.45 -35.94 15.71 Favored 'General case' 0 N--CA 1.452 -0.345 0 O-C-N 121.337 -0.852 . . . . 3.49 109.863 174.469 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 59.9 mtt -57.13 152.39 13.57 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 121.603 0.716 . . . . 2.89 111.361 174.295 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 23.8 t -78.69 154.76 29.86 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 116.213 -0.449 . . . . 1.99 109.905 174.579 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -41.0 -44.57 2.4 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 125.602 1.561 . . . . 0.56 112.129 176.018 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 68.3 m-80 -54.33 -58.22 8.24 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.304 0.642 . . . . 1.59 110.339 178.85 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 3.6 mm-40 -59.82 -44.61 93.93 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 123.077 0.551 . . . . 2.67 109.849 -179.864 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.416 ' CG1' ' CZ ' ' A' ' 48' ' ' PHE . 53.1 t -57.91 -43.95 85.59 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 CA-C-O 121.293 0.568 . . . . 0.6 109.523 -179.264 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 21.6 tttt -63.27 -48.92 76.14 Favored 'General case' 0 N--CA 1.452 -0.37 0 O-C-N 121.289 -0.882 . . . . 2.98 110.922 176.288 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -51.54 -54.09 31.02 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 118.18 0.446 . . . . 3.07 110.671 176.363 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.512 HG12 HG22 ' A' ' 3' ' ' ILE 0.27 17.4 m -54.7 -44.34 70.04 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.206 0 CA-C-O 118.826 -0.607 . . . . 0.58 110.984 178.802 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.559 ' CZ ' ' HB3' ' A' ' 103' ' ' PHE . 15.1 m-30 -54.21 -40.39 67.6 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 119.153 0.888 . . . . 5.94 112.783 174.343 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 69.7 mtp85 -57.25 -42.02 80.72 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 118.613 0.642 . . . . 2.96 109.947 174.906 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 -68.64 -33.24 73.67 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 118.67 -0.681 . . . . 5.56 110.949 176.77 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 14.0 mm -63.65 -59.81 3.72 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 CA-C-O 118.433 -0.794 . . . . 1.5 110.89 175.718 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 55.6 t0 -74.13 71.18 1.63 Allowed 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 119.194 0.906 . . . . 1.87 110.554 -175.791 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 27.7 t30 -46.32 -47.24 18.49 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 125.888 1.675 . . . . 1.92 111.0 176.617 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -64.39 -19.26 65.38 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 126.639 1.976 . . . . 3.96 112.12 -177.905 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 59.64 12.64 2.97 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 127.08 2.152 . . . . 4.61 113.58 178.677 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 3.9 p -70.12 -10.32 58.39 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 113.83 1.048 . . . . 2.21 113.83 -170.138 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 85.71 34.89 12.4 Favored Glycine 0 CA--C 1.529 0.937 0 CA-C-N 118.933 0.788 . . . . 2.43 111.968 172.067 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -171.05 143.71 2.01 Favored 'General case' 0 CA--C 1.519 -0.233 0 C-N-CA 127.289 2.235 . . . . 2.75 105.001 175.625 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -102.93 68.54 1.0 Allowed 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 107.309 -1.367 . . . . 2.27 107.309 176.272 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -56.81 146.45 26.16 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.744 1.618 . . . . 1.67 110.761 179.362 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -44.89 -51.26 9.84 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 123.512 0.725 . . . . 3.54 112.953 -175.395 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -69.67 -19.62 63.59 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 121.968 -0.457 . . . . 3.28 111.917 -173.39 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 91.4 mt-10 -77.64 -44.57 27.77 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-O 121.293 0.568 . . . . 2.39 109.598 167.413 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 6.4 tp -53.23 -28.24 26.2 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.644 0.777 . . . . 2.63 110.978 174.191 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 30.2 ttpt -50.67 -16.71 0.42 Allowed 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 113.904 1.076 . . . . 2.47 113.904 169.326 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 27.5 p90 -127.48 33.93 4.76 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 120.097 1.317 . . . . 5.25 112.634 170.138 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 46.4 t80 -57.76 -67.36 0.34 Allowed 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.649 0.78 . . . . 2.45 110.794 178.431 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 2.9 tp -85.38 -9.27 57.79 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.473 -0.767 . . . . 2.39 112.066 -175.79 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 49.5 mm-40 -56.0 -18.72 10.11 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.098 0.959 . . . . 1.61 111.399 171.405 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -83.04 -16.39 47.22 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 121.196 -0.94 . . . . 3.55 111.476 177.969 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 6.3 m-30 -101.16 -53.87 2.92 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 124.674 1.189 . . . . 3.25 108.916 -179.1 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -112.83 161.2 17.21 Favored 'General case' 0 C--O 1.222 -0.371 0 N-CA-C 106.606 -1.627 . . . . 3.35 106.606 175.8 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 24.1 m -85.66 -34.62 21.27 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 118.896 0.771 . . . . 2.08 110.524 172.629 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -114.48 42.61 1.88 Allowed Glycine 0 CA--C 1.519 0.324 0 N-CA-C 109.568 -1.413 . . . . 1.04 109.568 -170.444 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.08 -171.57 0.92 Allowed 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 120.953 0.406 . . . . 1.28 111.01 177.552 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.7 -13.59 39.31 Favored 'General case' 0 N--CA 1.453 -0.287 0 O-C-N 121.696 -0.628 . . . . 3.0 112.545 -166.112 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -46.47 -40.59 12.64 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 126.842 2.057 . . . . 3.11 112.802 -163.445 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.401 HD22 ' H ' ' A' ' 78' ' ' LEU . 0.2 OUTLIER -49.04 -43.1 40.37 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.607 1.163 . . . . 0.81 112.144 175.584 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 91.8 m -69.26 104.77 2.31 Favored 'General case' 0 C--O 1.235 0.304 0 O-C-N 121.523 -0.736 . . . . 0.77 109.98 175.997 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -54.77 -41.98 71.14 Favored 'General case' 0 C--O 1.219 -0.542 0 CA-C-N 115.609 -0.723 . . . . 3.07 111.671 178.807 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 34.7 t -54.28 -53.91 47.37 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-O 121.463 0.649 . . . . 1.79 111.081 -178.463 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -63.36 -47.67 81.12 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 124.074 0.949 . . . . 2.89 108.577 -178.765 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -52.22 -44.91 65.03 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 116.177 -0.465 . . . . 0.55 111.229 174.232 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -76.42 -27.3 56.2 Favored 'General case' 0 C--O 1.221 -0.422 0 C-N-CA 124.219 1.007 . . . . 5.09 110.718 -175.793 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 24.6 m -61.6 -45.96 91.87 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 119.089 0.859 . . . . 1.5 109.798 168.667 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -59.3 -57.91 10.96 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 110.039 -0.356 . . . . 2.78 110.039 172.194 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 22.2 ttp -47.16 -52.64 15.05 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.22 0.608 . . . . 3.07 111.366 178.214 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -49.65 -51.37 38.41 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 126.117 1.767 . . . . 0.5 111.537 -172.028 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -78.02 -41.73 34.81 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-O 119.853 -0.118 . . . . 0.49 111.294 179.835 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -54.81 -41.36 70.54 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-O 120.682 0.277 . . . . 0.35 111.036 179.263 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -77.76 80.96 4.21 Favored 'General case' 0 N--CA 1.445 -0.688 0 C-N-CA 123.245 0.618 . . . . 0.93 111.083 -176.574 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 52.8 p-10 -76.26 41.31 0.23 Allowed 'General case' 0 CA--C 1.541 0.633 0 O-C-N 121.405 -0.809 . . . . 2.79 112.16 176.374 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 29.2 m-20 -126.11 -58.98 1.35 Allowed 'General case' 0 C--N 1.342 0.251 0 C-N-CA 126.193 1.797 . . . . 1.25 108.299 172.913 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 93.94 44.33 3.62 Favored Glycine 0 CA--C 1.53 0.971 0 N-CA-C 109.147 -1.581 . . . . 0.82 109.147 -157.304 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 41.0 p-10 -124.87 -47.43 1.8 Allowed 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 124.621 1.168 . . . . 2.05 110.318 172.395 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 115.7 -31.24 6.22 Favored Glycine 0 CA--C 1.524 0.638 0 C-N-CA 124.618 1.104 . . . . 0.64 111.227 170.655 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 21.5 pttp -69.34 114.22 7.39 Favored 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 107.692 -1.225 . . . . 5.16 107.692 168.715 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 19.7 mt -103.83 115.57 46.02 Favored 'Isoleucine or valine' 0 C--O 1.231 0.13 0 C-N-CA 123.551 0.74 . . . . 0.66 109.36 -171.842 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -72.28 162.15 54.48 Favored Glycine 0 CA--C 1.534 1.267 0 CA-C-O 121.831 0.684 . . . . 0.55 112.143 172.463 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -57.11 -40.09 76.38 Favored 'General case' 0 C--O 1.226 -0.184 0 O-C-N 121.78 -0.835 . . . . 0.6 109.673 172.106 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -56.19 -54.18 48.23 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.978 0.911 . . . . 2.57 110.274 177.262 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -51.66 -50.53 60.19 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.079 0.952 . . . . 1.27 110.422 176.954 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' PHE . . . . . 0.559 ' HB3' ' CZ ' ' A' ' 48' ' ' PHE . 3.4 m-85 -61.12 -44.22 97.68 Favored 'General case' 0 CA--C 1.534 0.364 0 O-C-N 121.87 -0.519 . . . . 3.78 111.709 177.847 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 30.9 tt0 -57.42 -49.83 74.95 Favored 'General case' 0 C--O 1.222 -0.384 0 N-CA-C 108.796 -0.816 . . . . 2.07 108.796 178.877 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -47.01 -60.39 2.48 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 123.521 0.729 . . . . 3.24 110.548 172.913 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.22 -43.42 98.87 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 120.378 -0.529 . . . . 2.85 110.976 -172.257 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 66.2 t -64.23 -38.93 83.78 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.428 0 CA-C-O 119.306 -0.378 . . . . 1.01 111.227 176.596 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 79.5 t60 -66.42 -22.48 66.23 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 124.376 1.07 . . . . 2.6 110.055 -173.899 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 22.7 t . . . . . 0 C--O 1.253 1.273 0 CA-C-O 115.343 -2.265 . . . . 2.58 112.986 176.886 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 110' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 111' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 17.1 mmt . . . . . 0 N--CA 1.47 0.565 0 N-CA-C 108.514 -0.921 . . . . 8.91 108.514 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 75.7 m -161.38 170.49 19.98 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 104.771 -2.307 . . . . 2.6 104.771 176.562 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.689 HG22 HG12 ' A' ' 47' ' ' VAL . 1.3 pp -47.27 -37.79 4.71 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.679 0 C-N-CA 123.806 0.842 . . . . 1.22 112.662 -173.062 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 14.8 t -68.89 -7.06 31.22 Favored 'General case' 0 N--CA 1.429 -1.491 0 C-N-CA 127.866 2.466 . . . . 1.82 112.812 -177.241 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 47.1 t0 -153.11 44.34 0.64 Allowed 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.438 1.495 . . . . 2.54 108.891 -177.766 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 13.2 t -128.29 -59.14 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.339 0.133 0 C-N-CA 126.171 1.788 . . . . 1.55 108.936 174.49 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -172.54 -47.55 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.14 0 N-CA-C 106.986 -1.487 . . . . 1.29 106.986 -175.194 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 2.4 m -48.15 -32.66 7.24 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 114.46 1.282 . . . . 0.94 114.46 -175.747 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -51.19 -40.72 59.3 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 119.363 0.983 . . . . 0.85 113.218 174.818 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -76.04 -37.15 58.67 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 121.54 0.686 . . . . 2.17 109.791 177.854 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 23.2 m-20 -57.47 -52.31 65.9 Favored 'General case' 0 C--O 1.234 0.278 0 C-N-CA 124.083 0.953 . . . . 2.59 108.569 -179.43 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 28.3 pt -61.8 -39.3 82.9 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.278 0 CA-C-N 115.352 -0.84 . . . . 0.73 109.929 -178.131 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -54.23 -44.68 71.91 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 118.267 0.485 . . . . 0.66 111.045 174.885 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.96 -59.14 5.24 Favored 'General case' 0 CA--C 1.53 0.185 0 O-C-N 121.908 -0.495 . . . . 0.64 110.84 174.495 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -48.79 -46.06 41.05 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 124.132 0.973 . . . . 0.63 112.015 -177.56 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -50.11 -44.07 52.02 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 125.369 1.468 . . . . 2.78 109.346 177.52 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 13.7 mt-30 -85.09 -30.19 24.26 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-O 118.285 -0.864 . . . . 2.82 112.623 -178.967 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -74.33 -25.56 59.62 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 119.956 1.253 . . . . 2.43 111.207 -179.66 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 91.6 m -128.16 46.51 2.56 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.037 1.335 . . . . 1.42 110.009 177.419 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.67 -40.43 63.7 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 119.048 0.84 . . . . 6.56 109.309 171.769 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -62.18 133.96 94.42 Favored Pre-proline 0 N--CA 1.445 -0.702 0 C-N-CA 124.756 1.222 . . . . 3.06 108.151 -171.988 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 55.1 Cg_endo -60.17 142.83 99.16 Favored 'Trans proline' 0 N--CA 1.448 -1.189 0 C-N-CA 121.957 1.771 . . . . 1.33 109.751 -174.128 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 69.45 21.73 6.74 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.905 0.882 . . . . 3.32 111.615 170.049 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.1 m -113.81 11.02 17.89 Favored 'General case' 0 C--N 1.347 0.458 0 C-N-CA 125.142 1.377 . . . . 0.95 112.148 -179.531 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -84.98 114.16 21.95 Favored 'General case' 0 C--O 1.232 0.143 0 N-CA-C 107.863 -1.162 . . . . 2.28 107.863 179.76 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -110.78 149.05 39.79 Favored Pre-proline 0 CA--C 1.534 0.331 0 C-N-CA 124.264 1.026 . . . . 2.76 109.473 174.319 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_endo -65.7 -73.34 0.02 OUTLIER 'Trans proline' 0 N--CA 1.452 -0.917 0 C-N-CA 123.353 2.702 . . . . 0.69 111.614 -173.578 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -49.73 -43.79 48.0 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 124.964 1.306 . . . . 2.54 110.772 -179.858 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.53 -64.57 0.77 Allowed 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 125.834 1.654 . . . . 2.8 110.454 175.81 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 65.8 t80 -58.14 -43.51 87.35 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-O 122.85 1.31 . . . . 2.01 110.981 -179.795 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.518 ' CE1' ' HA ' ' A' ' 107' ' ' VAL . 3.8 t80 -52.16 -51.57 57.18 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.117 0.967 . . . . 4.65 112.1 178.485 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 30.1 mt-30 -72.56 -36.81 68.31 Favored 'General case' 0 N--CA 1.45 -0.43 0 O-C-N 121.431 -0.793 . . . . 3.81 110.724 176.901 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -64.14 -41.18 97.3 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-N 119.139 0.881 . . . . 1.37 110.983 -176.559 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 11.5 p -62.3 -50.3 72.19 Favored 'General case' 0 N--CA 1.441 -0.895 0 N-CA-C 106.777 -1.564 . . . . 2.9 106.777 173.885 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 102.39 20.58 11.9 Favored Glycine 0 CA--C 1.521 0.464 0 N-CA-C 109.619 -1.392 . . . . 1.72 109.619 -176.829 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 32.5 mt -60.08 -24.81 64.91 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 121.866 -0.785 . . . . 1.46 109.772 168.809 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 22.8 t -62.05 -24.78 67.29 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 123.459 0.704 . . . . 2.41 110.52 173.944 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -92.83 -24.74 18.4 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 123.006 0.522 . . . . 4.29 109.831 178.457 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 21.1 mmt -66.85 144.88 56.02 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 121.674 0.749 . . . . 3.83 111.141 176.387 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 8.5 t -75.01 156.26 36.44 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.983 -0.553 . . . . 2.02 109.512 179.336 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -45.53 -43.35 11.76 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 124.335 1.054 . . . . 0.6 111.435 176.447 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -49.96 -62.85 1.33 Allowed 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.66 0.784 . . . . 2.87 110.587 175.339 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 1.7 mm-40 -56.25 -46.45 79.63 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 122.983 0.513 . . . . 3.19 109.924 -179.315 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 78.4 t -58.4 -38.67 71.07 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.646 0 O-C-N 122.07 -0.394 . . . . 0.54 110.419 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 14.7 tptt -68.68 -44.26 74.39 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 121.182 -0.948 . . . . 4.21 111.091 176.898 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 73.6 m-20 -59.09 -53.43 58.47 Favored 'General case' 0 C--O 1.232 0.163 0 N-CA-C 109.767 -0.457 . . . . 2.9 109.767 178.85 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.689 HG12 HG22 ' A' ' 3' ' ' ILE . 7.8 m -58.2 -43.75 86.36 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 N-CA-C 109.505 -0.554 . . . . 0.65 109.505 176.907 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.439 ' CE1' ' HB2' ' A' ' 100' ' ' ALA . 7.7 t80 -49.19 -48.69 45.01 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 118.482 0.583 . . . . 4.16 111.019 175.274 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 73.2 mtp180 -58.73 -37.68 76.71 Favored 'General case' 0 CA--C 1.532 0.266 0 O-C-N 121.684 -0.635 . . . . 4.02 112.432 177.583 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 9.8 m-85 -62.7 -33.71 75.66 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 118.497 0.589 . . . . 3.57 110.18 174.122 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.3 mm -73.59 -47.14 45.97 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 CA-C-O 118.707 -0.663 . . . . 1.54 110.407 -179.303 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 20.1 t0 -73.32 65.29 0.85 Allowed 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 118.898 0.772 . . . . 1.9 108.969 176.445 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 10.8 t30 -58.29 -36.17 72.91 Favored 'General case' 0 C--N 1.332 -0.179 0 C-N-CA 125.104 1.361 . . . . 2.29 111.863 -170.598 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -73.38 -20.06 60.85 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.438 1.095 . . . . 2.55 111.955 175.782 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 14.0 mt-30 53.87 72.09 0.47 Allowed 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.831 1.652 . . . . 3.11 110.954 -175.016 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 89.4 p -105.72 -28.97 10.37 Favored 'General case' 0 C--N 1.34 0.171 0 C-N-CA 123.824 0.849 . . . . 1.41 111.909 174.609 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 87.74 7.41 74.97 Favored Glycine 0 CA--C 1.532 1.096 0 CA-C-O 119.398 -0.668 . . . . 1.53 112.063 -167.513 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 16.2 m-85 -134.11 133.57 41.23 Favored 'General case' 0 C--O 1.233 0.218 0 N-CA-C 108.214 -1.032 . . . . 2.5 108.214 164.526 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -93.33 80.58 4.42 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 126.689 1.995 . . . . 1.94 105.809 163.716 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -63.65 153.73 35.13 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 114.393 -1.276 . . . . 1.93 109.431 169.568 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -50.41 -46.1 56.08 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 124.345 1.058 . . . . 3.79 112.252 -173.15 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.5 tm-20 -59.56 -46.1 89.88 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 123.293 0.637 . . . . 3.61 110.355 -177.059 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 90.3 mt-10 -59.17 -43.79 92.13 Favored 'General case' 0 N--CA 1.451 -0.425 0 O-C-N 121.763 -0.585 . . . . 2.15 110.129 175.886 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -58.25 -37.63 75.31 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 122.289 -0.257 . . . . 2.2 110.607 175.559 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 21.0 ttmt -58.77 -12.32 4.18 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.966 0.906 . . . . 3.0 112.968 172.287 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 9.0 t80 -123.08 28.21 7.27 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.573 1.149 . . . . 5.06 110.47 173.176 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -66.06 -74.63 0.1 Allowed 'General case' 0 CA--C 1.53 0.181 0 O-C-N 121.247 -0.908 . . . . 2.65 110.604 -179.764 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.484 HD22 ' HB2' ' A' ' 75' ' ' ALA . 0.4 OUTLIER -68.01 -17.2 64.35 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 121.619 -0.675 . . . . 2.92 110.999 -164.592 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 78.0 mm-40 -51.03 -21.63 1.91 Allowed 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.911 1.684 . . . . 1.88 112.354 166.125 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 1.9 mmpt? -80.07 -25.35 40.09 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 121.07 -1.019 . . . . 3.15 111.385 176.077 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 16.6 m-30 -94.07 -62.7 1.3 Allowed 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 125.435 1.494 . . . . 3.1 109.551 -179.823 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -105.65 -178.91 3.79 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 125.983 1.713 . . . . 2.99 107.864 -179.276 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 20.0 m -124.04 47.45 2.06 Favored 'General case' 0 N--CA 1.461 0.101 0 C-N-CA 123.123 0.569 . . . . 2.5 111.088 177.535 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 154.18 59.39 0.01 OUTLIER Glycine 0 CA--C 1.519 0.343 0 N-CA-C 110.019 -1.232 . . . . 1.16 110.019 179.147 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.573 ' HB3' ' OE2' ' A' ' 77' ' ' GLU . . . -91.1 -142.41 0.18 Allowed 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 108.558 -0.904 . . . . 1.64 108.558 175.104 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -123.26 41.69 3.4 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 123.91 0.884 . . . . 5.02 110.659 -175.831 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.573 ' OE2' ' HB3' ' A' ' 75' ' ' ALA . 4.2 mp0 -77.06 -36.84 55.64 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 125.296 1.439 . . . . 4.78 109.028 177.557 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.487 ' H ' HD22 ' A' ' 78' ' ' LEU . 0.2 OUTLIER -52.99 -44.85 67.53 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 114.75 -1.114 . . . . 0.99 110.54 178.026 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 23.8 m -67.87 113.47 5.63 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 121.7 0.762 . . . . 1.02 110.43 179.55 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -58.75 -41.95 87.71 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-N 114.737 -1.12 . . . . 2.84 111.002 177.591 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 15.8 m -47.66 -60.21 2.72 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 119.066 0.848 . . . . 1.38 111.318 173.634 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.74 -40.39 79.86 Favored 'General case' 0 N--CA 1.454 -0.229 0 O-C-N 121.896 -0.503 . . . . 3.41 109.932 -171.989 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 1.1 m -53.28 -47.74 68.92 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-O 122.06 0.933 . . . . 0.66 108.89 171.303 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 33.5 tttp -70.14 -27.77 64.82 Favored 'General case' 0 N--CA 1.44 -0.973 0 C-N-CA 124.236 1.014 . . . . 4.9 111.473 -174.761 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 52.5 m -55.94 -47.91 76.7 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 120.195 1.362 . . . . 1.31 109.998 168.189 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 9.0 mt -60.76 -58.21 9.43 Favored 'General case' 0 C--O 1.233 0.226 0 N-CA-C 109.47 -0.567 . . . . 2.26 109.47 172.612 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 2.6 ttp -46.96 -43.6 19.33 Favored 'General case' 0 CA--C 1.535 0.366 0 O-C-N 123.528 0.517 . . . . 3.48 112.39 -178.092 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -56.45 -45.92 80.58 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 125.886 1.675 . . . . 0.62 111.668 -173.34 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -84.91 -44.6 13.02 Favored 'General case' 0 CA--C 1.521 -0.137 0 N-CA-C 110.575 -0.157 . . . . 0.68 110.575 178.51 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -55.99 -45.4 79.02 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 122.706 0.403 . . . . 0.36 110.483 -176.644 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -73.75 77.8 1.56 Allowed 'General case' 0 N--CA 1.448 -0.566 0 CA-C-O 121.274 0.559 . . . . 0.93 109.571 177.325 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -76.19 45.48 0.37 Allowed 'General case' 0 CA--C 1.538 0.496 0 O-C-N 121.477 -0.764 . . . . 2.7 111.827 178.286 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 62.5 m-20 -135.37 -58.93 0.78 Allowed 'General case' 0 C--N 1.338 0.07 0 C-N-CA 125.463 1.505 . . . . 1.57 109.278 -177.517 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 103.26 45.67 1.54 Allowed Glycine 0 CA--C 1.532 1.106 0 N-CA-C 110.025 -1.23 . . . . 0.87 110.025 -163.329 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -124.6 -61.89 1.29 Allowed 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 125.078 1.351 . . . . 1.97 109.687 171.085 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 127.43 -24.28 5.3 Favored Glycine 0 CA--C 1.529 0.948 0 C-N-CA 124.678 1.133 . . . . 0.7 111.563 177.733 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 40.0 mtpt -80.71 114.08 19.34 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 106.823 -1.547 . . . . 4.21 106.823 175.544 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 5.5 mt -95.16 153.6 3.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 N-CA-C 107.232 -1.395 . . . . 0.87 107.232 -178.09 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -132.03 -179.35 16.14 Favored Glycine 0 CA--C 1.522 0.47 0 N-CA-C 108.903 -1.679 . . . . 0.75 108.903 175.853 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' ALA . . . . . 0.439 ' HB2' ' CE1' ' A' ' 48' ' ' PHE . . . -66.06 -36.79 84.18 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 117.601 0.701 . . . . 0.7 110.404 -177.242 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 -60.02 -59.13 5.9 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-O 118.797 -0.62 . . . . 2.51 110.13 173.594 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -52.24 -47.98 65.44 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-O 121.767 0.794 . . . . 1.43 110.648 -179.664 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 58.7 t80 -62.46 -54.22 43.34 Favored 'General case' 0 N--CA 1.454 -0.27 0 O-C-N 121.821 -0.55 . . . . 3.6 110.363 -178.205 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 46.7 tt0 -55.44 -46.44 76.73 Favored 'General case' 0 C--O 1.22 -0.497 0 CA-C-O 118.294 -0.86 . . . . 2.17 110.613 177.747 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -51.96 -58.88 5.19 Favored 'General case' 0 CA--C 1.522 -0.126 0 CA-C-N 119.462 1.028 . . . . 3.09 110.075 176.67 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -55.8 -47.21 77.52 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 109.44 -0.578 . . . . 4.73 109.44 -179.475 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' VAL . . . . . 0.518 ' HA ' ' CE1' ' A' ' 31' ' ' PHE . 76.1 t -75.35 -6.06 8.08 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.795 0 C-N-CA 124.293 1.037 . . . . 1.4 112.552 -177.284 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 6.6 t60 -90.15 -11.58 40.75 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 120.086 -1.634 . . . . 2.72 110.221 173.983 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 28.5 t . . . . . 0 C--O 1.252 1.219 0 CA-C-O 114.935 -2.459 . . . . 2.31 114.016 -174.109 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 110' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 111' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.9 ttt . . . . . 0 N--CA 1.474 0.753 0 N-CA-C 108.3 -1.0 . . . . 6.92 108.3 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 11.6 t 157.74 -72.24 0.0 OUTLIER 'General case' 0 C--O 1.224 -0.284 0 C-N-CA 126.533 1.933 . . . . 3.93 106.154 -171.572 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.484 HG22 HG12 ' A' ' 47' ' ' VAL . 1.7 pp -96.66 -23.1 4.86 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.289 0 CA-C-O 121.65 0.738 . . . . 1.21 111.942 -167.73 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 12.9 t -65.91 -15.38 62.9 Favored 'General case' 0 N--CA 1.422 -1.844 0 C-N-CA 126.879 2.071 . . . . 1.96 111.616 -174.889 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 36.6 t0 -134.0 44.72 2.7 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.914 0.886 . . . . 2.86 109.537 -179.326 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 20.1 t -121.02 -61.82 2.09 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.229 0 C-N-CA 124.912 1.285 . . . . 1.58 109.4 177.636 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 9.1 tp -171.95 -61.55 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 104.991 -2.226 . . . . 1.67 104.991 -174.933 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -33.03 -37.83 0.03 OUTLIER 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 128.921 2.888 . . . . 1.2 115.8 -173.213 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -51.27 -41.12 60.18 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 118.94 0.791 . . . . 0.8 112.893 179.54 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.3 t0 -68.2 -45.5 73.17 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 122.86 1.314 . . . . 1.9 108.56 177.027 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -62.62 -47.63 82.9 Favored 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 125.143 1.377 . . . . 2.51 109.34 -170.171 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 26.6 pt -60.57 -38.28 77.8 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.877 0 C-N-CA 123.188 0.595 . . . . 0.97 111.394 176.402 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.84 -44.72 93.94 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 118.34 0.518 . . . . 1.07 110.045 177.484 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.85 -54.76 43.52 Favored 'General case' 0 C--O 1.234 0.247 0 O-C-N 122.174 -0.328 . . . . 0.89 110.471 172.055 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -48.55 -46.49 39.01 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 124.549 1.14 . . . . 0.72 111.272 -177.93 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -54.32 -43.44 71.17 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 124.6 1.16 . . . . 3.75 109.65 -179.475 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -77.99 -49.27 14.39 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 109.699 -0.482 . . . . 2.97 109.699 -176.096 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -59.69 -33.2 71.29 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 122.025 0.13 . . . . 3.2 110.904 -175.205 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 75.0 m -107.98 36.91 2.6 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 124.796 1.238 . . . . 1.34 110.493 177.359 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 53.7 ttt-85 -78.93 -30.86 44.91 Favored 'General case' 0 C--O 1.234 0.242 0 O-C-N 121.364 -0.835 . . . . 5.36 109.964 179.155 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 61.3 m-20 -74.27 144.87 82.18 Favored Pre-proline 0 CA--C 1.539 0.551 0 C-N-CA 123.789 0.836 . . . . 2.05 109.613 177.212 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -64.31 140.79 72.18 Favored 'Trans proline' 0 N--CA 1.456 -0.68 0 C-N-CA 123.505 2.803 . . . . 1.33 111.02 -176.087 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 62.73 10.83 4.45 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.084 1.353 . . . . 2.41 113.184 177.356 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 29.3 m -92.7 16.21 12.76 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.299 1.44 . . . . 1.12 110.957 -177.996 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 7.4 t80 -99.86 112.47 24.74 Favored 'General case' 0 N--CA 1.444 -0.764 0 N-CA-C 106.767 -1.568 . . . . 2.68 106.767 179.693 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -104.42 147.64 34.7 Favored Pre-proline 0 C--O 1.235 0.303 0 N-CA-C 108.257 -1.016 . . . . 4.86 108.257 167.598 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -62.05 -62.67 0.11 Allowed 'Trans proline' 0 N--CA 1.451 -1.015 0 C-N-CA 122.88 2.387 . . . . 0.57 111.176 -176.013 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 48.9 mt-30 -59.0 -40.63 85.5 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 123.177 0.591 . . . . 2.2 110.937 -173.684 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -50.45 -69.41 0.11 Allowed 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.54 1.136 . . . . 4.96 108.966 169.817 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 80.8 t80 -53.65 -43.39 68.77 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 123.583 0.753 . . . . 2.46 112.183 -175.216 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -50.59 -59.07 4.42 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 127.325 2.25 . . . . 4.78 109.983 177.093 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.73 -48.0 76.2 Favored 'General case' 0 N--CA 1.445 -0.693 0 N-CA-C 107.972 -1.121 . . . . 3.79 107.972 -177.072 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -63.35 -35.74 81.4 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 123.514 0.726 . . . . 0.69 112.914 -171.682 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 43.5 m -76.49 2.65 13.16 Favored 'General case' 0 N--CA 1.449 -0.518 0 O-C-N 123.705 0.628 . . . . 2.06 110.803 176.87 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 79.62 9.42 86.86 Favored Glycine 0 C--N 1.339 0.73 0 N-CA-C 110.951 -0.859 . . . . 0.7 110.951 169.258 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 50.0 mt -73.91 -24.06 59.63 Favored 'General case' 0 N--CA 1.441 -0.879 0 O-C-N 121.378 -1.072 . . . . 1.42 109.818 -172.979 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 26.3 p -66.29 -25.69 66.97 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.34 0.656 . . . . 2.57 111.063 168.853 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 13.1 tptt -86.27 -34.09 20.48 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 108.175 -1.046 . . . . 3.81 108.175 -177.726 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.4 ' O ' ' CB ' ' A' ' 40' ' ' SER . 36.2 mtt -47.67 -66.88 0.33 Allowed 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 114.702 1.371 . . . . 3.7 114.702 -177.064 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.4 ' CB ' ' O ' ' A' ' 39' ' ' MET . 42.1 t 113.99 139.93 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 128.714 2.806 . . . . 1.94 108.021 -172.788 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -37.22 -40.34 0.32 Allowed 'General case' 0 C--N 1.341 0.217 0 C-N-CA 125.206 1.402 . . . . 0.74 112.688 173.695 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 60.8 m-80 -56.9 -61.37 2.49 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-O 122.028 0.918 . . . . 2.11 109.703 -179.031 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.453 ' O ' HG13 ' A' ' 47' ' ' VAL . 28.8 tt0 -70.43 -35.57 73.46 Favored 'General case' 0 N--CA 1.439 -1.002 0 CA-C-N 115.165 -0.925 . . . . 3.24 109.558 -176.244 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 51.8 t -59.26 -49.31 83.91 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.67 0 CA-C-N 119.063 0.847 . . . . 0.56 108.994 178.653 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -55.08 -46.78 75.49 Favored 'General case' 0 N--CA 1.455 -0.221 0 O-C-N 121.361 -0.837 . . . . 2.82 110.608 173.31 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 33.7 t0 -56.2 -55.36 34.08 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 118.076 0.398 . . . . 2.47 110.778 178.597 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.484 HG12 HG22 ' A' ' 3' ' ' ILE . 3.1 m -52.79 -44.4 47.75 Favored 'Isoleucine or valine' 0 C--N 1.342 0.27 0 CA-C-O 118.983 -0.532 . . . . 0.79 110.304 179.468 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 16.0 m-30 -49.98 -39.71 41.82 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 118.535 0.607 . . . . 5.65 112.067 177.109 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 69.0 mtp180 -58.89 -30.17 67.58 Favored 'General case' 0 CA--C 1.532 0.259 0 O-C-N 121.195 -0.941 . . . . 3.22 111.989 179.145 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 18.1 t80 -70.02 -25.14 63.44 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.503 0.721 . . . . 4.01 110.919 178.054 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.438 HG21 ' CD1' ' A' ' 67' ' ' PHE . 4.1 mp -125.69 99.61 6.08 Favored 'Isoleucine or valine' 0 C--N 1.342 0.266 0 C-N-CA 124.066 0.946 . . . . 2.66 111.206 -177.02 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 57.0 t0 -155.99 -49.04 0.08 Allowed 'General case' 0 C--O 1.223 -0.338 0 C-N-CA 125.979 1.712 . . . . 3.9 106.388 166.56 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 17.6 t-20 97.62 -52.88 0.01 OUTLIER 'General case' 0 C--N 1.34 0.195 0 C-N-CA 128.31 2.644 . . . . 4.87 107.825 -178.128 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 40.6 m-20 -56.88 -46.22 82.03 Favored 'General case' 0 CA--C 1.528 0.107 0 CA-C-O 121.455 0.645 . . . . 2.99 110.24 169.201 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 59.26 63.32 1.61 Allowed 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 114.468 -1.242 . . . . 3.99 109.491 -152.569 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 98.0 p -103.22 -43.69 5.39 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 127.185 2.194 . . . . 2.47 110.424 178.821 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 108.97 -11.73 34.5 Favored Glycine 0 CA--C 1.534 1.23 0 C-N-CA 124.591 1.091 . . . . 1.81 111.626 -166.447 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 76.6 m-85 -100.51 115.44 30.11 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 124.698 1.199 . . . . 3.34 109.187 175.412 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -87.43 81.51 7.8 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 125.889 1.676 . . . . 1.87 106.855 167.101 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -63.59 144.14 57.25 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 114.306 -1.316 . . . . 1.38 109.19 174.674 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -40.26 -51.35 2.73 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 125.247 1.419 . . . . 3.48 113.95 -171.056 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -71.57 -22.27 61.76 Favored 'General case' 0 N--CA 1.452 -0.325 0 O-C-N 121.274 -0.891 . . . . 3.54 112.14 -173.921 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 89.0 mt-10 -67.9 -38.42 82.96 Favored 'General case' 0 N--CA 1.456 -0.171 0 O-C-N 120.725 -1.235 . . . . 2.09 108.694 169.29 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -51.02 -47.35 61.67 Favored 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 109.231 -0.655 . . . . 2.62 109.231 171.714 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 29.3 ttpt -54.99 -13.57 1.17 Allowed 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 114.466 1.284 . . . . 2.32 114.466 176.234 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 78.8 m-85 -124.03 10.21 8.79 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 119.876 1.217 . . . . 5.35 112.289 173.61 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.438 ' CD1' HG21 ' A' ' 51' ' ' ILE . 85.5 t80 -49.76 -64.51 0.79 Allowed 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.89 1.276 . . . . 2.77 111.548 -169.321 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 70.2 mt -65.2 -12.86 55.7 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 113.443 0.905 . . . . 2.42 113.443 -176.79 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 11.1 mm-40 -61.31 -30.66 70.64 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 120.458 1.481 . . . . 1.67 110.505 -179.796 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.9 mptm? -59.74 -30.03 68.56 Favored 'General case' 0 CA--C 1.531 0.247 0 O-C-N 122.157 -0.339 . . . . 2.84 111.897 172.344 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 9.4 m-30 -86.75 -53.75 4.76 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 123.305 0.642 . . . . 3.1 109.659 -179.438 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -143.22 123.29 13.63 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.275 1.03 . . . . 3.7 108.493 -174.99 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 79.8 p -44.7 -37.12 3.5 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 126.423 1.889 . . . . 2.4 112.26 174.585 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -106.4 28.44 13.54 Favored Glycine 0 CA--C 1.525 0.669 0 C-N-CA 125.883 1.706 . . . . 1.48 111.946 -172.649 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -71.42 -165.85 0.16 Allowed 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 117.956 0.878 . . . . 1.42 111.681 174.546 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 6.0 tpt180 -113.48 -9.75 13.27 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 115.626 1.713 . . . . 3.11 115.626 -158.412 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 55.1 mm-40 -59.35 -6.9 1.11 Allowed 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 114.06 1.133 . . . . 4.57 114.06 -175.827 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.576 ' H ' HD22 ' A' ' 78' ' ' LEU . 0.9 OUTLIER -57.31 -39.97 76.92 Favored 'General case' 0 N--CA 1.446 -0.673 0 O-C-N 121.105 -0.997 . . . . 1.34 110.562 171.922 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 4.1 m -76.84 129.95 36.95 Favored 'General case' 0 C--N 1.345 0.385 0 C-N-CA 118.987 -1.085 . . . . 0.96 109.875 177.644 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -65.45 -43.81 89.22 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-N 115.285 -0.87 . . . . 3.25 110.677 177.497 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 73.7 m -50.11 -62.86 1.33 Allowed 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 119.41 1.005 . . . . 1.18 111.761 171.755 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -54.09 -42.51 69.45 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 118.207 0.458 . . . . 2.94 111.074 -177.532 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 5.8 m -57.7 -53.62 56.08 Favored 'General case' 0 C--N 1.34 0.179 0 CA-C-O 121.913 0.863 . . . . 0.89 109.785 173.824 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 8.5 tptt -58.67 -38.58 78.48 Favored 'General case' 0 N--CA 1.445 -0.722 0 C-N-CA 125.91 1.684 . . . . 3.97 110.591 -170.998 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 67.4 m -52.1 -46.99 65.49 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 118.988 0.813 . . . . 1.25 111.696 170.835 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -65.66 -56.38 12.44 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 108.298 -1.001 . . . . 2.22 108.298 177.542 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 3.5 ttp -45.3 -45.27 12.08 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.456 0.702 . . . . 3.43 111.991 178.628 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -58.84 -43.57 90.78 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 126.086 1.755 . . . . 0.67 112.21 -171.863 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -90.27 -31.66 16.88 Favored 'General case' 0 N--CA 1.461 0.098 0 C-N-CA 122.552 0.341 . . . . 0.64 111.45 -179.694 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -62.05 -48.56 79.69 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 123.025 0.53 . . . . 0.34 110.675 175.525 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -71.24 114.41 9.28 Favored 'General case' 0 N--CA 1.446 -0.626 0 N-CA-C 108.856 -0.794 . . . . 1.01 108.856 178.984 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 8.0 m-80 -110.22 37.14 2.8 Favored 'General case' 0 N--CA 1.463 0.202 0 N-CA-C 109.661 -0.496 . . . . 3.1 109.661 -179.135 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 32.9 m-20 -119.06 -47.53 2.48 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 125.093 1.357 . . . . 1.43 110.195 173.333 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 89.75 41.56 5.63 Favored Glycine 0 CA--C 1.53 0.989 0 N-CA-C 108.672 -1.771 . . . . 0.87 108.672 -155.985 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -121.94 -55.03 1.91 Allowed 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.363 1.065 . . . . 2.69 110.134 -179.861 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 121.44 -38.15 2.74 Favored Glycine 0 CA--C 1.527 0.828 0 C-N-CA 124.19 0.9 . . . . 0.7 111.253 176.78 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 77.9 mttt -69.58 121.87 17.95 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 107.384 -1.339 . . . . 4.16 107.384 176.973 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 9.0 mt -105.71 127.65 60.49 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.323 0 N-CA-C 108.603 -0.888 . . . . 0.71 108.603 -173.728 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -85.11 158.88 33.46 Favored Glycine 0 CA--C 1.528 0.905 0 N-CA-C 110.387 -1.085 . . . . 0.55 110.387 169.688 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -51.27 -34.82 34.52 Favored 'General case' 0 C--N 1.34 0.176 0 O-C-N 122.044 -0.68 . . . . 0.8 109.896 167.973 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 25.8 tt0 -61.67 -62.27 1.92 Allowed 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 123.57 0.748 . . . . 2.48 110.67 179.021 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -44.57 -48.61 10.31 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.164 0.985 . . . . 2.19 110.167 172.613 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -65.72 -42.05 91.53 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 115.956 -0.566 . . . . 2.76 111.522 -175.682 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 12.4 tt0 -61.19 -43.8 98.3 Favored 'General case' 0 C--O 1.222 -0.38 0 CA-C-O 118.166 -0.921 . . . . 2.72 108.962 173.697 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -54.15 -53.16 57.2 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 120.032 1.287 . . . . 3.12 110.916 176.57 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.97 -54.42 47.15 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 108.449 -0.945 . . . . 2.7 108.449 -179.026 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 92.5 t -74.9 -15.74 16.04 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 CA-C-N 115.308 -0.86 . . . . 1.56 112.866 -169.838 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 3.0 t60 -98.15 3.86 49.05 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 120.423 -1.423 . . . . 2.62 111.186 175.521 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 31.3 t . . . . . 0 C--O 1.254 1.297 0 CA-C-O 115.995 -1.955 . . . . 2.4 111.37 179.491 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 110' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 111' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.47 0.568 0 N-CA-C 106.602 -1.629 . . . . 7.3 106.602 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 51.1 m -144.61 176.13 9.64 Favored 'General case' 0 N--CA 1.443 -0.808 0 O-C-N 125.265 1.603 . . . . 3.45 106.952 179.49 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.61 HG22 HG12 ' A' ' 47' ' ' VAL . 1.2 pp -52.08 -39.16 25.68 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 CA-C-N 115.795 -0.638 . . . . 1.78 110.275 178.449 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 2.8 t -82.44 52.37 2.04 Favored 'General case' 0 N--CA 1.438 -1.063 0 C-N-CA 125.979 1.712 . . . . 3.09 108.919 179.885 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -174.64 -50.89 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.126 0 C-N-CA 125.026 1.33 . . . . 3.11 108.394 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 24.2 t -51.08 -46.71 31.52 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 C-N-CA 124.144 0.978 . . . . 1.86 111.683 -177.734 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 11.7 tp -164.34 -58.47 0.03 OUTLIER 'General case' 0 CA--C 1.517 -0.305 0 N-CA-C 106.901 -1.518 . . . . 1.62 106.901 -177.229 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 2.3 m -49.26 -26.08 2.76 Favored 'General case' 0 C--O 1.215 -0.747 0 CA-C-O 117.785 -1.103 . . . . 0.99 112.948 -171.382 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -36.86 -48.46 0.75 Allowed 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 114.402 1.26 . . . . 1.06 114.402 168.741 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -70.17 -44.39 68.89 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-O 122.69 1.233 . . . . 2.09 109.375 -179.825 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -64.0 -41.57 97.44 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 124.612 1.165 . . . . 2.6 110.434 -173.365 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 45.8 pt -60.6 -39.74 82.38 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.811 0 O-C-N 121.289 -0.882 . . . . 1.44 110.299 175.153 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.16 -41.16 99.21 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 118.347 0.521 . . . . 1.0 109.788 178.86 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.48 -59.7 4.98 Favored 'General case' 0 CA--C 1.536 0.415 0 O-C-N 122.229 -0.294 . . . . 0.77 110.416 171.701 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -48.78 -47.52 41.9 Favored 'General case' 0 C--O 1.234 0.248 0 C-N-CA 125.842 1.657 . . . . 0.66 111.589 -176.525 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 18.9 tp -48.52 -43.86 35.63 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 126.199 1.799 . . . . 3.07 110.227 178.164 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -90.73 -42.98 10.4 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 110.052 -0.351 . . . . 2.92 110.052 -173.106 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -65.86 -34.46 78.2 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 122.379 0.271 . . . . 2.31 111.374 -173.657 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 58.2 m -123.18 62.93 1.01 Allowed 'General case' 0 C--O 1.234 0.263 0 C-N-CA 124.038 0.935 . . . . 1.81 108.495 171.777 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 36.4 ttt180 -82.5 -18.75 40.49 Favored 'General case' 0 CA--C 1.535 0.392 0 O-C-N 121.715 -0.616 . . . . 5.91 111.729 176.817 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -97.21 147.34 32.81 Favored Pre-proline 0 C--O 1.235 0.341 0 C-N-CA 124.986 1.315 . . . . 2.23 111.314 -166.429 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_endo -60.0 127.94 24.93 Favored 'Trans proline' 0 N--CA 1.452 -0.934 0 C-N-CA 123.049 2.499 . . . . 1.25 111.233 -173.658 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 41.7 m-20 76.29 18.44 1.87 Allowed 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 126.925 2.09 . . . . 2.92 111.944 169.36 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 7.2 m -90.15 -17.09 28.25 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.494 0.718 . . . . 0.7 111.989 -178.615 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -86.01 97.15 10.11 Favored 'General case' 0 CA--C 1.534 0.362 0 O-C-N 121.731 -0.606 . . . . 3.75 111.313 -157.857 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -80.44 155.47 74.02 Favored Pre-proline 0 CA--C 1.534 0.331 0 C-N-CA 123.918 0.887 . . . . 2.71 110.548 -178.938 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -70.81 -63.27 0.04 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.209 0 C-N-CA 122.534 2.156 . . . . 0.63 111.243 -177.636 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 38.2 mt-30 -61.12 -31.93 71.63 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 122.765 0.426 . . . . 2.46 110.867 -178.245 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.79 -64.43 0.96 Allowed 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 109.337 -0.616 . . . . 3.41 109.337 171.014 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 4.8 t80 -54.82 -48.38 72.88 Favored 'General case' 0 C--O 1.22 -0.469 0 C-N-CA 123.281 0.632 . . . . 2.21 110.676 -174.355 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -34.99 -64.09 0.29 Allowed 'General case' 0 C--O 1.234 0.267 0 C-N-CA 127.741 2.417 . . . . 5.11 111.837 171.86 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 -66.75 -48.61 68.58 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 108.747 -0.834 . . . . 3.32 108.747 -177.408 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -60.63 -25.57 66.39 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 123.582 0.753 . . . . 0.67 112.238 -174.627 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 30.7 t -89.82 -3.53 58.08 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 126.616 1.967 . . . . 1.43 111.086 -179.472 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 80.61 5.85 89.68 Favored Glycine 0 C--N 1.335 0.52 0 N-CA-C 111.326 -0.709 . . . . 0.68 111.326 172.359 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 80.7 mt -68.55 -26.57 65.48 Favored 'General case' 0 N--CA 1.445 -0.695 0 O-C-N 121.831 -0.805 . . . . 1.49 109.902 -177.153 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 24.2 t -64.02 -30.61 71.67 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.604 1.162 . . . . 2.15 111.387 169.117 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -86.6 -38.09 17.46 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 109.296 -0.631 . . . . 4.0 109.296 -176.353 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 28.6 mtt -56.18 128.13 34.1 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-O 120.968 0.413 . . . . 3.15 111.039 174.66 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 7.7 m -63.73 158.67 21.03 Favored 'General case' 0 N--CA 1.452 -0.335 0 O-C-N 121.74 -0.6 . . . . 2.1 110.057 173.428 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -43.01 -41.55 3.46 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 124.231 1.013 . . . . 0.72 111.983 177.005 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 7.8 m120 -55.0 -58.46 7.53 Favored 'General case' 0 N--CA 1.457 -0.093 0 C-N-CA 123.787 0.835 . . . . 2.53 110.075 177.648 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 13.4 mm-40 -60.49 -48.0 83.68 Favored 'General case' 0 C--O 1.219 -0.527 0 N-CA-C 109.555 -0.535 . . . . 2.85 109.555 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 77.1 t -54.55 -48.69 70.16 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 CA-C-N 118.975 0.807 . . . . 0.56 110.489 -179.645 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 63.9 tttt -74.9 -24.05 58.47 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 121.087 -1.008 . . . . 3.15 111.812 -178.784 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 61.3 t0 -66.66 -65.46 0.68 Allowed 'General case' 0 CA--C 1.529 0.151 0 N-CA-C 108.782 -0.821 . . . . 2.84 108.782 168.888 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.61 HG12 HG22 ' A' ' 3' ' ' ILE . 15.2 m -47.35 -50.88 7.2 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 C-N-CA 123.678 0.791 . . . . 0.59 110.805 179.406 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 20.9 m-85 -55.29 -43.77 75.07 Favored 'General case' 0 C--O 1.225 -0.225 0 CA-C-N 118.843 0.747 . . . . 6.72 111.975 177.695 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 84.0 mtm180 -68.37 -36.44 79.2 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 119.169 0.895 . . . . 6.09 112.261 176.524 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 49.4 t80 -63.96 -41.2 97.64 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 118.448 0.567 . . . . 2.91 109.509 -179.819 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.0 mp -78.02 -32.52 17.46 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 CA-C-O 118.607 -0.711 . . . . 2.07 111.975 177.003 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 52.4 t0 -66.98 75.57 0.12 Allowed 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 119.354 0.979 . . . . 1.86 108.983 170.501 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 25.3 t-20 -54.73 156.46 3.58 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 107.699 -1.223 . . . . 3.37 107.699 167.922 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 72.23 -44.77 0.6 Allowed 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 123.916 0.886 . . . . 3.48 113.118 -173.861 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 59.09 52.09 6.53 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 124.207 1.003 . . . . 3.84 111.312 -172.645 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 16.6 p -57.78 -6.98 0.6 Allowed 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.3 1.44 . . . . 1.94 113.093 166.419 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 73.78 14.07 80.18 Favored Glycine 0 CA--C 1.527 0.808 0 N-CA-C 110.0 -1.24 . . . . 1.59 110.0 -167.871 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 -148.06 141.93 25.78 Favored 'General case' 0 N--CA 1.441 -0.894 0 C-N-CA 124.929 1.292 . . . . 3.4 108.207 -179.235 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 4.9 mp -95.25 78.99 3.49 Favored 'General case' 0 N--CA 1.435 -1.212 0 N-CA-C 105.26 -2.126 . . . . 3.18 105.26 161.333 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -63.19 170.39 2.92 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-N 113.754 -1.566 . . . . 1.5 109.224 175.733 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -48.7 -57.33 6.45 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 120.059 1.299 . . . . 4.08 111.727 -171.255 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -45.32 -35.4 3.48 Favored 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 115.258 1.577 . . . . 3.51 115.258 172.082 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -57.86 -44.08 86.37 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 121.213 1.824 . . . . 2.38 109.379 174.498 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -77.89 16.81 0.65 Allowed 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 115.219 -0.901 . . . . 2.44 111.259 175.439 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 26.7 ttpt -106.22 5.78 30.19 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.825 1.25 . . . . 2.42 109.019 161.828 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 25.3 p90 -152.8 30.28 0.51 Allowed 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 118.606 0.639 . . . . 5.75 112.189 171.631 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 27.4 t80 -57.83 -61.75 2.3 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 119.116 0.871 . . . . 2.44 108.916 -179.277 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 1.3 mp -82.58 -13.91 55.75 Favored 'General case' 0 CA--C 1.535 0.374 0 O-C-N 120.951 -1.093 . . . . 2.46 113.238 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 48.9 mm-40 -69.5 14.06 0.11 Allowed 'General case' 0 CA--C 1.544 0.734 0 O-C-N 121.146 -0.971 . . . . 1.58 112.114 176.881 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.86 -25.85 12.46 Favored 'General case' 0 CA--C 1.533 0.293 0 O-C-N 120.21 -1.556 . . . . 3.64 110.326 165.28 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -81.14 -48.26 12.37 Favored 'General case' 0 N--CA 1.456 -0.159 0 N-CA-C 108.184 -1.043 . . . . 7.53 108.184 173.629 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -120.7 177.46 5.07 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 123.688 0.795 . . . . 4.03 110.672 -175.073 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 7.0 m -96.32 -28.16 14.62 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.704 1.202 . . . . 2.15 111.031 165.581 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -113.08 15.01 23.46 Favored Glycine 0 CA--C 1.527 0.802 0 C-N-CA 123.706 0.669 . . . . 1.26 112.081 -166.504 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -72.09 157.58 37.52 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 117.288 0.544 . . . . 2.07 111.059 -176.567 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.87 18.41 0.1 Allowed 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 115.597 1.702 . . . . 3.43 115.597 -159.228 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 73.1 mm-40 -58.96 -34.25 71.57 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 122.43 1.109 . . . . 3.96 111.718 -173.229 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.534 ' H ' HD22 ' A' ' 78' ' ' LEU . 0.1 OUTLIER -55.21 -35.4 64.83 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 114.764 -1.107 . . . . 0.76 111.912 175.759 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 52.6 m -76.6 106.03 8.01 Favored 'General case' 0 C--N 1.342 0.273 0 CA-C-N 119.117 0.871 . . . . 0.85 109.758 -179.045 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -56.17 -41.33 75.32 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 114.942 -1.027 . . . . 3.17 110.92 -176.605 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 69.8 m -62.38 -53.33 56.61 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.103 0.561 . . . . 1.49 111.864 -178.266 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -58.7 -46.63 86.84 Favored 'General case' 0 C--O 1.233 0.229 0 O-C-N 121.482 -0.761 . . . . 3.17 110.341 176.773 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -50.0 -51.17 43.87 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-O 121.545 0.688 . . . . 0.55 109.764 175.176 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 89.2 mttt -66.62 -28.25 68.34 Favored 'General case' 0 C--O 1.22 -0.481 0 C-N-CA 124.969 1.308 . . . . 5.02 111.61 -177.517 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 3.4 t -60.79 -47.19 87.46 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 119.561 1.073 . . . . 1.71 109.446 171.14 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -63.67 -51.3 65.72 Favored 'General case' 0 C--O 1.234 0.28 0 O-C-N 121.871 -0.518 . . . . 3.24 110.412 174.744 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 31.6 ttm -45.82 -50.97 13.6 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 123.263 0.352 . . . . 3.09 111.747 173.659 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -54.6 -46.27 73.76 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 125.831 1.652 . . . . 0.48 111.863 -169.177 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -86.54 -41.29 14.45 Favored 'General case' 0 C--O 1.226 -0.157 0 N-CA-C 111.635 0.235 . . . . 0.45 111.635 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -59.16 -39.3 82.03 Favored 'General case' 0 CA--C 1.521 -0.135 0 CA-C-N 118.092 0.406 . . . . 0.31 111.288 179.761 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 15.7 t0 -67.04 112.56 4.45 Favored 'General case' 0 N--CA 1.443 -0.811 0 N-CA-C 108.206 -1.035 . . . . 1.59 108.206 174.087 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 76.0 m-20 -93.14 4.97 53.09 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-O 118.747 -0.644 . . . . 2.65 110.908 -179.894 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 49.8 m-20 -99.71 -56.22 2.45 Favored 'General case' 0 C--N 1.345 0.404 0 CA-C-N 118.904 0.775 . . . . 1.21 110.975 -178.799 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 99.44 50.62 1.4 Allowed Glycine 0 CA--C 1.53 1.025 0 N-CA-C 108.69 -1.764 . . . . 0.8 108.69 -156.63 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 30.1 p-10 -134.74 -50.63 0.78 Allowed 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 126.191 1.796 . . . . 1.92 110.544 176.729 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 126.9 -46.87 1.05 Allowed Glycine 0 CA--C 1.521 0.428 0 C-N-CA 124.785 1.183 . . . . 0.83 110.716 170.473 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 6.3 ptpp? -57.21 136.29 56.46 Favored 'General case' 0 C--O 1.241 0.649 0 CA-C-N 117.282 0.541 . . . . 4.36 109.542 171.304 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 8.1 mt -125.41 114.6 40.45 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.197 0 C-N-CA 124.538 1.135 . . . . 0.67 108.646 -172.001 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -71.13 160.16 54.01 Favored Glycine 0 CA--C 1.531 1.032 0 N-CA-C 110.121 -1.192 . . . . 0.56 110.121 172.643 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -57.76 -36.91 72.75 Favored 'General case' 0 C--O 1.227 -0.12 0 O-C-N 121.848 -0.796 . . . . 1.08 109.354 171.909 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -47.51 -69.57 0.12 Allowed 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.98 0.912 . . . . 4.02 111.847 166.256 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -44.01 -46.46 8.36 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.428 1.091 . . . . 2.15 111.942 179.045 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -67.38 -50.16 60.88 Favored 'General case' 0 CA--C 1.541 0.629 0 O-C-N 121.997 -0.439 . . . . 3.74 111.869 -178.698 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 5.7 tm0? -62.22 -32.75 73.46 Favored 'General case' 0 C--O 1.223 -0.301 0 C-N-CA 124.083 0.953 . . . . 2.21 110.618 178.189 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -60.1 -60.11 4.35 Favored 'General case' 0 N--CA 1.456 -0.156 0 CA-C-N 119.123 0.874 . . . . 4.3 109.523 169.823 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 7.7 tpt -54.0 -44.32 70.77 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-O 121.072 0.463 . . . . 2.78 109.919 -174.019 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 46.0 t -72.44 -64.59 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.595 0 CA-C-N 115.872 -0.604 . . . . 1.26 111.403 178.825 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 22.5 t60 -58.17 -36.19 72.66 Favored 'General case' 0 C--N 1.331 -0.233 0 O-C-N 121.038 -1.039 . . . . 3.47 110.529 -169.529 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 80.6 p . . . . . 0 C--O 1.251 1.175 0 C-N-CA 125.938 1.695 . . . . 5.71 113.166 173.622 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 110' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 111' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.472 0.661 0 N-CA-C 106.465 -1.68 . . . . 7.37 106.465 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.4 m 143.9 -82.17 0.0 OUTLIER 'General case' 0 C--O 1.223 -0.334 0 C-N-CA 129.267 3.027 . . . . 2.87 106.0 -176.997 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.57 HG22 HG12 ' A' ' 47' ' ' VAL . 2.9 pt -84.04 -24.67 7.59 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.181 0 CA-C-O 121.509 0.671 . . . . 1.64 112.237 -168.39 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 11.9 t -54.51 -37.44 65.35 Favored 'General case' 0 N--CA 1.424 -1.763 0 C-N-CA 126.281 1.832 . . . . 2.27 112.355 -178.753 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 39.5 t0 -112.58 45.17 1.34 Allowed 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.769 0.828 . . . . 3.06 109.994 -175.635 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 66.1 t -120.05 -64.4 1.63 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.21 0 C-N-CA 124.23 1.012 . . . . 1.42 109.724 175.367 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -169.89 -54.45 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 106.704 -1.591 . . . . 1.17 106.704 -173.849 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 2.5 m -34.7 -29.61 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 129.507 3.123 . . . . 0.86 116.446 -172.185 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -49.08 -49.77 40.09 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 119.076 0.853 . . . . 0.78 111.939 172.781 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -63.03 -42.15 99.7 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-O 122.51 1.147 . . . . 2.09 109.484 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -68.29 -43.68 77.18 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-N 115.197 -0.911 . . . . 2.42 108.905 -171.647 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 10.0 pt -61.92 -37.49 78.37 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.943 0 O-C-N 121.21 -0.931 . . . . 1.32 111.526 174.029 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.44 -44.57 89.22 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 118.928 0.785 . . . . 0.78 110.305 175.331 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.21 -56.26 24.4 Favored 'General case' 0 CA--C 1.535 0.4 0 O-C-N 122.198 -0.314 . . . . 0.56 110.737 173.018 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -53.72 -44.19 69.67 Favored 'General case' 0 N--CA 1.457 -0.097 0 C-N-CA 124.691 1.196 . . . . 0.6 111.256 -175.579 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.9 tt -51.29 -38.72 54.4 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 125.302 1.441 . . . . 3.42 110.838 177.428 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 13.0 tt0 -89.18 -43.54 10.94 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 117.725 0.238 . . . . 2.9 110.807 -177.328 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -69.15 -34.74 75.46 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 117.865 0.302 . . . . 3.16 111.104 -175.528 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 19.6 t -108.29 52.62 0.71 Allowed 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 125.303 1.441 . . . . 2.95 109.462 175.416 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 5.8 ttt-85 -92.41 -46.92 7.43 Favored 'General case' 0 C--O 1.231 0.112 0 C-N-CA 123.426 0.69 . . . . 4.15 109.516 179.027 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -62.72 148.67 90.89 Favored Pre-proline 0 CA--C 1.537 0.471 0 C-N-CA 125.523 1.529 . . . . 2.81 109.483 178.665 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -67.83 138.58 45.12 Favored 'Trans proline' 0 N--CA 1.451 -1.022 0 C-N-CA 122.123 1.882 . . . . 1.31 111.386 -175.364 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 64.48 25.58 13.31 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 126.165 1.786 . . . . 2.36 111.695 170.78 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 8.6 m -91.53 -13.62 31.78 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 124.558 1.143 . . . . 1.05 111.574 -179.848 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 3.4 t80 -54.51 120.6 6.89 Favored 'General case' 0 CA--C 1.534 0.339 0 O-C-N 121.635 -0.666 . . . . 4.02 111.325 179.829 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -119.43 155.37 54.11 Favored Pre-proline 0 CA--C 1.537 0.477 0 C-N-CA 125.393 1.477 . . . . 2.42 109.665 169.674 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -67.19 -82.21 0.01 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.706 0 C-N-CA 123.736 2.958 . . . . 1.01 112.083 -176.085 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 47.1 mt-30 -49.31 -45.64 45.61 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 124.584 1.154 . . . . 1.77 111.189 -176.481 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -39.41 -68.2 0.18 Allowed 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 125.111 1.364 . . . . 2.61 110.004 166.963 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 25.2 t80 -65.05 -38.21 90.1 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 122.421 0.288 . . . . 3.03 111.291 -174.764 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 9.0 m-30 -57.41 -43.0 83.37 Favored 'General case' 0 CA--C 1.53 0.189 0 O-C-N 121.345 -0.847 . . . . 4.87 110.323 179.001 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -69.73 -52.45 25.31 Favored 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 109.481 -0.563 . . . . 2.74 109.481 174.643 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -63.64 -26.72 68.8 Favored 'General case' 0 N--CA 1.446 -0.63 0 C-N-CA 123.033 0.533 . . . . 0.99 111.559 -170.141 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 25.8 t -93.42 1.14 56.97 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 125.488 1.515 . . . . 1.68 111.787 178.623 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 88.79 -11.46 68.75 Favored Glycine 0 C--N 1.337 0.632 0 C-N-CA 124.276 0.941 . . . . 1.05 111.288 171.398 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 52.8 mt -65.15 -38.17 89.72 Favored 'General case' 0 N--CA 1.44 -0.936 0 C-N-CA 124.578 1.151 . . . . 1.44 111.367 -167.909 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 46.0 m -70.13 -20.6 63.16 Favored 'General case' 0 N--CA 1.461 0.106 0 CA-C-N 118.524 0.602 . . . . 3.03 111.954 174.855 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 13.2 tttt -86.65 -38.04 17.44 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 108.678 -0.86 . . . . 4.11 108.678 -178.76 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 31.1 mmt -58.87 131.47 51.08 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-O 121.588 0.709 . . . . 3.16 109.625 169.331 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -68.63 158.47 34.0 Favored 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 108.659 -0.867 . . . . 2.16 108.659 179.575 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -41.82 -42.58 2.71 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 124.407 1.083 . . . . 0.72 112.408 177.606 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -52.34 -55.11 23.71 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.523 0.729 . . . . 2.51 111.535 174.707 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 16.9 mm100 -69.0 -39.1 79.52 Favored 'General case' 0 N--CA 1.454 -0.234 0 O-C-N 122.04 -0.413 . . . . 2.89 110.426 -177.928 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 94.2 t -59.1 -41.14 82.65 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 O-C-N 121.568 -0.707 . . . . 0.63 109.408 175.736 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 83.2 tttt -64.47 -40.21 95.26 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.21 0.604 . . . . 2.56 111.023 175.772 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -57.5 -64.65 0.82 Allowed 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 118.759 0.709 . . . . 3.23 110.513 173.164 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.57 HG12 HG22 ' A' ' 3' ' ' ILE . 14.9 m -53.61 -45.27 59.64 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.306 0 N-CA-C 110.32 -0.252 . . . . 0.7 110.32 -175.71 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.833 ' CZ ' ' HB2' ' A' ' 100' ' ' ALA . 14.6 t80 -40.96 -44.83 2.43 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 125.16 1.384 . . . . 4.71 112.72 172.67 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 47.4 mtp180 -58.63 -30.34 67.21 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 119.107 0.867 . . . . 3.02 112.071 -178.046 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -79.0 -38.07 37.6 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 123.291 0.636 . . . . 4.13 109.509 -178.559 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 4.1 mp -66.72 176.14 0.44 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.939 0 C-N-CA 124.319 1.048 . . . . 2.42 108.398 168.968 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 18.5 t70 73.67 -51.05 0.7 Allowed 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 127.199 2.2 . . . . 3.86 111.209 -174.944 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 7.1 t30 77.51 -42.09 0.38 Allowed 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 125.442 1.497 . . . . 1.85 112.581 175.456 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 86.1 m-20 -48.48 -52.32 22.94 Favored 'General case' 0 C--N 1.342 0.242 0 N-CA-C 108.237 -1.023 . . . . 2.87 108.237 165.302 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 91.88 -1.88 0.17 Allowed 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 128.817 2.847 . . . . 4.33 110.477 -164.565 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 95.5 p -46.75 -41.86 15.89 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 126.936 2.094 . . . . 2.17 111.309 168.972 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 87.3 -14.16 58.31 Favored Glycine 0 CA--C 1.528 0.892 0 C-N-CA 123.747 0.689 . . . . 2.51 113.073 -174.979 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 33.6 m-85 -76.86 100.75 5.63 Favored 'General case' 0 CA--C 1.511 -0.524 0 N-CA-C 107.064 -1.458 . . . . 2.38 107.064 165.113 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 8.6 mp -68.87 87.93 0.37 Allowed 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 106.137 -1.801 . . . . 2.75 106.137 163.012 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -67.28 152.18 46.18 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.133 1.373 . . . . 1.47 108.415 168.015 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -46.4 -53.83 10.27 Favored 'General case' 0 CA--C 1.535 0.374 0 O-C-N 121.229 -0.919 . . . . 3.76 112.973 -173.192 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -55.38 -27.7 49.2 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.256 0.622 . . . . 3.17 112.509 179.739 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 64.9 mt-10 -75.18 -29.29 60.34 Favored 'General case' 0 C--N 1.33 -0.268 0 O-C-N 120.083 -1.635 . . . . 2.01 111.074 177.376 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 17.4 mt -66.42 -20.65 66.11 Favored 'General case' 0 N--CA 1.449 -0.476 0 O-C-N 121.82 -0.55 . . . . 2.36 110.498 173.165 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 26.6 ttpt -63.52 -6.83 5.63 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.299 0.64 . . . . 2.14 111.843 168.054 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 20.6 p90 -135.33 31.37 3.18 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 120.061 1.3 . . . . 5.2 112.561 169.306 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -50.92 -70.45 0.08 Allowed 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 123.567 0.747 . . . . 2.21 112.304 -178.327 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 2.4 tp -77.94 -20.47 52.71 Favored 'General case' 0 CA--C 1.533 0.318 0 O-C-N 121.059 -1.026 . . . . 2.49 111.63 -179.8 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.07 -13.09 10.05 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.638 1.175 . . . . 2.4 111.111 175.684 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.56 -34.11 77.17 Favored 'General case' 0 N--CA 1.449 -0.479 0 O-C-N 120.996 -1.065 . . . . 2.78 111.991 170.413 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -90.62 -61.86 1.58 Allowed 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 108.06 -1.089 . . . . 7.08 108.06 178.09 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -104.1 -176.65 3.14 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 124.467 1.107 . . . . 3.58 108.418 -170.368 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 66.3 m -124.55 -15.57 6.55 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 119.639 1.109 . . . . 2.34 113.686 -177.801 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -131.72 39.34 1.78 Allowed Glycine 0 CA--C 1.525 0.681 0 C-N-CA 125.151 1.358 . . . . 1.28 111.007 -176.256 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -74.9 -134.51 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.183 0.993 . . . . 1.72 110.286 173.839 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 5.4 tpt85 -124.47 -4.14 7.8 Favored 'General case' 0 CA--C 1.534 0.362 0 O-C-N 121.028 -1.045 . . . . 3.9 113.028 -168.057 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -57.18 -23.52 48.17 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.274 1.03 . . . . 3.12 112.956 -163.177 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.821 ' H ' HD22 ' A' ' 78' ' ' LEU . 0.0 OUTLIER -56.07 -42.19 76.27 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 125.104 1.362 . . . . 0.96 111.834 173.31 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 90.6 m -71.78 102.44 2.84 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 121.599 0.714 . . . . 0.83 110.258 -176.127 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -52.35 -42.1 63.62 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 114.663 -1.153 . . . . 3.09 111.754 -179.278 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 65.7 m -57.76 -40.64 80.25 Favored 'General case' 0 CA--C 1.531 0.23 0 O-C-N 121.342 -0.849 . . . . 1.24 112.308 177.331 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -79.39 -45.77 18.87 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 108.634 -0.876 . . . . 2.69 108.634 -172.705 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -47.79 -55.18 10.24 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-O 121.144 0.497 . . . . 0.57 110.136 167.658 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 27.4 pttt -71.54 -22.27 61.79 Favored 'General case' 0 C--O 1.217 -0.642 0 CA-C-O 118.535 -0.745 . . . . 5.53 111.132 -172.281 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 15.6 t -60.6 -49.83 75.96 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 119.965 1.257 . . . . 1.93 109.073 169.084 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.7 tt -58.16 -54.4 47.41 Favored 'General case' 0 C--N 1.342 0.256 0 N-CA-C 109.404 -0.591 . . . . 3.03 109.404 174.15 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 25.2 ttp -48.21 -52.54 20.54 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 121.046 0.451 . . . . 2.69 111.853 178.717 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -55.01 -40.62 70.36 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 126.293 1.837 . . . . 0.57 111.749 -169.38 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -92.41 -40.35 10.93 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 122.369 0.267 . . . . 0.59 111.701 -178.828 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -58.23 -40.39 81.58 Favored 'General case' 0 C--N 1.339 0.119 0 CA-C-N 118.123 0.42 . . . . 0.4 110.533 176.787 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -70.18 120.68 16.22 Favored 'General case' 0 N--CA 1.444 -0.768 0 N-CA-C 108.469 -0.938 . . . . 1.02 108.469 174.772 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 9.2 m-80 -106.53 12.78 29.14 Favored 'General case' 0 C--N 1.331 -0.21 0 C-N-CA 122.794 0.438 . . . . 2.87 111.152 -179.602 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 38.1 m-20 -99.1 -39.25 8.59 Favored 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 122.987 0.515 . . . . 1.38 109.901 178.09 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 86.09 38.98 8.18 Favored Glycine 0 CA--C 1.529 0.907 0 N-CA-C 108.753 -1.739 . . . . 0.82 108.753 -156.916 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -119.87 -58.77 1.86 Allowed 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 117.795 0.797 . . . . 2.47 111.089 -178.991 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 126.77 -38.93 2.07 Favored Glycine 0 CA--C 1.528 0.889 0 C-N-CA 124.171 0.891 . . . . 0.66 111.506 178.875 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 31.6 mmtp -60.81 117.25 5.17 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 108.141 -1.059 . . . . 3.99 108.141 173.798 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 6.8 mt -108.66 113.8 45.02 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.09 0 N-CA-C 109.317 -0.623 . . . . 0.83 109.317 -178.943 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -75.96 170.42 54.71 Favored Glycine 0 CA--C 1.53 1.015 0 N-CA-C 110.879 -0.888 . . . . 0.5 110.879 170.6 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' ALA . . . . . 0.833 ' HB2' ' CZ ' ' A' ' 48' ' ' PHE . . . -55.34 -42.39 73.77 Favored 'General case' 0 CA--C 1.515 -0.372 0 O-C-N 122.234 -0.568 . . . . 0.68 109.672 173.104 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.16 -63.54 1.26 Allowed 'General case' 0 N--CA 1.447 -0.576 0 O-C-N 124.264 0.977 . . . . 2.75 108.822 -177.057 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -42.25 -52.59 4.4 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.787 0.835 . . . . 1.35 111.769 173.139 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 42.3 t80 -59.76 -56.37 22.7 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-O 121.267 0.556 . . . . 3.45 110.603 -176.625 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -61.57 -37.91 85.6 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 124.764 1.226 . . . . 3.03 110.89 -176.264 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -54.61 -62.98 1.3 Allowed 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 119.411 1.005 . . . . 3.77 109.155 172.095 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 1.7 tpt -63.59 -37.59 87.89 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 120.622 -0.431 . . . . 3.63 111.417 -171.685 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 49.7 t -62.74 -48.21 89.24 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.22 0 C-N-CA 123.063 0.545 . . . . 1.28 110.886 174.024 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 83.9 t60 -67.83 -30.82 70.31 Favored 'General case' 0 N--CA 1.456 -0.141 0 C-N-CA 123.371 0.668 . . . . 2.08 110.55 -173.435 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 5.1 t . . . . . 0 C--O 1.251 1.159 0 C-N-CA 125.962 1.705 . . . . 2.64 112.141 177.694 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 110' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 111' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.3 ptm . . . . . 0 N--CA 1.477 0.921 0 N-CA-C 112.929 0.714 . . . . 7.58 112.929 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.6 m -174.08 -56.47 0.01 OUTLIER 'General case' 0 C--O 1.223 -0.325 0 C-N-CA 125.066 1.346 . . . . 2.31 107.973 177.494 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.642 HG22 HG12 ' A' ' 47' ' ' VAL . 1.5 pp -92.5 -38.17 9.77 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.224 0 CA-C-O 121.397 0.618 . . . . 1.25 111.139 179.333 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 62.8 p -58.12 -56.27 24.26 Favored 'General case' 0 N--CA 1.439 -1.004 0 C-N-CA 123.881 0.872 . . . . 3.06 108.81 -178.085 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 38.5 t0 -80.99 45.33 0.82 Allowed 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.929 2.091 . . . . 2.43 111.4 -169.73 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 73.9 t -143.46 -57.59 0.16 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.14 0 C-N-CA 126.832 2.053 . . . . 1.57 107.77 -178.085 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 4.2 tp -166.25 -56.11 0.03 OUTLIER 'General case' 0 C--N 1.334 -0.093 0 N-CA-C 106.302 -1.74 . . . . 1.09 106.302 -176.793 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -45.9 -23.57 0.3 Allowed 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 127.631 2.372 . . . . 1.13 115.496 -165.313 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -49.66 -47.57 49.95 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 119.558 1.072 . . . . 0.93 111.525 170.931 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -63.81 -39.81 95.13 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-O 122.449 1.119 . . . . 1.79 109.725 -179.414 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -72.76 -42.58 63.86 Favored 'General case' 0 N--CA 1.443 -0.792 0 C-N-CA 123.714 0.806 . . . . 2.44 109.987 -173.271 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 29.0 pt -61.92 -41.43 90.83 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.769 0 O-C-N 121.224 -0.923 . . . . 0.97 110.249 172.707 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.25 -46.53 76.07 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 118.947 0.794 . . . . 0.71 111.129 173.062 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -57.04 -59.14 5.5 Favored 'General case' 0 CA--C 1.536 0.41 0 O-C-N 121.617 -0.677 . . . . 0.53 110.837 174.046 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -46.11 -43.58 14.92 Favored 'General case' 0 CA--C 1.528 0.132 0 C-N-CA 125.633 1.573 . . . . 0.68 111.484 178.717 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 39.5 tp -60.26 -40.56 90.76 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 123.833 0.853 . . . . 2.78 110.508 -176.622 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 18.2 tt0 -87.91 -40.1 14.23 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 110.3 -0.259 . . . . 2.7 110.3 -173.847 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.4 pp20? -68.11 -49.19 62.7 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 109.232 -0.655 . . . . 3.4 109.232 -179.392 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -86.4 46.88 1.39 Allowed 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 124.543 1.137 . . . . 1.95 108.855 -179.608 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 61.1 ttt180 -87.29 -56.42 3.38 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 108.458 -0.941 . . . . 4.25 108.458 -176.351 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -55.13 131.35 68.62 Favored Pre-proline 0 N--CA 1.449 -0.508 0 CA-C-O 118.657 -0.687 . . . . 2.32 109.47 176.381 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -62.78 150.1 89.21 Favored 'Trans proline' 0 N--CA 1.453 -0.895 0 C-N-CA 122.443 2.095 . . . . 1.25 110.304 -173.813 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 66.99 3.78 3.27 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.902 1.681 . . . . 2.99 113.367 174.62 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 12.5 m -77.9 -7.74 57.14 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 120.783 -1.198 . . . . 0.81 111.981 -176.519 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 41.3 t80 -68.48 113.68 6.23 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 121.429 -0.794 . . . . 4.26 111.927 -173.114 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -102.87 155.61 36.35 Favored Pre-proline 0 CA--C 1.542 0.65 0 C-N-CA 125.396 1.478 . . . . 2.74 111.035 166.944 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.36 -71.8 0.02 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.531 0 C-N-CA 124.47 3.446 . . . . 0.78 112.575 -175.114 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 35.1 mt-30 -52.94 -46.35 68.08 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 123.734 0.814 . . . . 2.65 110.567 -178.428 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -44.56 -67.39 0.29 Allowed 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 124.931 1.292 . . . . 3.7 108.349 170.182 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 51.1 t80 -48.95 -52.96 21.83 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-O 118.635 -0.697 . . . . 2.82 111.768 178.47 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.465 ' CE1' HD21 ' A' ' 86' ' ' LEU . 16.9 m-85 -52.11 -45.46 64.9 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 119.486 1.039 . . . . 4.78 111.698 -176.441 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -72.87 -42.84 63.23 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 119.704 -0.798 . . . . 3.1 110.293 179.265 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -61.31 -36.28 79.69 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 123.357 0.663 . . . . 0.81 111.716 -178.517 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 57.7 p -83.03 -0.12 47.45 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 124.245 1.018 . . . . 1.99 111.206 178.848 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 82.19 -8.58 60.44 Favored Glycine 0 C--N 1.337 0.636 0 N-CA-C 110.773 -0.931 . . . . 0.83 110.773 176.363 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 75.0 mt -59.39 -38.03 79.5 Favored 'General case' 0 N--CA 1.442 -0.855 0 C-N-CA 124.456 1.102 . . . . 1.31 111.212 -174.381 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 21.3 m -71.45 -23.14 61.78 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 118.663 0.665 . . . . 2.85 112.057 176.352 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 6.8 ttpt -83.87 -36.36 23.47 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 109.124 -0.695 . . . . 4.42 109.124 179.008 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 14.2 mmt -59.95 135.72 57.79 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-O 121.631 0.729 . . . . 2.57 110.445 173.21 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 69.5 m -63.58 152.45 38.74 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 116.082 -0.508 . . . . 1.84 110.382 174.458 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -39.51 -40.76 0.9 Allowed 'General case' 0 C--O 1.224 -0.246 0 C-N-CA 125.674 1.59 . . . . 0.66 111.976 172.805 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 67.7 m-20 -52.33 -56.16 16.73 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.632 1.173 . . . . 1.57 111.45 176.103 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -72.65 -38.87 67.54 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 108.98 -0.748 . . . . 3.62 108.98 -174.922 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.422 ' CG1' ' CZ ' ' A' ' 48' ' ' PHE . 52.7 t -58.52 -47.77 87.39 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 CA-C-O 121.342 0.591 . . . . 0.6 109.557 175.565 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -55.58 -48.97 73.95 Favored 'General case' 0 N--CA 1.453 -0.291 0 O-C-N 121.228 -0.92 . . . . 2.83 109.952 173.84 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -57.31 -51.13 70.63 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 120.224 -0.59 . . . . 2.99 111.294 179.924 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.642 HG12 HG22 ' A' ' 3' ' ' ILE . 3.7 m -55.19 -42.14 64.17 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 O-C-N 121.785 -0.572 . . . . 0.65 110.484 178.186 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.499 ' CZ ' ' HB3' ' A' ' 103' ' ' PHE . 17.3 m-30 -54.34 -34.42 61.03 Favored 'General case' 0 C--N 1.341 0.217 0 N-CA-C 113.027 0.751 . . . . 5.89 113.027 174.746 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 81.2 mtp180 -61.58 -40.53 95.09 Favored 'General case' 0 CA--C 1.529 0.154 0 CA-C-N 119.506 1.048 . . . . 4.24 109.975 174.882 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -64.5 -43.56 93.72 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 109.36 -0.607 . . . . 4.07 109.36 176.23 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.423 HD11 ' CZ ' ' A' ' 71' ' ' PHE . 27.9 mm -58.09 -54.91 25.92 Favored 'Isoleucine or valine' 0 C--O 1.237 0.401 0 CA-C-O 118.799 -0.62 . . . . 1.55 110.874 177.64 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -75.89 64.19 1.81 Allowed 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 124.821 1.248 . . . . 1.92 109.326 -173.179 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 31.6 t30 -55.27 -32.83 62.68 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 125.869 1.668 . . . . 1.87 111.942 -174.139 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 16.6 p-10 -74.5 -29.05 61.26 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.947 1.699 . . . . 2.36 111.977 175.163 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 8.7 mt-30 57.31 60.64 2.83 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 125.285 1.434 . . . . 2.92 110.859 -173.152 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 79.1 p -89.34 -46.02 9.06 Favored 'General case' 0 C--N 1.337 0.048 0 C-N-CA 123.858 0.863 . . . . 1.4 111.134 174.193 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 113.47 -18.87 20.06 Favored Glycine 0 CA--C 1.531 1.066 0 C-N-CA 123.912 0.768 . . . . 1.29 111.42 -164.871 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 77.9 m-85 -118.48 142.8 47.22 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 124.073 0.949 . . . . 2.53 110.076 178.324 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.428 HD13 ' CE2' ' A' ' 103' ' ' PHE . 0.2 OUTLIER -104.01 70.3 0.99 Allowed 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 124.648 1.179 . . . . 3.09 108.695 173.352 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -56.29 158.5 4.13 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.584 1.553 . . . . 2.04 111.472 176.931 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 54.9 mt-10 -43.67 -56.29 3.85 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 125.029 1.332 . . . . 3.41 113.633 -175.728 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 16.3 tt0 -62.88 -25.64 68.39 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 121.969 -0.457 . . . . 3.08 111.789 -178.633 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -71.02 -41.2 71.18 Favored 'General case' 0 N--CA 1.446 -0.652 0 O-C-N 121.109 -0.994 . . . . 2.81 109.272 175.205 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -53.78 -40.67 66.46 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 122.85 0.46 . . . . 2.81 110.416 172.629 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 21.3 ttpt -53.58 -16.55 1.6 Allowed 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.143 0.977 . . . . 1.97 112.814 174.805 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 59.5 m-85 -132.8 53.76 1.99 Allowed 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 118.923 0.783 . . . . 4.65 110.368 167.295 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 48.8 t80 -79.21 -75.84 0.23 Allowed 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.98 0.912 . . . . 2.31 109.97 173.787 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 1.7 tp -76.11 -8.91 58.07 Favored 'General case' 0 CA--C 1.542 0.636 0 O-C-N 120.438 -1.414 . . . . 2.45 112.341 -176.776 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 61.1 mm-40 -47.5 -49.43 25.91 Favored 'General case' 0 C--N 1.343 0.289 0 C-N-CA 124.264 1.025 . . . . 1.65 110.886 175.478 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.4 -11.25 14.62 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 112.919 0.711 . . . . 3.53 112.919 -177.958 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.423 ' CZ ' HD11 ' A' ' 51' ' ' ILE . 13.4 m-30 -100.96 -60.13 1.58 Allowed 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 124.025 0.93 . . . . 3.62 110.067 178.688 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -101.21 -22.43 14.66 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 112.354 0.502 . . . . 3.51 112.354 -170.256 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 3.4 t 74.97 -50.7 0.67 Allowed 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 125.663 1.585 . . . . 2.46 110.654 -174.385 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -99.99 41.02 2.26 Favored Glycine 0 CA--C 1.526 0.777 0 O-C-N 121.239 -0.913 . . . . 1.03 111.065 179.096 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -80.98 -172.03 3.51 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 117.199 0.499 . . . . 1.39 111.287 179.805 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -87.84 -7.26 57.49 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 123.427 0.691 . . . . 2.97 112.536 -167.187 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -49.28 -35.55 18.2 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.453 1.501 . . . . 3.18 113.299 -163.426 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.557 ' H ' HD22 ' A' ' 78' ' ' LEU . 0.1 OUTLIER -52.08 -44.57 64.41 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.389 1.076 . . . . 0.85 112.025 173.58 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 32.1 m -65.1 107.71 1.62 Allowed 'General case' 0 C--O 1.236 0.366 0 CA-C-O 122.075 0.94 . . . . 0.81 110.294 179.025 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -58.29 -41.58 84.69 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 113.925 -1.489 . . . . 2.72 110.347 -178.934 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -48.1 -59.13 3.62 Favored 'General case' 0 C--O 1.225 -0.215 0 CA-C-N 118.863 0.756 . . . . 1.54 111.341 176.649 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 14.5 mt-10 -71.7 -42.68 67.08 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 123.795 0.838 . . . . 2.68 109.382 -168.049 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -49.08 -52.73 24.03 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 116.105 -0.498 . . . . 0.59 110.049 168.3 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 15.0 mmmt -69.17 -31.91 70.87 Favored 'General case' 0 C--O 1.22 -0.463 0 C-N-CA 123.402 0.681 . . . . 4.51 111.07 -174.323 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 70.9 m -58.26 -42.82 87.27 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 120.084 1.311 . . . . 1.4 110.644 170.2 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.465 HD21 ' CE1' ' A' ' 31' ' ' PHE . 0.5 OUTLIER -61.33 -62.56 1.75 Allowed 'General case' 0 C--O 1.234 0.254 0 N-CA-C 108.397 -0.964 . . . . 2.99 108.397 172.062 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 9.7 ttm -49.27 -48.51 45.84 Favored 'General case' 0 CA--C 1.536 0.418 0 O-C-N 123.666 0.604 . . . . 4.4 112.435 -173.272 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -49.72 -46.04 49.84 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 126.627 1.971 . . . . 0.7 111.955 -178.89 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -83.63 -49.86 8.77 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 110.433 -0.21 . . . . 0.83 110.433 -177.689 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.479 ' HB3' HD13 ' A' ' 98' ' ' ILE . . . -54.46 -41.83 69.94 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 122.691 0.396 . . . . 0.64 111.681 -178.753 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -74.42 81.75 1.92 Allowed 'General case' 0 N--CA 1.446 -0.658 0 CA-C-O 121.352 0.596 . . . . 1.23 110.084 178.94 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 42.6 p-10 -77.46 49.88 0.76 Allowed 'General case' 0 CA--C 1.536 0.414 0 O-C-N 121.646 -0.659 . . . . 2.67 111.315 176.023 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 34.2 m-20 -137.53 -60.44 0.66 Allowed 'General case' 0 C--N 1.341 0.231 0 C-N-CA 126.356 1.862 . . . . 1.22 109.258 178.595 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 102.26 43.27 2.06 Favored Glycine 0 CA--C 1.533 1.199 0 C-N-CA 125.028 1.299 . . . . 1.06 110.247 -161.95 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -121.85 -61.53 1.49 Allowed 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.948 1.699 . . . . 1.94 109.552 173.427 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 119.55 -24.13 8.17 Favored Glycine 0 CA--C 1.53 0.975 0 C-N-CA 125.2 1.381 . . . . 0.79 111.28 -179.533 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 41.0 mttt -78.86 103.72 9.0 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 107.673 -1.232 . . . . 5.17 107.673 171.393 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' ILE . . . . . 0.479 HD13 ' HB3' ' A' ' 90' ' ' ALA . 67.8 mt -94.43 118.92 41.57 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.577 0 N-CA-C 107.794 -1.188 . . . . 0.91 107.794 -176.121 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -72.51 166.87 53.83 Favored Glycine 0 CA--C 1.534 1.244 0 CA-C-O 121.69 0.606 . . . . 0.55 111.835 170.577 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -61.18 -37.15 81.92 Favored 'General case' 0 N--CA 1.456 -0.143 0 O-C-N 121.285 -1.127 . . . . 0.59 110.087 178.058 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 56.0 mt-10 -62.34 -55.81 24.45 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-O 118.686 -0.673 . . . . 2.75 110.552 176.173 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -43.7 -50.3 7.61 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-O 121.829 0.824 . . . . 1.44 110.008 173.936 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' PHE . . . . . 0.499 ' HB3' ' CZ ' ' A' ' 48' ' ' PHE . 0.8 OUTLIER -61.3 -54.2 47.0 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 112.868 0.692 . . . . 4.01 112.868 177.867 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 18.7 tt0 -53.66 -49.88 66.99 Favored 'General case' 0 C--O 1.223 -0.308 0 C-N-CA 124.55 1.14 . . . . 2.41 108.756 -178.714 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 65.4 mt-10 -48.99 -58.23 5.23 Favored 'General case' 0 C--O 1.232 0.165 0 C-N-CA 123.952 0.901 . . . . 3.46 110.064 176.928 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.3 -47.86 84.02 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 120.776 -0.37 . . . . 3.61 111.193 -175.518 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 37.4 t -58.67 -44.95 90.9 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.193 0 C-N-CA 122.974 0.509 . . . . 1.28 111.393 178.444 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 63.4 t60 -62.88 -30.08 71.24 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 125.65 1.58 . . . . 2.52 110.179 -173.268 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 2.9 t . . . . . 0 C--O 1.251 1.154 0 CA-C-O 116.848 -1.549 . . . . 2.77 111.701 -177.195 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 110' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 111' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.411 ' N ' ' OD2' ' A' ' 5' ' ' ASP . 12.6 ptm . . . . . 0 N--CA 1.473 0.704 0 N-CA-C 113.793 1.034 . . . . 8.16 113.793 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.0 m -136.05 -88.86 0.31 Allowed 'General case' 0 C--O 1.224 -0.241 0 N-CA-C 109.674 -0.491 . . . . 2.35 109.674 -174.477 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.439 HG22 HG12 ' A' ' 47' ' ' VAL . 1.2 pp -105.45 -25.05 3.8 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.157 0 CA-C-O 121.641 0.734 . . . . 1.29 110.035 -175.426 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 9.9 t -74.12 7.78 2.51 Favored 'General case' 0 N--CA 1.436 -1.173 0 C-N-CA 126.574 1.95 . . . . 1.9 111.056 -174.486 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.411 ' OD2' ' N ' ' A' ' 1' ' ' MET . 11.1 t70 -168.38 45.84 0.04 OUTLIER 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 126.54 1.936 . . . . 3.62 105.804 -158.493 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -148.13 -50.83 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.529 0.152 0 CA-C-N 115.38 -0.827 . . . . 1.78 110.879 179.849 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 177.98 -56.1 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 105.945 -1.872 . . . . 1.19 105.945 -172.81 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 8.4 m -44.39 -32.92 1.49 Allowed 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 126.243 1.817 . . . . 0.91 115.393 -172.344 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -49.53 -43.9 46.02 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 119.489 1.041 . . . . 0.84 112.941 175.349 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 42.9 t0 -72.34 -39.24 68.28 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 122.725 1.25 . . . . 2.04 109.751 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 43.9 m-20 -62.16 -44.99 95.38 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 123.581 0.752 . . . . 2.51 110.276 -178.213 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 39.0 pt -62.83 -40.94 90.65 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.196 0 CA-C-O 118.231 -0.89 . . . . 0.79 110.13 177.479 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -52.36 -47.74 65.96 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 119.291 0.95 . . . . 0.69 111.043 174.538 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -54.17 -60.78 2.88 Favored 'General case' 0 CA--C 1.529 0.162 0 O-C-N 122.334 -0.229 . . . . 0.65 111.083 173.173 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -50.98 -48.63 61.15 Favored 'General case' 0 C--O 1.233 0.222 0 C-N-CA 123.269 0.628 . . . . 0.66 112.09 -177.77 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -48.73 -50.03 35.48 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 125.203 1.401 . . . . 4.12 110.053 178.9 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -79.23 -46.96 16.81 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 120.033 -0.667 . . . . 2.89 109.484 -174.98 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 43.9 tp10 -45.81 -50.4 14.16 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 124.507 1.123 . . . . 4.27 110.662 178.899 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 76.2 m -105.94 46.91 0.9 Allowed 'General case' 0 C--O 1.236 0.361 0 C-N-CA 123.053 0.541 . . . . 1.6 110.242 -178.078 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.24 -43.28 82.32 Favored 'General case' 0 C--N 1.343 0.322 0 CA-C-O 121.798 0.809 . . . . 7.14 109.078 -179.699 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -67.35 134.92 93.19 Favored Pre-proline 0 N--CA 1.442 -0.846 0 C-N-CA 125.885 1.674 . . . . 2.32 109.404 -173.223 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -63.76 148.31 92.09 Favored 'Trans proline' 0 N--CA 1.456 -0.705 0 C-N-CA 122.835 2.356 . . . . 1.29 112.01 -171.35 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 9.5 t70 69.27 -0.15 2.63 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 127.608 2.363 . . . . 3.68 113.639 179.172 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 14.9 m -77.55 -21.03 53.21 Favored 'General case' 0 C--N 1.341 0.215 0 N-CA-C 114.099 1.148 . . . . 0.93 114.099 -175.45 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -75.27 90.9 2.62 Favored 'General case' 0 CA--C 1.539 0.538 0 O-C-N 121.42 -0.8 . . . . 3.76 111.61 -165.063 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -77.48 155.11 81.61 Favored Pre-proline 0 CA--C 1.535 0.396 0 O-C-N 121.717 -0.614 . . . . 2.75 110.453 175.264 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -71.57 -67.23 0.03 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.108 0 C-N-CA 122.987 2.458 . . . . 0.77 111.804 -176.271 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 71.5 mt-30 -53.54 -44.6 69.34 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 118.565 0.62 . . . . 2.04 110.487 179.503 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 25.3 tptt -43.84 -62.29 1.16 Allowed 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.429 1.091 . . . . 2.83 110.062 169.105 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 16.0 t80 -53.6 -51.54 62.7 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.13 0.572 . . . . 2.82 111.406 179.025 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 7.4 m-30 -58.08 -34.69 70.42 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 121.593 -0.692 . . . . 5.0 111.576 -176.8 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 12.9 tt0 -73.58 -57.57 3.9 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 108.616 -0.883 . . . . 3.61 108.616 175.932 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -54.51 -38.03 66.03 Favored 'General case' 0 N--CA 1.444 -0.76 0 C-N-CA 124.829 1.252 . . . . 1.28 110.631 -172.605 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 69.2 m -88.6 1.78 54.34 Favored 'General case' 0 N--CA 1.445 -0.72 0 N-CA-C 112.926 0.713 . . . . 2.2 112.926 -177.165 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 76.83 -15.35 6.27 Favored Glycine 0 CA--C 1.532 1.147 0 O-C-N 119.951 -1.718 . . . . 1.23 112.836 172.295 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 94.2 mt -45.01 -35.24 2.82 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 127.445 2.298 . . . . 1.58 112.434 170.527 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 9.1 t -60.57 -37.99 83.11 Favored 'General case' 0 CA--C 1.529 0.157 0 O-C-N 121.683 -0.636 . . . . 2.02 110.57 176.281 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 29.1 tttp -89.45 -30.38 18.35 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-O 118.857 -0.592 . . . . 4.8 111.235 -174.995 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -31.73 -67.31 0.1 Allowed 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 125.852 1.661 . . . . 3.33 113.303 -174.545 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 26.1 m 135.34 143.97 0.0 OUTLIER 'General case' 0 C--O 1.234 0.242 0 C-N-CA 130.433 3.493 . . . . 1.71 106.719 -177.442 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -42.61 -41.9 3.23 Favored 'General case' 0 C--O 1.226 -0.179 0 C-N-CA 124.668 1.187 . . . . 0.64 111.393 175.485 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 50.2 m-20 -58.94 -57.74 11.73 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 123.616 0.766 . . . . 1.83 110.006 -176.943 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 3.4 mm-40 -62.42 -53.88 48.43 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 109.328 -0.619 . . . . 2.98 109.328 -178.353 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 70.0 t -49.62 -46.2 20.88 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.724 0 CA-C-O 121.664 0.745 . . . . 0.79 111.192 177.737 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -63.17 -46.22 88.14 Favored 'General case' 0 N--CA 1.452 -0.37 0 O-C-N 120.61 -1.306 . . . . 3.36 111.419 177.927 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -55.69 -52.03 65.27 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 118.191 0.451 . . . . 2.99 110.878 175.964 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.439 HG12 HG22 ' A' ' 3' ' ' ILE . 3.4 m -56.21 -42.94 74.98 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 C-N-CA 120.516 -0.474 . . . . 0.76 109.885 177.687 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 25.3 m-85 -60.49 -39.37 87.47 Favored 'General case' 0 C--N 1.342 0.253 0 CA-C-N 119.055 0.843 . . . . 6.6 112.35 176.547 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 43.5 mtp180 -58.49 -43.02 88.85 Favored 'General case' 0 C--N 1.339 0.111 0 CA-C-N 119.287 0.949 . . . . 3.67 110.918 171.843 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 27.3 t80 -58.98 -44.62 91.59 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 118.197 0.453 . . . . 4.01 110.249 177.619 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.632 ' CG2' HD11 ' A' ' 59' ' ' LEU . 1.6 mp -58.68 -49.34 82.98 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 CA-C-O 118.088 -0.958 . . . . 1.61 112.061 174.461 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 45.1 t0 -69.91 70.02 0.33 Allowed 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.275 1.03 . . . . 1.79 109.567 -175.259 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 20.3 t30 -61.81 -38.43 88.1 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 126.849 2.06 . . . . 1.8 111.958 -165.94 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -69.74 -25.48 63.85 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 125.471 1.509 . . . . 2.32 111.559 171.76 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 4.9 mt-30 65.2 36.08 7.37 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 125.693 1.597 . . . . 2.79 113.036 -179.703 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 70.9 p -57.8 -31.88 67.0 Favored 'General case' 0 CA--C 1.534 0.341 0 O-C-N 121.373 -0.829 . . . . 1.33 112.3 169.421 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 88.51 37.43 7.53 Favored Glycine 0 CA--C 1.526 0.772 0 N-CA-C 109.011 -1.636 . . . . 1.41 109.011 -164.947 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 11.8 m-85 -164.74 135.83 4.18 Favored 'General case' 0 CA--C 1.516 -0.356 0 C-N-CA 125.273 1.429 . . . . 2.64 108.796 -177.269 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.632 HD11 ' CG2' ' A' ' 51' ' ' ILE . 1.0 OUTLIER -86.19 78.01 9.45 Favored 'General case' 0 N--CA 1.443 -0.786 0 N-CA-C 107.511 -1.292 . . . . 2.18 107.511 167.358 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -69.55 157.66 36.74 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 114.336 -1.302 . . . . 1.65 110.199 177.093 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -53.14 -51.51 61.71 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.422 1.089 . . . . 4.56 112.969 -168.281 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.9 tm-20 -59.92 -47.89 83.92 Favored 'General case' 0 CA--C 1.531 0.228 0 N-CA-C 109.719 -0.474 . . . . 4.04 109.719 -173.931 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -56.69 -36.26 69.41 Favored 'General case' 0 C--N 1.332 -0.18 0 C-N-CA 123.399 0.679 . . . . 2.04 111.219 177.611 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 7.0 tp -55.74 -34.68 65.4 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 122.496 0.318 . . . . 2.34 110.546 176.719 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 31.1 ttpt -62.73 -10.82 14.07 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.881 1.272 . . . . 2.15 112.761 174.252 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -124.85 18.99 8.56 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 126.089 1.756 . . . . 5.02 110.561 175.21 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 83.3 t80 -52.2 -70.99 0.07 Allowed 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.391 1.077 . . . . 2.15 111.689 -172.797 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.56 -19.24 62.18 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.495 0.718 . . . . 3.35 109.53 -176.597 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -71.31 1.52 6.06 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 126.608 1.963 . . . . 2.13 113.09 178.459 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.75 -32.06 59.83 Favored 'General case' 0 CA--C 1.529 0.156 0 O-C-N 121.308 -0.87 . . . . 3.11 110.496 159.817 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.44 ' CZ ' HD11 ' A' ' 51' ' ' ILE . 4.4 m-30 -93.43 -58.74 2.2 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 124.289 1.036 . . . . 3.31 108.845 -174.228 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -96.01 -170.95 2.21 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 124.804 1.242 . . . . 2.92 107.898 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 23.8 m -136.35 48.68 2.13 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 123.603 0.761 . . . . 2.38 110.271 175.516 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 141.61 60.88 0.03 OUTLIER Glycine 0 C--N 1.336 0.554 0 N-CA-C 109.92 -1.272 . . . . 1.41 109.92 -178.594 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -89.17 -98.82 0.09 Allowed 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.038 0.535 . . . . 2.01 109.994 179.674 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -144.07 24.53 1.63 Allowed 'General case' 0 CA--C 1.528 0.12 0 CA-C-O 121.682 0.753 . . . . 3.28 111.51 -179.396 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 5.2 mp0 -72.29 -36.07 68.85 Favored 'General case' 0 N--CA 1.445 -0.717 0 C-N-CA 125.229 1.412 . . . . 4.69 108.7 -172.052 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.497 ' H ' HD22 ' A' ' 78' ' ' LEU . 0.2 OUTLIER -51.77 -56.48 13.6 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 126.305 1.842 . . . . 0.97 111.434 178.74 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 58.9 m -59.89 114.44 2.81 Favored 'General case' 0 C--N 1.341 0.231 0 N-CA-C 110.021 -0.363 . . . . 0.89 110.021 -173.755 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -64.97 -44.68 88.53 Favored 'General case' 0 N--CA 1.447 -0.609 0 N-CA-C 109.825 -0.435 . . . . 3.39 109.825 -176.149 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.5 m -50.9 -59.69 3.86 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 123.815 0.846 . . . . 1.54 110.374 177.058 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.93 -49.38 71.47 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 123.8 0.84 . . . . 2.6 110.737 178.98 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -58.83 -39.19 80.51 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 120.125 -0.63 . . . . 0.9 109.594 179.757 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 90.3 mttt -69.42 -27.61 65.42 Favored 'General case' 0 C--O 1.219 -0.51 0 C-N-CA 124.054 0.942 . . . . 4.74 111.388 177.81 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 14.6 m -58.36 -46.15 86.85 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 120.183 1.356 . . . . 1.31 109.907 169.806 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.3 mp -61.01 -59.79 4.82 Favored 'General case' 0 C--O 1.233 0.226 0 N-CA-C 109.829 -0.434 . . . . 3.04 109.829 170.077 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 29.8 ttp -46.09 -53.8 9.67 Favored 'General case' 0 C--O 1.221 -0.431 0 C-N-CA 123.06 0.544 . . . . 2.73 111.592 -175.209 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -47.41 -64.11 0.87 Allowed 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 127.456 2.302 . . . . 1.0 110.741 -174.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -65.07 -53.11 50.71 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 116.348 -0.387 . . . . 0.68 110.037 179.879 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -50.41 -39.29 46.78 Favored 'General case' 0 C--O 1.226 -0.143 0 N-CA-C 111.769 0.285 . . . . 0.51 111.769 -176.131 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -72.28 -58.33 3.49 Favored 'General case' 0 N--CA 1.445 -0.719 0 C-N-CA 124.124 0.97 . . . . 2.42 110.333 178.843 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 46.31 25.61 0.38 Allowed 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.344 1.458 . . . . 3.04 114.837 -175.039 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 69.2 m-20 -112.23 -45.16 3.31 Favored 'General case' 0 N--CA 1.463 0.192 0 C-N-CA 123.752 0.821 . . . . 1.85 109.452 177.178 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 97.68 39.81 3.79 Favored Glycine 0 CA--C 1.53 0.971 0 C-N-CA 125.681 1.61 . . . . 1.24 109.48 -161.792 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -127.39 -47.29 1.45 Allowed 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 118.386 1.093 . . . . 1.77 111.856 174.505 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 109.27 -27.89 11.87 Favored Glycine 0 CA--C 1.527 0.841 0 C-N-CA 124.175 0.893 . . . . 0.73 112.347 172.089 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 23.7 mttt -78.9 131.43 36.4 Favored 'General case' 0 C--O 1.241 0.642 0 N-CA-C 107.986 -1.116 . . . . 4.12 107.986 174.08 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 10.6 mt -123.8 106.14 16.62 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.457 0 C-N-CA 124.659 1.183 . . . . 1.12 108.426 -166.416 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -62.68 161.0 32.45 Favored Glycine 0 CA--C 1.53 0.981 0 N-CA-C 110.159 -1.176 . . . . 0.7 110.159 168.082 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -58.88 -37.08 75.75 Favored 'General case' 0 N--CA 1.453 -0.284 0 O-C-N 121.604 -0.939 . . . . 0.96 109.81 177.068 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 61.5 mt-10 -66.13 -47.89 72.6 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 122.947 0.499 . . . . 3.79 111.431 -179.594 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -47.88 -53.51 15.52 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 121.853 0.835 . . . . 1.95 109.632 170.495 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -66.92 -44.38 80.89 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 116.113 -0.494 . . . . 3.19 111.201 -173.285 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 10.1 tt0 -51.96 -54.38 30.28 Favored 'General case' 0 C--O 1.221 -0.439 0 C-N-CA 125.157 1.383 . . . . 2.72 109.515 172.356 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -48.36 -52.42 21.8 Favored 'General case' 0 C--O 1.231 0.097 0 CA-C-N 119.071 0.85 . . . . 4.0 110.212 177.231 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -61.88 -46.26 90.18 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 119.921 -0.712 . . . . 3.11 110.879 -176.937 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 44.0 t -59.97 -38.03 74.83 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.23 0 CA-C-O 119.196 -0.431 . . . . 1.46 111.828 175.181 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 2.0 t60 -64.66 -19.79 65.92 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 125.512 1.525 . . . . 2.46 109.997 -171.397 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 34.8 t . . . . . 0 C--O 1.254 1.296 0 CA-C-O 115.077 -2.392 . . . . 2.71 113.148 175.742 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 110' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 111' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.472 0.644 0 N-CA-C 105.792 -1.929 . . . . 9.21 105.792 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 28.2 t -156.62 176.46 12.69 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 106.272 -1.751 . . . . 2.72 106.272 172.65 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.65 HG22 HG12 ' A' ' 47' ' ' VAL . 1.3 pp -58.93 -27.32 35.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 C-N-CA 124.527 1.131 . . . . 1.4 110.784 -175.398 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.54 ' HA ' ' HB2' ' A' ' 9' ' ' ALA . 0.6 OUTLIER -68.21 -10.76 56.77 Favored 'General case' 0 N--CA 1.439 -0.989 0 C-N-CA 126.082 1.753 . . . . 1.88 112.014 179.013 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.0 t0 -135.83 32.5 2.97 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.096 1.359 . . . . 2.56 109.948 -174.238 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 11.2 m -125.34 -56.33 2.04 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 N-CA-C 112.576 0.584 . . . . 2.59 112.576 172.643 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 22.3 tp -171.55 -59.2 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.135 0 N-CA-C 106.131 -1.803 . . . . 1.43 106.131 -172.641 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 28.5 m -42.06 -35.78 0.98 Allowed 'General case' 0 C--O 1.217 -0.656 0 C-N-CA 125.501 1.52 . . . . 1.22 113.698 -175.909 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.54 ' HB2' ' HA ' ' A' ' 4' ' ' THR . . . -40.68 -45.63 2.42 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 114.094 1.146 . . . . 0.84 114.094 172.245 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -70.9 -43.63 67.94 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 122.261 1.029 . . . . 1.78 109.597 179.352 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -62.83 -46.55 87.38 Favored 'General case' 0 N--CA 1.449 -0.518 0 C-N-CA 123.963 0.905 . . . . 2.55 109.966 -175.654 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 35.9 pt -58.94 -41.67 83.76 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.767 0 C-N-CA 123.752 0.821 . . . . 0.97 110.354 178.362 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.8 -46.76 84.19 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 110.267 -0.272 . . . . 1.09 110.267 176.975 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.49 -52.28 66.27 Favored 'General case' 0 CA--C 1.529 0.15 0 O-C-N 121.781 -0.574 . . . . 0.91 110.715 173.458 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.418 ' HB1' ' CE2' ' A' ' 30' ' ' PHE . . . -53.11 -43.82 67.15 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 124.769 1.227 . . . . 1.03 111.537 -176.259 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -55.36 -43.24 74.91 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 124.225 1.01 . . . . 3.7 109.017 176.455 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 68.5 mt-30 -77.23 -39.17 49.45 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-O 119.164 -0.446 . . . . 4.14 111.663 -176.513 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.34 -44.58 82.9 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 108.99 -0.744 . . . . 3.38 108.99 179.25 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 76.4 m -85.49 41.58 0.9 Allowed 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.219 1.008 . . . . 2.26 111.195 175.873 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 15.1 mtt180 -77.69 -55.58 5.23 Favored 'General case' 0 CA--C 1.518 -0.285 0 O-C-N 121.142 -0.974 . . . . 4.99 108.605 178.813 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -69.46 140.52 90.0 Favored Pre-proline 0 N--CA 1.448 -0.55 0 CA-C-N 115.83 -0.623 . . . . 2.72 109.509 -175.036 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -63.63 142.65 84.66 Favored 'Trans proline' 0 N--CA 1.449 -1.108 0 C-N-CA 122.208 1.939 . . . . 1.24 111.207 -175.94 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 17.8 t70 57.62 36.92 27.24 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 127.009 2.124 . . . . 3.62 112.179 178.76 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 24.4 m -102.31 -29.57 11.59 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.872 1.269 . . . . 0.82 111.281 177.085 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -53.87 125.44 18.64 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 125.688 1.595 . . . . 2.39 109.155 -177.488 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -119.64 152.06 52.79 Favored Pre-proline 0 C--O 1.232 0.134 0 C-N-CA 124.686 1.194 . . . . 2.18 108.294 172.537 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -64.94 -66.47 0.04 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.217 0 C-N-CA 122.707 2.271 . . . . 0.56 110.52 178.428 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 35.0 mt-30 -60.61 -36.53 78.82 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 122.978 0.511 . . . . 2.17 111.297 -175.103 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -58.5 -64.85 0.78 Allowed 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 109.316 -0.624 . . . . 5.16 109.316 173.108 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.418 ' CE2' ' HB1' ' A' ' 15' ' ' ALA . 55.9 t80 -56.6 -45.55 81.37 Favored 'General case' 0 C--O 1.221 -0.42 0 CA-C-O 121.427 0.632 . . . . 2.19 110.593 -174.717 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.404 ' CE1' ' HA ' ' A' ' 107' ' ' VAL . 4.4 t80 -41.29 -57.24 2.19 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 126.784 2.034 . . . . 4.71 111.047 176.422 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 12.0 mt-30 -70.96 -45.36 64.26 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 109.933 -0.395 . . . . 2.96 109.933 178.698 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -55.99 -29.06 59.74 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 123.11 0.564 . . . . 0.72 112.439 -179.001 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 14.7 t -88.5 -8.74 54.34 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 126.489 1.916 . . . . 1.44 110.429 -175.505 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 81.05 -1.99 82.7 Favored Glycine 0 C--N 1.34 0.795 0 O-C-N 121.322 -0.861 . . . . 0.67 111.04 174.047 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.413 ' HB3' HG13 ' A' ' 107' ' ' VAL . 85.0 mt -63.36 -28.85 70.27 Favored 'General case' 0 N--CA 1.441 -0.896 0 C-N-CA 124.737 1.215 . . . . 1.33 110.217 -176.246 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 60.4 p -63.02 -35.52 80.5 Favored 'General case' 0 C--N 1.338 0.102 0 C-N-CA 123.711 0.805 . . . . 2.36 111.62 171.894 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 7.5 tttt -82.79 -32.08 27.88 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 108.945 -0.761 . . . . 5.1 108.945 -176.158 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 21.5 mtt -57.62 124.66 19.84 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-O 121.088 0.471 . . . . 2.86 110.342 174.273 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 6.9 m -61.2 157.09 16.89 Favored 'General case' 0 N--CA 1.452 -0.368 0 O-C-N 121.525 -0.734 . . . . 1.91 110.15 172.171 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -43.33 -40.26 3.51 Favored 'General case' 0 C--O 1.225 -0.22 0 C-N-CA 124.031 0.932 . . . . 0.67 111.414 175.399 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 49.9 m-20 -47.02 -60.07 2.7 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 124.351 1.061 . . . . 1.87 110.381 174.559 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 30.6 mm100 -69.32 -43.56 73.47 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 115.778 -0.646 . . . . 3.25 109.547 -175.696 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 95.2 t -56.91 -45.89 83.6 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 CA-C-N 119.166 0.894 . . . . 0.56 110.087 -179.937 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 14.2 tttt -63.03 -43.15 99.49 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 109.598 -0.519 . . . . 3.54 109.598 176.206 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 27.0 t0 -61.75 -54.99 34.94 Favored 'General case' 0 CA--C 1.535 0.38 0 O-C-N 121.947 -0.471 . . . . 2.45 110.964 -179.098 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.65 HG12 HG22 ' A' ' 3' ' ' ILE . 15.0 m -55.19 -43.65 71.43 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.202 0 C-N-CA 123.045 0.538 . . . . 0.69 110.364 176.694 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -44.8 -48.25 10.95 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 118.679 0.672 . . . . 5.25 111.221 171.733 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 83.6 mtm180 -60.27 -30.91 69.75 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 118.807 0.731 . . . . 6.5 112.479 177.857 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 14.0 m-85 -70.46 -34.59 72.59 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 118.963 0.801 . . . . 3.82 111.105 172.638 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.764 HG22 ' H ' ' A' ' 52' ' ' ASP . 18.0 mm -77.83 -171.82 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.84 0 CA-C-N 118.994 0.816 . . . . 2.39 109.692 177.95 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.764 ' H ' HG22 ' A' ' 51' ' ' ILE . 41.8 t0 75.55 -55.8 0.62 Allowed 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 127.331 2.253 . . . . 4.11 110.216 -178.472 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 11.3 t30 96.52 -54.41 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.187 0 C-N-CA 127.935 2.494 . . . . 2.13 108.437 -179.787 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -56.06 -35.23 66.72 Favored 'General case' 0 CA--C 1.529 0.14 0 C-N-CA 124.371 1.069 . . . . 2.37 111.642 170.937 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 75.8 mt-30 55.8 49.96 15.09 Favored 'General case' 0 CA--C 1.539 0.523 0 N-CA-C 109.19 -0.67 . . . . 4.55 109.19 -159.768 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 51.0 p -90.47 -44.25 9.73 Favored 'General case' 0 C--N 1.339 0.13 0 C-N-CA 123.422 0.689 . . . . 2.12 110.045 174.508 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 117.44 -37.88 3.16 Favored Glycine 0 C--N 1.336 0.573 0 N-CA-C 111.241 -0.743 . . . . 2.27 111.241 -177.411 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 11.2 m-85 -70.73 110.12 5.35 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 106.453 -1.684 . . . . 2.48 106.453 167.744 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -84.71 81.49 8.85 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 106.117 -1.808 . . . . 1.88 106.117 166.034 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -69.65 150.62 46.83 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 114.122 -1.399 . . . . 1.46 109.161 -179.628 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -47.76 -46.5 30.24 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.768 1.227 . . . . 3.9 112.112 -171.642 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -57.39 -39.99 77.28 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 123.143 0.577 . . . . 3.68 111.089 -178.896 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -71.54 -28.34 63.81 Favored 'General case' 0 CA--C 1.517 -0.289 0 O-C-N 120.959 -1.088 . . . . 2.34 110.399 -178.889 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.27 -30.36 59.96 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 119.285 -0.388 . . . . 2.33 110.375 170.137 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 31.5 ttpt -60.71 -9.92 4.63 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.093 0.957 . . . . 1.96 113.222 172.997 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 30.4 m-85 -132.39 23.12 4.41 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.299 1.039 . . . . 4.97 111.244 172.217 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 44.2 t80 -55.02 -65.54 0.56 Allowed 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 118.827 0.739 . . . . 2.48 110.742 -178.624 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 14.3 tp -84.35 -13.65 51.73 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.399 0.68 . . . . 2.41 111.598 -176.065 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 83.5 mm-40 -52.56 -57.02 11.31 Favored 'General case' 0 C--N 1.344 0.343 0 N-CA-C 109.006 -0.739 . . . . 2.13 109.006 173.719 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.78 42.31 0.37 Allowed 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 112.296 0.48 . . . . 2.35 112.296 -179.658 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.598 ' CE1' HD11 ' A' ' 51' ' ' ILE . 0.1 OUTLIER -147.04 -56.87 0.26 Allowed 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 127.384 2.273 . . . . 3.33 106.404 -179.258 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -104.8 -46.34 4.34 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.516 1.126 . . . . 3.89 111.657 -178.295 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 19.9 m 81.4 109.13 0.07 Allowed 'General case' 0 C--N 1.34 0.182 0 C-N-CA 126.687 1.995 . . . . 3.24 110.358 -170.684 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 86.64 40.73 7.11 Favored Glycine 0 CA--C 1.525 0.711 0 N-CA-C 110.594 -1.002 . . . . 1.21 110.594 -179.597 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -85.88 -154.77 0.22 Allowed 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.041 0.937 . . . . 1.34 110.886 177.739 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 1.6 tpt85 -102.28 -9.26 20.55 Favored 'General case' 0 N--CA 1.463 0.182 0 C-N-CA 123.524 0.729 . . . . 4.08 112.684 -161.744 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -43.89 -39.75 4.12 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 129.253 3.021 . . . . 3.38 113.038 -167.004 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.571 ' H ' HD22 ' A' ' 78' ' ' LEU . 0.6 OUTLIER -50.55 -41.48 54.07 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 124.669 1.188 . . . . 1.08 111.991 176.128 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 63.7 m -65.33 109.47 2.28 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 108.63 -0.878 . . . . 0.85 108.63 171.722 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 16.5 pt-20 -54.95 -46.62 75.03 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-N 115.457 -0.792 . . . . 3.17 110.525 176.199 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.1 m -50.13 -58.08 6.31 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 119.457 1.026 . . . . 1.28 112.393 176.912 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -64.82 -40.52 95.34 Favored 'General case' 0 N--CA 1.453 -0.325 0 N-CA-C 109.836 -0.431 . . . . 2.7 109.836 -173.402 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -61.85 -44.92 95.86 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 122.515 1.15 . . . . 0.94 109.563 174.224 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -62.65 -31.62 72.52 Favored 'General case' 0 N--CA 1.444 -0.743 0 C-N-CA 124.898 1.279 . . . . 7.1 109.91 -176.406 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 50.6 m -53.82 -43.21 69.21 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 119.529 1.059 . . . . 1.31 111.284 171.087 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 8.0 mt -64.92 -56.61 12.27 Favored 'General case' 0 C--O 1.233 0.228 0 N-CA-C 109.184 -0.673 . . . . 2.17 109.184 170.958 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 7.7 ttm -43.59 -47.55 7.48 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 124.077 0.861 . . . . 3.07 112.056 -177.592 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -54.5 -46.86 73.55 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 127.661 2.384 . . . . 0.89 112.392 -173.47 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -87.08 -41.53 13.75 Favored 'General case' 0 CA--C 1.522 -0.111 0 CA-C-N 117.821 0.282 . . . . 0.75 110.783 179.18 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -54.83 -46.85 74.66 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 116.554 -0.294 . . . . 0.35 110.212 -179.252 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -73.7 77.97 1.54 Allowed 'General case' 0 N--CA 1.447 -0.589 0 CA-C-O 121.625 0.726 . . . . 0.98 109.7 178.669 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 51.4 p30 -77.07 41.58 0.29 Allowed 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.61 -0.681 . . . . 2.65 111.793 177.794 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 26.4 m-20 -128.14 -59.72 1.17 Allowed 'General case' 0 C--N 1.34 0.158 0 C-N-CA 126.614 1.966 . . . . 1.23 108.527 179.3 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 103.78 45.41 1.52 Allowed Glycine 0 CA--C 1.531 1.083 0 C-N-CA 125.19 1.376 . . . . 0.77 110.096 -164.129 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -125.1 -63.89 1.13 Allowed 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.58 1.552 . . . . 1.88 110.194 173.754 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 128.08 -30.8 3.82 Favored Glycine 0 CA--C 1.531 1.079 0 C-N-CA 124.885 1.231 . . . . 0.79 111.794 -179.915 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 37.9 mttp -73.17 108.4 6.03 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 108.153 -1.055 . . . . 4.46 108.153 169.439 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 18.1 mt -97.6 115.25 36.98 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.353 0 C-N-CA 123.952 0.901 . . . . 0.76 108.855 -174.393 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -69.93 164.9 51.34 Favored Glycine 0 CA--C 1.537 1.446 0 CA-C-N 118.73 0.696 . . . . 0.84 112.527 172.534 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -59.08 -39.56 82.5 Favored 'General case' 0 N--CA 1.456 -0.163 0 O-C-N 121.518 -0.989 . . . . 1.23 108.525 171.613 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -51.22 -57.94 7.48 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 124.344 1.057 . . . . 4.07 111.288 170.216 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -51.13 -48.1 61.86 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.133 0.973 . . . . 1.99 110.406 176.637 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -56.54 -60.3 3.74 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 112.349 0.5 . . . . 3.54 112.349 176.267 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -59.82 -35.69 75.23 Favored 'General case' 0 C--O 1.22 -0.467 0 CA-C-O 118.587 -0.721 . . . . 3.1 110.19 -178.286 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 17.8 mm-40 -57.5 -59.86 4.52 Favored 'General case' 0 N--CA 1.456 -0.128 0 CA-C-N 119.686 1.13 . . . . 3.21 109.654 174.068 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -56.14 -50.7 70.38 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-O 121.719 0.771 . . . . 3.86 109.119 -177.349 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 107' ' ' VAL . . . . . 0.413 HG13 ' HB3' ' A' ' 36' ' ' LEU . 96.6 t -72.49 -30.6 34.96 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.761 0 CA-C-N 115.604 -0.726 . . . . 1.49 112.58 -172.528 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 15.2 t60 -95.16 15.36 19.31 Favored 'General case' 0 CA--C 1.532 0.286 0 O-C-N 120.117 -1.614 . . . . 3.44 110.952 178.367 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 5.8 t . . . . . 0 C--O 1.253 1.239 0 CA-C-O 116.868 -1.539 . . . . 3.45 109.142 179.661 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 110' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 111' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 94.5 mtp . . . . . 0 N--CA 1.472 0.653 0 N-CA-C 107.595 -1.261 . . . . 10.39 107.595 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 18.7 t -173.26 48.68 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 124.493 1.117 . . . . 3.74 108.17 176.553 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.583 HG22 HG12 ' A' ' 47' ' ' VAL 0.311 0.6 OUTLIER 69.41 -48.35 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.882 0 C-N-CA 126.76 2.024 . . . . 1.58 112.858 -177.022 . . . . . . . . 4 4 . 1 . 010 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 5.7 t -38.77 -29.94 0.04 OUTLIER 'General case' 0 N--CA 1.442 -0.83 1 C-N-CA 133.036 4.535 . . . . 1.93 115.5 176.59 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 39.5 t0 -145.22 57.25 1.25 Allowed 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 121.822 0.82 . . . . 3.59 109.08 170.176 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 97.0 t -116.83 -59.47 3.1 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.17 0 CA-C-N 115.226 -0.897 . . . . 1.75 109.366 173.813 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 13.6 tp -169.67 -60.55 0.02 OUTLIER 'General case' 0 CA--C 1.519 -0.213 0 N-CA-C 106.075 -1.824 . . . . 1.47 106.075 -178.354 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -53.18 -20.42 3.94 Favored 'General case' 0 N--CA 1.446 -0.666 0 C-N-CA 125.507 1.523 . . . . 1.02 113.152 -172.012 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -50.13 -40.97 47.92 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 113.516 0.932 . . . . 0.94 113.516 169.847 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -70.87 -42.45 70.05 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 122.4 1.095 . . . . 1.85 109.264 176.013 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -65.29 -44.12 88.97 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 115.489 -0.778 . . . . 2.48 109.659 -172.538 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 36.3 pt -58.67 -39.15 75.37 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.671 0 O-C-N 120.855 -1.153 . . . . 0.77 111.066 175.778 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.63 -43.2 93.92 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 109.689 -0.486 . . . . 0.64 109.689 176.394 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.43 -56.66 19.24 Favored 'General case' 0 CA--C 1.535 0.397 0 O-C-N 122.115 -0.366 . . . . 0.51 110.419 172.699 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -50.34 -46.79 55.93 Favored 'General case' 0 C--O 1.231 0.116 0 C-N-CA 125.224 1.41 . . . . 0.51 111.448 -176.927 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.1 mt -50.01 -44.88 51.46 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.056 -0.975 . . . . 3.22 109.712 178.386 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.38 -46.5 17.48 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 109.763 -0.458 . . . . 4.51 109.763 -175.945 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.74 -28.26 66.65 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 121.207 -0.197 . . . . 2.74 111.416 -169.867 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 62.5 m -112.78 49.59 0.93 Allowed 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.887 1.275 . . . . 1.36 109.054 171.199 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -73.49 -33.65 64.91 Favored 'General case' 0 C--O 1.236 0.351 0 O-C-N 121.25 -0.906 . . . . 5.54 109.716 177.521 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -83.97 141.27 40.57 Favored Pre-proline 0 N--CA 1.449 -0.499 0 C-N-CA 125.456 1.502 . . . . 1.96 109.46 -171.205 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -59.96 148.94 86.85 Favored 'Trans proline' 0 N--CA 1.451 -0.98 0 C-N-CA 122.342 2.028 . . . . 1.21 110.441 -170.879 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 50.81 42.24 27.49 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 126.243 1.817 . . . . 2.65 111.333 173.525 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 10.4 m -109.65 -24.49 10.9 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 125.089 1.356 . . . . 1.04 112.869 179.451 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -53.38 112.51 0.91 Allowed 'General case' 0 N--CA 1.445 -0.718 0 C-N-CA 123.417 0.687 . . . . 3.15 112.141 -177.04 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -102.78 156.16 35.64 Favored Pre-proline 0 CA--C 1.539 0.531 0 C-N-CA 124.531 1.132 . . . . 2.63 109.836 173.663 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_endo -68.4 -78.42 0.01 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.883 0 C-N-CA 123.563 2.842 . . . . 1.09 112.187 -176.481 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 46.3 mt-30 -50.1 -43.91 51.78 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.991 0.916 . . . . 2.88 110.892 -178.562 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -44.59 -63.55 0.88 Allowed 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 124.266 1.026 . . . . 3.31 110.163 169.863 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 5.3 t80 -60.76 -42.47 97.52 Favored 'General case' 0 C--O 1.224 -0.266 0 CA-C-N 118.21 0.459 . . . . 2.11 110.915 -179.071 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 8.3 m-30 -56.08 -37.77 69.79 Favored 'General case' 0 CA--C 1.532 0.272 0 O-C-N 121.21 -0.931 . . . . 4.6 110.93 -179.242 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 12.6 tt0 -76.31 -53.27 8.44 Favored 'General case' 0 N--CA 1.456 -0.134 0 O-C-N 121.921 -0.487 . . . . 3.0 110.101 174.119 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -66.3 -17.39 64.73 Favored 'General case' 0 N--CA 1.447 -0.608 0 C-N-CA 123.557 0.743 . . . . 0.9 112.618 -171.931 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 2.6 t -96.41 -3.82 42.87 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 125.747 1.619 . . . . 1.46 111.154 176.236 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 80.43 -21.78 5.02 Favored Glycine 0 CA--C 1.532 1.144 0 O-C-N 120.662 -1.274 . . . . 0.73 112.308 178.673 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -40.75 -48.02 2.94 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 126.968 2.107 . . . . 2.76 114.018 178.32 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 43.6 p -68.47 -26.15 65.34 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 118.873 0.761 . . . . 2.02 112.016 -179.731 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 22.2 tttt -78.89 -38.0 38.66 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 107.903 -1.147 . . . . 4.23 107.903 178.345 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 9.8 mmt -62.64 139.47 58.64 Favored 'General case' 0 N--CA 1.44 -0.95 0 CA-C-O 121.575 0.703 . . . . 3.74 109.541 176.006 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 44.5 p -74.97 162.07 28.92 Favored 'General case' 0 N--CA 1.449 -0.48 0 O-C-N 121.759 -0.588 . . . . 2.02 109.889 -179.164 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -45.7 -35.99 4.61 Favored 'General case' 0 C--O 1.225 -0.223 0 C-N-CA 124.235 1.014 . . . . 0.61 112.239 176.738 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -49.9 -60.34 3.01 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 123.331 0.652 . . . . 2.77 110.681 172.334 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 5.8 mm100 -69.38 -42.38 75.23 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-O 119.134 -0.46 . . . . 2.53 109.948 -176.776 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 60.7 t -59.55 -38.41 75.22 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-N 119.148 0.885 . . . . 0.61 110.051 179.363 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 54.8 tttp -63.62 -48.92 75.35 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 118.719 0.69 . . . . 2.77 110.245 174.079 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -55.65 -57.55 11.51 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 120.626 0.251 . . . . 3.12 110.709 -179.827 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.583 HG12 HG22 ' A' ' 3' ' ' ILE . 5.5 m -57.91 -46.94 87.45 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.214 0 N-CA-C 109.579 -0.526 . . . . 0.53 109.579 177.776 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 13.8 t80 -46.15 -48.46 17.39 Favored 'General case' 0 C--O 1.224 -0.285 0 CA-C-O 118.454 -0.784 . . . . 4.05 110.663 177.243 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 76.2 mtp180 -54.74 -40.59 69.46 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-N 119.302 0.956 . . . . 3.91 111.493 177.169 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -63.78 -41.26 97.98 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 110.242 -0.281 . . . . 3.84 110.242 176.487 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.424 HG22 HD11 ' A' ' 59' ' ' LEU . 3.3 mp -65.42 -42.09 92.63 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.687 0 O-C-N 121.623 -0.673 . . . . 1.66 110.716 176.396 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 54.3 t0 -75.76 63.09 1.59 Allowed 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 124.933 1.293 . . . . 1.95 110.073 179.311 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -47.11 144.11 2.79 Favored 'General case' 0 C--O 1.232 0.175 0 N-CA-C 107.715 -1.217 . . . . 3.64 107.715 168.008 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 75.91 -33.82 0.23 Allowed 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 125.048 1.339 . . . . 3.4 112.209 -173.86 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 56.75 41.08 28.71 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 124.7 1.2 . . . . 4.59 111.532 -175.275 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 11.8 p -48.22 -32.15 6.75 Favored 'General case' 0 C--N 1.341 0.238 0 C-N-CA 126.36 1.864 . . . . 2.13 112.196 176.02 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 113.34 -17.79 21.22 Favored Glycine 0 CA--C 1.525 0.673 0 N-CA-C 109.365 -1.494 . . . . 1.87 109.365 -164.229 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 84.7 m-85 -135.39 159.44 41.57 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-O 123.041 1.4 . . . . 2.14 112.005 179.727 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.424 HD11 HG22 ' A' ' 51' ' ' ILE . 3.5 mm? -98.21 73.8 2.2 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 105.426 -2.064 . . . . 1.89 105.426 164.731 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -55.17 146.22 19.27 Favored 'General case' 0 CA--C 1.545 0.765 0 CA-C-N 113.807 -1.542 . . . . 1.61 108.815 172.376 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -50.15 -54.45 20.67 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 113.952 1.093 . . . . 3.34 113.952 -160.937 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 64.5 mt-10 -55.34 -31.69 61.92 Favored 'General case' 0 CA--C 1.535 0.368 0 O-C-N 121.589 -0.695 . . . . 3.59 111.982 177.965 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -71.14 -43.09 68.24 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 123.149 0.58 . . . . 2.32 109.614 176.767 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -51.6 -36.01 43.87 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.471 1.108 . . . . 2.61 110.398 173.225 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 10.8 ttmt -46.82 -60.84 2.16 Favored 'General case' 0 N--CA 1.464 0.272 0 O-C-N 121.879 -0.513 . . . . 2.67 110.309 169.752 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -73.38 60.48 0.62 Allowed 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.91 0.884 . . . . 4.62 109.981 177.62 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -89.03 -69.38 0.71 Allowed 'General case' 0 C--N 1.331 -0.223 0 O-C-N 120.533 -1.354 . . . . 2.93 108.193 175.592 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 5.8 mp -68.18 -26.24 65.64 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 122.718 0.407 . . . . 3.36 111.368 -173.424 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -72.95 0.61 10.74 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 123.999 0.92 . . . . 3.55 113.132 -176.25 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 7.1 mptt -70.83 -32.2 69.18 Favored 'General case' 0 N--CA 1.455 -0.215 0 O-C-N 121.405 -0.809 . . . . 4.21 109.823 161.949 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -92.4 -58.17 2.46 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 123.335 0.654 . . . . 3.27 109.322 -172.087 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -98.31 175.97 5.87 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 123.597 0.759 . . . . 3.04 109.095 -178.055 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 15.9 p -109.51 -9.68 14.9 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 124.01 0.924 . . . . 2.51 112.29 171.952 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -137.95 41.27 1.39 Allowed Glycine 0 CA--C 1.527 0.802 0 N-CA-C 111.079 -0.809 . . . . 1.19 111.079 179.852 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -83.67 -177.5 6.72 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-O 121.948 0.88 . . . . 1.59 111.422 176.544 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 2.2 tpt180 -89.04 24.2 2.18 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.121 1.369 . . . . 3.08 113.409 -162.596 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -53.52 -55.58 24.28 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-O 122.54 1.162 . . . . 6.74 111.344 -176.006 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.408 ' H ' HD22 ' A' ' 78' ' ' LEU . 0.4 OUTLIER -49.85 -35.53 23.56 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 126.87 2.068 . . . . 1.46 112.678 -177.857 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 19.3 m -70.68 102.4 2.28 Favored 'General case' 0 CA--C 1.514 -0.41 0 C-N-CA 118.558 -1.257 . . . . 0.88 109.172 176.913 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -62.24 -40.15 95.21 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 113.153 -1.839 . . . . 3.44 109.371 -177.559 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 18.4 m -49.73 -51.82 36.06 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 120.391 1.45 . . . . 1.27 112.585 171.671 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -69.93 -46.78 64.62 Favored 'General case' 0 C--O 1.234 0.261 0 N-CA-C 108.903 -0.777 . . . . 2.65 108.903 -172.216 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -54.1 -48.88 70.24 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-O 122.059 0.933 . . . . 0.78 109.362 174.852 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 8.0 tmtt? -74.3 -29.61 61.71 Favored 'General case' 0 N--CA 1.442 -0.829 0 C-N-CA 124.869 1.268 . . . . 5.49 110.245 -170.707 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 23.2 t -57.57 -51.12 70.78 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 119.232 0.924 . . . . 1.68 108.642 170.317 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -60.39 -51.66 68.53 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-O 119.296 -0.383 . . . . 3.76 110.125 176.25 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 37.1 ttp -50.19 -44.33 52.94 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 117.798 0.272 . . . . 2.43 111.675 175.712 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -55.3 -45.49 76.25 Favored 'General case' 0 C--O 1.226 -0.172 0 C-N-CA 125.117 1.367 . . . . 0.53 111.226 -171.577 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -88.46 -43.99 11.05 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 116.345 -0.389 . . . . 0.54 110.702 -178.331 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -54.95 -41.94 71.71 Favored 'General case' 0 C--N 1.339 0.142 0 CA-C-N 117.809 0.277 . . . . 0.47 110.694 178.722 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -74.39 104.34 5.09 Favored 'General case' 0 N--CA 1.442 -0.841 0 N-CA-C 108.264 -1.013 . . . . 1.21 108.264 175.145 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 24.1 p30 -99.1 5.87 46.76 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-O 119.525 -0.274 . . . . 2.87 111.599 -177.832 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 45.7 m-20 -79.88 -52.22 8.15 Favored 'General case' 0 C--N 1.341 0.198 0 N-CA-C 108.944 -0.761 . . . . 1.4 108.944 167.472 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 91.64 44.75 4.17 Favored Glycine 0 CA--C 1.529 0.929 0 N-CA-C 109.275 -1.53 . . . . 0.83 109.275 -157.875 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -126.26 -48.66 1.57 Allowed 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 124.641 1.176 . . . . 2.46 110.533 177.47 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 126.52 -46.1 1.11 Allowed Glycine 0 C--N 1.337 0.585 0 C-N-CA 124.606 1.098 . . . . 0.75 110.372 171.111 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -60.12 114.89 3.1 Favored 'General case' 0 C--O 1.237 0.446 0 N-CA-C 108.915 -0.772 . . . . 3.62 108.915 174.099 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 7.2 mt -97.94 153.71 3.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 C-N-CA 124.781 1.233 . . . . 0.77 108.693 177.919 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -126.62 178.85 16.6 Favored Glycine 0 CA--C 1.526 0.747 0 N-CA-C 109.062 -1.615 . . . . 1.02 109.062 174.398 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -61.41 -47.25 86.63 Favored 'General case' 0 CA--C 1.516 -0.335 0 O-C-N 122.437 -0.449 . . . . 1.04 109.822 -175.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -55.33 -68.27 0.21 Allowed 'General case' 0 N--CA 1.447 -0.588 0 O-C-N 124.573 1.171 . . . . 3.68 109.179 176.043 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -38.28 -49.72 1.41 Allowed 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.82 0.848 . . . . 1.4 112.153 176.871 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 63.0 t80 -61.69 -56.76 16.21 Favored 'General case' 0 CA--C 1.537 0.451 0 O-C-N 122.399 -0.188 . . . . 3.59 111.111 179.652 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 33.4 tp60 -57.55 -47.55 81.74 Favored 'General case' 0 C--O 1.218 -0.6 0 CA-C-O 117.281 -1.342 . . . . 5.03 110.727 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -44.95 -56.59 4.45 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 120.793 1.633 . . . . 3.79 110.528 176.286 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -64.57 -47.55 78.28 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 120.18 -0.608 . . . . 3.68 110.465 -177.301 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 42.8 t -56.22 -35.42 42.41 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.462 0 C-N-CA 123.058 0.543 . . . . 1.36 112.379 176.96 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 52.3 t60 -73.38 -22.08 60.35 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 125.958 1.703 . . . . 2.62 110.934 -174.395 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 23.2 t . . . . . 0 C--O 1.253 1.285 0 CA-C-O 115.066 -2.397 . . . . 2.63 112.866 -176.181 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 110' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 111' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.8 ptt? . . . . . 0 N--CA 1.48 1.051 0 N-CA-C 111.353 0.131 . . . . 9.79 111.353 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 58.8 m -156.77 -91.25 0.03 OUTLIER 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 106.787 -1.56 . . . . 2.78 106.787 173.81 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.574 HG22 HG12 ' A' ' 47' ' ' VAL . 1.2 pp -76.93 -32.1 19.49 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 CA-C-O 121.306 0.574 . . . . 1.31 111.349 -171.789 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -60.76 -29.4 69.39 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 123.731 0.813 . . . . 1.86 111.684 -175.189 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 48.0 t0 -122.18 55.84 1.12 Allowed 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 107.937 -1.134 . . . . 2.55 107.937 -176.531 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -135.72 -52.67 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.222 0 CA-C-N 115.739 -0.664 . . . . 1.97 111.498 176.345 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 179.85 -60.8 0.01 OUTLIER 'General case' 0 N--CA 1.456 -0.135 0 N-CA-C 106.368 -1.716 . . . . 1.03 106.368 -173.386 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 25.5 m -49.94 -17.5 0.39 Allowed 'General case' 0 C--O 1.219 -0.53 0 N-CA-C 115.659 1.726 . . . . 2.02 115.659 -169.36 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -49.33 -46.13 46.4 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 121.157 1.799 . . . . 0.72 112.151 168.381 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -66.17 -42.47 88.91 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 122.534 1.159 . . . . 2.08 109.845 179.0 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -69.1 -41.08 77.93 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 115.341 -0.845 . . . . 2.71 109.247 -172.454 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 29.0 pt -63.52 -39.76 86.51 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.748 0 O-C-N 120.477 -1.39 . . . . 0.78 110.78 173.37 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.57 -45.38 77.35 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 118.784 0.72 . . . . 0.69 110.19 174.289 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -55.91 -57.34 12.5 Favored 'General case' 0 CA--C 1.531 0.241 0 O-C-N 122.18 -0.325 . . . . 0.63 110.975 171.131 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -48.45 -48.22 37.73 Favored 'General case' 0 C--O 1.231 0.098 0 C-N-CA 124.101 0.96 . . . . 0.6 111.394 -177.421 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -52.23 -41.85 63.11 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 125.219 1.408 . . . . 2.81 109.741 -177.925 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 38.4 tt0 -87.61 -49.36 7.22 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 117.747 0.248 . . . . 3.6 110.835 -176.466 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 24.7 tp10 -47.49 -49.75 24.94 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 125.203 1.401 . . . . 3.7 110.301 178.214 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 79.3 m -111.02 55.81 0.65 Allowed 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 108.007 -1.108 . . . . 1.52 108.007 178.169 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 71.2 ttt180 -77.95 -55.0 5.66 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 119.73 1.15 . . . . 4.22 108.695 178.977 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -52.12 140.21 32.89 Favored Pre-proline 0 N--CA 1.446 -0.652 0 C-N-CA 124.795 1.238 . . . . 2.29 110.922 -178.163 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -57.8 151.53 55.68 Favored 'Trans proline' 0 N--CA 1.453 -0.873 0 C-N-CA 123.377 2.718 . . . . 1.21 110.441 -176.075 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 13.2 t70 69.52 -22.66 0.15 Allowed 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 127.472 2.309 . . . . 3.53 114.941 -179.801 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 2.0 m -73.88 24.37 0.08 Allowed 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.837 1.655 . . . . 1.09 113.439 -164.497 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -105.29 80.59 1.61 Allowed 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 119.374 0.988 . . . . 3.5 111.037 -163.385 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -71.0 145.04 91.04 Favored Pre-proline 0 C--O 1.234 0.26 0 C-N-CA 123.174 0.59 . . . . 2.99 110.451 -177.597 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -66.01 -65.69 0.04 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.347 0 C-N-CA 122.193 1.928 . . . . 0.75 111.151 179.768 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.73 -42.14 67.79 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 123.829 0.851 . . . . 3.07 110.822 -176.533 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 6.4 ttpt -58.74 -59.87 4.72 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 119.228 -0.415 . . . . 3.67 109.955 174.678 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 11.3 t80 -53.76 -49.71 67.6 Favored 'General case' 0 C--O 1.224 -0.241 0 CA-C-N 118.261 0.482 . . . . 2.02 110.289 -176.632 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -41.32 -56.25 2.5 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 126.764 2.026 . . . . 4.77 111.889 174.599 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 22.5 tt0 -68.58 -50.54 50.95 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 109.04 -0.726 . . . . 2.9 109.04 -179.655 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -64.75 -20.63 66.46 Favored 'General case' 0 N--CA 1.441 -0.898 0 C-N-CA 124.207 1.003 . . . . 0.7 112.265 -171.366 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 67.6 p -89.08 -9.19 52.07 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.482 1.513 . . . . 2.21 112.004 177.007 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 83.17 6.19 88.29 Favored Glycine 0 C--N 1.337 0.591 0 N-CA-C 111.558 -0.617 . . . . 0.69 111.558 172.803 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 83.0 mt -66.94 -28.96 68.72 Favored 'General case' 0 N--CA 1.443 -0.802 0 O-C-N 122.182 -0.599 . . . . 1.24 109.998 179.173 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 19.5 p -58.5 -38.11 76.96 Favored 'General case' 0 N--CA 1.464 0.243 0 C-N-CA 123.395 0.678 . . . . 2.65 111.912 165.85 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -83.66 -26.72 29.62 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 125.321 1.448 . . . . 5.99 108.991 -166.93 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 18.2 mtt -54.26 -65.03 0.64 Allowed 'General case' 0 N--CA 1.447 -0.624 0 N-CA-C 113.85 1.056 . . . . 3.52 113.85 -177.306 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 30.8 t 117.27 147.22 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 129.031 2.933 . . . . 1.85 108.352 -168.397 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -42.47 -37.79 1.72 Allowed 'General case' 0 C--N 1.34 0.155 0 C-N-CA 123.826 0.85 . . . . 0.58 111.644 169.825 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 73.8 m-20 -59.5 -63.12 1.42 Allowed 'General case' 0 CA--C 1.529 0.16 0 CA-C-O 121.683 0.754 . . . . 1.82 109.502 -178.796 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 20.8 mm100 -60.7 -40.3 91.72 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 115.755 -0.657 . . . . 3.02 110.479 -179.241 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 97.1 t -62.77 -42.54 96.63 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 CA-C-N 118.548 0.613 . . . . 0.65 109.879 -179.762 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 21.7 ttmm -59.74 -41.47 90.99 Favored 'General case' 0 CA--C 1.533 0.299 0 O-C-N 121.426 -0.796 . . . . 3.1 110.064 174.063 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -59.49 -58.89 6.61 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 117.729 0.24 . . . . 3.06 111.135 174.989 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.574 HG12 HG22 ' A' ' 3' ' ' ILE . 4.1 m -56.6 -40.78 71.09 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 O-C-N 121.631 -0.668 . . . . 0.68 110.955 -177.631 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 5.9 t80 -44.11 -44.8 7.83 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.942 0.897 . . . . 5.09 111.884 172.993 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.54 -38.49 77.9 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 118.816 0.735 . . . . 4.51 110.868 178.253 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -72.41 -34.54 67.94 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.027 0.531 . . . . 3.57 110.173 178.221 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 5.1 mm -65.61 -54.45 27.97 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.166 0 C-N-CA 122.742 0.417 . . . . 1.8 110.325 177.753 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -75.85 67.45 2.25 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 108.478 -0.934 . . . . 2.0 108.478 -178.594 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 5.4 t30 -50.64 -40.36 52.95 Favored 'General case' 0 C--N 1.333 -0.14 0 C-N-CA 126.6 1.96 . . . . 1.92 111.99 -172.821 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -78.79 -22.65 46.02 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 126.781 2.032 . . . . 2.33 112.348 178.394 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 7.5 mt-30 62.4 31.53 17.19 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 126.183 1.793 . . . . 3.06 113.473 -177.783 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 97.0 p -60.29 -35.85 76.51 Favored 'General case' 0 C--N 1.339 0.135 0 O-C-N 120.907 -1.121 . . . . 1.41 111.236 167.555 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 88.61 -4.3 85.1 Favored Glycine 0 CA--C 1.531 1.085 0 CA-C-O 119.128 -0.818 . . . . 1.32 111.787 -167.6 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 46.1 m-85 -109.77 140.94 43.09 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 124.012 0.925 . . . . 2.71 109.084 168.764 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.3 mt -118.23 76.61 1.09 Allowed 'General case' 0 N--CA 1.44 -0.934 0 C-N-CA 127.649 2.38 . . . . 2.72 106.949 177.091 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -66.06 157.35 31.26 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 126.272 1.829 . . . . 2.7 111.203 170.549 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -52.15 -44.02 64.35 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 123.524 0.73 . . . . 3.76 112.813 -176.297 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -59.59 -37.01 77.4 Favored 'General case' 0 CA--C 1.535 0.386 0 O-C-N 121.537 -0.727 . . . . 3.47 111.971 176.753 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 64.6 mt-10 -66.09 -42.87 88.74 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 118.922 0.783 . . . . 2.0 109.901 172.022 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 8.9 mp -57.01 -31.64 65.32 Favored 'General case' 0 CA--C 1.533 0.305 0 O-C-N 121.523 -0.736 . . . . 2.73 111.207 173.816 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 14.4 ttpt -73.62 0.73 11.86 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 113.046 0.758 . . . . 2.9 113.046 175.808 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 66.7 t80 -150.91 68.88 0.95 Allowed 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 107.97 -1.122 . . . . 5.2 107.97 167.991 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -117.01 -61.33 1.73 Allowed 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 128.529 2.732 . . . . 2.16 108.463 -177.806 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -65.95 -21.4 66.42 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 123.858 0.863 . . . . 3.5 111.488 -178.182 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 77.8 mm-40 -62.58 -10.3 11.68 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 119.615 1.098 . . . . 2.24 111.688 177.775 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.6 mptp? -67.98 -46.57 70.97 Favored 'General case' 0 C--N 1.342 0.247 0 O-C-N 120.51 -1.369 . . . . 2.85 110.395 165.218 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 8.3 m-30 -74.37 -42.64 58.98 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 123.503 0.721 . . . . 3.07 110.535 -169.239 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -142.73 -178.17 5.67 Favored 'General case' 0 C--O 1.226 -0.177 0 C-N-CA 124.561 1.145 . . . . 4.75 108.601 -176.704 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 10.2 m -116.92 22.7 12.42 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 123.079 0.552 . . . . 2.21 111.957 -178.111 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -168.19 45.3 0.23 Allowed Glycine 0 C--N 1.336 0.536 0 N-CA-C 111.157 -0.777 . . . . 1.03 111.157 -177.579 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.426 ' HB3' ' OE2' ' A' ' 77' ' ' GLU . . . -76.67 -150.27 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 121.292 0.568 . . . . 1.37 111.073 -179.463 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -115.74 -6.77 12.13 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 123.997 0.919 . . . . 3.13 112.801 -174.729 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.426 ' OE2' ' HB3' ' A' ' 75' ' ' ALA . 1.0 OUTLIER -49.18 -33.92 13.4 Favored 'General case' 0 C--O 1.226 -0.181 0 N-CA-C 113.348 0.869 . . . . 4.06 113.348 -175.407 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.449 ' H ' HD22 ' A' ' 78' ' ' LEU . 0.2 OUTLIER -39.26 -53.02 1.96 Allowed 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 125.307 1.443 . . . . 0.96 111.168 169.503 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 6.0 m -77.95 120.61 23.04 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-O 122.706 1.241 . . . . 1.13 110.752 -176.375 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 56.4 mp0 -66.85 -33.42 75.57 Favored 'General case' 0 N--CA 1.441 -0.899 0 CA-C-N 114.025 -1.443 . . . . 3.92 111.25 -174.967 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 5.9 t -57.75 -59.08 5.76 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 119.644 1.111 . . . . 1.84 110.891 178.761 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 15.5 mp0 -56.28 -45.59 80.1 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 123.621 0.768 . . . . 3.45 111.217 177.273 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -55.36 -48.67 73.91 Favored 'General case' 0 N--CA 1.457 -0.096 0 N-CA-C 109.298 -0.63 . . . . 0.59 109.298 176.861 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 7.8 tmtt? -67.8 -32.79 73.6 Favored 'General case' 0 N--CA 1.443 -0.803 0 C-N-CA 123.661 0.785 . . . . 5.73 110.611 -174.71 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 20.3 m -58.08 -44.83 87.8 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 124.025 0.93 . . . . 1.47 110.183 171.223 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -63.32 -54.99 28.33 Favored 'General case' 0 C--O 1.236 0.374 0 O-C-N 122.065 -0.397 . . . . 3.46 110.646 172.43 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 3.7 ttp -45.62 -45.14 13.66 Favored 'General case' 0 C--O 1.223 -0.332 0 C-N-CA 123.361 0.664 . . . . 3.5 111.486 177.458 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -55.58 -44.77 77.23 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 125.646 1.578 . . . . 0.72 112.058 -173.405 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -84.8 -43.03 14.58 Favored 'General case' 0 N--CA 1.461 0.088 0 CA-C-O 120.626 0.25 . . . . 0.8 110.822 179.405 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -58.3 -42.33 86.41 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 123.027 0.531 . . . . 0.45 111.07 -178.404 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -74.34 87.0 2.0 Allowed 'General case' 0 N--CA 1.445 -0.714 0 N-CA-C 109.131 -0.692 . . . . 0.84 109.131 178.497 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 9.3 m-80 -82.2 39.8 0.6 Allowed 'General case' 0 CA--C 1.535 0.379 0 O-C-N 121.18 -0.95 . . . . 3.22 109.99 -177.233 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 45.8 m-20 -127.98 -58.23 1.22 Allowed 'General case' 0 C--N 1.339 0.119 0 C-N-CA 124.829 1.252 . . . . 1.37 109.039 -178.146 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 100.78 44.98 2.0 Allowed Glycine 0 CA--C 1.53 1.028 0 N-CA-C 109.61 -1.396 . . . . 0.9 109.61 -162.197 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -127.54 -51.9 1.37 Allowed 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.669 1.188 . . . . 1.94 110.041 174.872 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 124.17 -36.73 2.86 Favored Glycine 0 CA--C 1.525 0.699 0 C-N-CA 124.527 1.06 . . . . 0.68 111.543 175.224 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 51.7 mttm -70.29 116.28 10.46 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 107.806 -1.183 . . . . 4.73 107.806 175.608 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 4.0 mt -89.18 166.4 1.86 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.334 0 N-CA-C 107.459 -1.312 . . . . 1.39 107.459 173.71 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -144.58 178.79 22.24 Favored Glycine 0 N--CA 1.446 -0.663 0 N-CA-C 107.177 -2.369 . . . . 0.87 107.177 172.08 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -55.01 -46.04 75.17 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 109.62 -0.511 . . . . 0.82 109.62 -176.575 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 22.9 tt0 -58.86 -63.25 1.37 Allowed 'General case' 0 N--CA 1.444 -0.766 0 O-C-N 124.24 0.962 . . . . 2.49 109.538 -176.613 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -46.21 -47.54 17.82 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 123.455 0.702 . . . . 1.27 112.205 174.971 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -61.61 -53.76 51.91 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-O 121.405 0.621 . . . . 2.91 109.858 -176.771 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -62.28 -32.64 73.38 Favored 'General case' 0 C--O 1.218 -0.594 0 C-N-CA 124.066 0.947 . . . . 2.55 110.717 178.995 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 30.5 mm-40 -64.22 -54.02 39.97 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-N 120.07 1.304 . . . . 3.48 109.931 175.646 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.05 -52.6 62.68 Favored 'General case' 0 CA--C 1.531 0.237 0 N-CA-C 108.029 -1.101 . . . . 2.99 108.029 -179.938 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 71.7 t -70.0 -34.07 58.12 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.607 0 CA-C-N 115.594 -0.73 . . . . 1.17 112.821 -174.19 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 6.7 t-80 -86.66 8.12 23.71 Favored 'General case' 0 CA--C 1.534 0.356 0 O-C-N 119.734 -1.853 . . . . 3.34 111.269 -178.037 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 32.2 t . . . . . 0 C--O 1.254 1.311 0 CA-C-O 115.518 -2.182 . . . . 2.39 111.386 178.55 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 110' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 111' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.0 mmt . . . . . 0 N--CA 1.471 0.583 0 N-CA-C 108.819 -0.808 . . . . 6.25 108.819 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.8 m -147.62 174.23 11.96 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 106.154 -1.795 . . . . 3.94 106.154 177.369 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.614 HG22 HG12 ' A' ' 47' ' ' VAL . 0.2 OUTLIER -49.89 -28.11 4.02 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.404 0 C-N-CA 125.153 1.381 . . . . 1.51 112.899 177.404 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -44.06 -50.27 8.49 Favored 'General case' 0 N--CA 1.442 -0.84 0 C-N-CA 125.697 1.599 . . . . 2.34 110.106 170.982 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -86.02 46.41 1.32 Allowed 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.462 1.105 . . . . 3.38 110.418 -173.273 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 25.3 t -142.01 -58.96 0.21 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.1 0 C-N-CA 123.905 0.882 . . . . 1.52 108.936 177.248 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 9.8 tp -171.41 -51.82 0.02 OUTLIER 'General case' 0 C--O 1.232 0.159 0 N-CA-C 106.943 -1.502 . . . . 1.25 106.943 -174.201 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 18.7 m -48.67 -21.14 0.55 Allowed 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 116.052 1.871 . . . . 1.02 116.052 -166.527 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -50.47 -49.09 56.15 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 120.286 1.403 . . . . 0.69 111.46 171.461 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -65.45 -42.94 91.81 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-O 122.086 0.946 . . . . 1.84 109.596 -177.694 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 27.7 m-20 -62.06 -51.1 69.34 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 115.187 -0.915 . . . . 2.53 109.046 -176.889 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 16.9 pt -63.27 -39.58 85.79 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.916 0 O-C-N 121.683 -0.636 . . . . 0.81 111.601 178.661 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -54.66 -44.94 73.73 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 118.356 0.525 . . . . 0.56 110.774 173.956 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.41 -56.61 16.57 Favored 'General case' 0 CA--C 1.535 0.378 0 O-C-N 122.014 -0.429 . . . . 0.61 110.855 173.485 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.534 ' HB1' ' CE2' ' A' ' 30' ' ' PHE . . . -47.59 -48.35 28.18 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 125.89 1.676 . . . . 0.56 111.369 -177.052 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 14.3 tp -50.21 -42.29 51.31 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 126.166 1.786 . . . . 2.39 110.532 177.868 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 4.9 tm0? -86.44 -45.52 11.07 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 123.884 0.874 . . . . 3.59 109.163 -171.176 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -61.79 -44.44 96.87 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 120.737 0.303 . . . . 3.45 110.421 -178.804 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 69.5 m -104.83 67.16 0.79 Allowed 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 107.153 -1.425 . . . . 1.48 107.153 175.979 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 19.2 ttt-85 -102.89 -2.8 27.19 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 119.473 1.033 . . . . 5.27 113.27 178.545 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -103.11 155.18 36.97 Favored Pre-proline 0 CA--C 1.533 0.322 0 C-N-CA 124.277 1.031 . . . . 2.28 110.626 -173.577 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -66.07 126.88 16.56 Favored 'Trans proline' 0 N--CA 1.453 -0.876 0 C-N-CA 122.423 2.082 . . . . 1.41 111.121 -176.859 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 42.6 m-20 63.19 53.28 2.29 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 127.907 2.483 . . . . 2.51 110.107 175.963 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.5 m -118.73 -18.44 8.96 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 124.326 1.05 . . . . 0.76 112.828 179.738 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 19.4 t80 -60.74 106.05 0.52 Allowed 'General case' 0 N--CA 1.446 -0.655 0 C-N-CA 124.326 1.05 . . . . 3.16 109.856 -174.686 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -86.99 142.78 34.22 Favored Pre-proline 0 CA--C 1.534 0.354 0 N-CA-C 108.572 -0.899 . . . . 2.69 108.572 165.637 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -65.34 -67.97 0.04 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.107 0 C-N-CA 123.169 2.579 . . . . 0.58 110.476 -179.337 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 40.5 mt-30 -55.39 -41.86 73.22 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.302 0.641 . . . . 2.27 110.73 -176.926 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 12.4 tptp -51.87 -69.71 0.11 Allowed 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 109.629 -0.508 . . . . 3.3 109.629 172.716 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.534 ' CE2' ' HB1' ' A' ' 15' ' ' ALA . 40.2 t80 -55.72 -37.09 67.95 Favored 'General case' 0 C--O 1.221 -0.44 0 C-N-CA 123.329 0.652 . . . . 2.89 111.043 -173.967 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.49 ' CE1' ' HA ' ' A' ' 107' ' ' VAL . 0.7 OUTLIER -55.82 -59.14 5.3 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 126.138 1.775 . . . . 4.67 110.297 177.459 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 42.1 mt-30 -61.1 -44.24 97.65 Favored 'General case' 0 CA--C 1.517 -0.312 0 N-CA-C 108.697 -0.853 . . . . 3.03 108.697 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -65.21 -30.56 71.46 Favored 'General case' 0 N--CA 1.434 -1.274 0 N-CA-C 113.094 0.776 . . . . 0.76 113.094 -175.228 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 34.9 t -74.54 -0.73 18.61 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 123.712 0.805 . . . . 1.66 109.773 174.559 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 75.32 5.45 77.19 Favored Glycine 0 C--N 1.339 0.743 0 N-CA-C 111.039 -0.824 . . . . 0.67 111.039 178.381 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.484 HD21 HG21 ' A' ' 47' ' ' VAL . 5.0 mt -70.45 -25.12 63.04 Favored 'General case' 0 N--CA 1.447 -0.618 0 O-C-N 121.387 -1.067 . . . . 2.03 110.822 -170.7 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.442 ' HB3' ' CZ ' ' A' ' 31' ' ' PHE . 25.4 p -65.72 -27.96 68.71 Favored 'General case' 0 CA--C 1.529 0.139 0 C-N-CA 123.644 0.778 . . . . 2.35 110.775 171.413 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 12.5 tptt -86.86 -33.64 19.73 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 108.428 -0.952 . . . . 3.84 108.428 -178.582 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 30.0 mtt -58.54 131.39 50.62 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 118.789 -1.164 . . . . 2.86 111.044 172.63 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 82.2 p -70.6 158.15 36.68 Favored 'General case' 0 CA--C 1.533 0.298 0 O-C-N 121.675 -0.64 . . . . 2.6 110.11 178.29 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -43.59 -36.84 2.26 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.78 1.232 . . . . 0.78 113.082 177.337 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 9.3 m-80 -56.56 -61.8 2.17 Favored 'General case' 0 CA--C 1.527 0.091 0 C-N-CA 124.128 0.971 . . . . 1.58 109.21 175.045 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 23.5 mm100 -59.54 -45.61 91.29 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 115.804 -0.634 . . . . 2.88 110.076 -179.506 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.519 HG13 HG11 ' A' ' 107' ' ' VAL . 73.1 t -57.13 -46.15 84.51 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 CA-C-N 118.975 0.807 . . . . 0.7 110.0 -177.452 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 3.2 ttpm? -72.59 -29.64 63.69 Favored 'General case' 0 N--CA 1.448 -0.554 0 O-C-N 121.798 -0.564 . . . . 3.84 111.519 179.896 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -62.74 -58.51 7.22 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 118.939 0.791 . . . . 2.84 110.67 170.365 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.614 HG12 HG22 ' A' ' 3' ' ' ILE . 12.0 m -53.02 -44.67 51.13 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.174 0 O-C-N 121.8 -0.563 . . . . 0.56 110.224 -179.209 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.46 ' CZ ' ' HB2' ' A' ' 100' ' ' ALA . 13.5 t80 -42.3 -50.83 4.97 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 123.262 0.625 . . . . 4.67 111.827 171.111 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 65.4 mtp85 -65.8 -34.39 78.06 Favored 'General case' 0 CA--C 1.529 0.173 0 C-N-CA 122.895 0.478 . . . . 3.19 110.926 179.183 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -61.89 -40.55 95.8 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 109.802 -0.444 . . . . 3.75 109.802 175.445 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.504 HG21 ' CD1' ' A' ' 67' ' ' PHE . 25.5 mm -84.06 -47.49 17.65 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 CA-C-O 118.088 -0.958 . . . . 1.45 113.233 -173.648 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -72.46 71.47 0.94 Allowed 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 106.536 -1.653 . . . . 1.94 106.536 170.876 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -57.2 -36.74 71.21 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 126.842 2.057 . . . . 2.2 111.521 -173.476 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 12.0 p-10 -58.18 -27.24 63.67 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 126.748 2.019 . . . . 3.03 112.23 170.224 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 22.7 mt-30 49.95 57.89 6.06 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 126.047 1.739 . . . . 3.26 110.145 -172.795 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 78.3 p -80.1 -42.8 22.89 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 114.137 -1.392 . . . . 1.38 109.769 171.67 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 117.38 -26.98 7.89 Favored Glycine 0 CA--C 1.53 1.005 0 CA-C-O 119.343 -0.698 . . . . 1.55 111.718 -169.622 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 37.3 m-85 -118.96 138.76 52.57 Favored 'General case' 0 C--N 1.34 0.171 0 C-N-CA 123.898 0.879 . . . . 2.94 110.344 -178.24 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -84.7 76.07 10.25 Favored 'General case' 0 N--CA 1.456 -0.146 0 N-CA-C 107.036 -1.468 . . . . 1.75 107.036 167.725 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -54.83 155.77 4.13 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.718 1.207 . . . . 1.53 109.727 171.461 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -44.48 -54.35 6.06 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 123.647 0.779 . . . . 3.3 111.874 -177.73 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -56.09 -35.46 67.05 Favored 'General case' 0 CA--C 1.534 0.327 0 N-CA-C 114.132 1.16 . . . . 3.63 114.132 176.802 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -65.39 -37.47 87.07 Favored 'General case' 0 N--CA 1.462 0.127 0 CA-C-N 120.543 1.519 . . . . 3.25 109.622 174.608 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 60.1 mt -73.2 14.27 0.33 Allowed 'General case' 0 C--O 1.222 -0.393 0 CA-C-O 118.523 -0.751 . . . . 2.18 112.408 170.193 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 27.2 ttpt -97.31 0.04 47.35 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 120.084 1.311 . . . . 2.02 109.716 162.163 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 92.1 m-85 -149.11 32.77 0.74 Allowed 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.567 0.747 . . . . 4.58 111.795 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.504 ' CD1' HG21 ' A' ' 51' ' ' ILE . 46.0 t80 -64.77 -72.22 0.16 Allowed 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 119.625 1.102 . . . . 2.35 109.82 -179.869 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 15.7 mt -65.98 -16.92 64.31 Favored 'General case' 0 CA--C 1.534 0.33 0 O-C-N 120.494 -1.379 . . . . 2.41 113.205 177.48 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 74.1 mm-40 -57.25 -33.18 67.31 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 121.032 -1.042 . . . . 1.86 111.347 176.395 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 1.6 mptp? -83.47 -13.56 54.43 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 118.792 0.723 . . . . 3.73 112.227 174.957 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 24.5 m-85 -75.29 -56.48 4.68 Favored 'General case' 0 C--N 1.338 0.104 0 N-CA-C 108.702 -0.851 . . . . 3.22 108.702 171.309 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 28.2 tp10 -118.06 -63.76 1.38 Allowed 'General case' 0 CA--C 1.531 0.248 0 O-C-N 124.148 0.905 . . . . 3.82 110.416 -169.824 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 8.7 t 104.3 117.68 0.01 OUTLIER 'General case' 0 C--N 1.341 0.236 0 C-N-CA 127.68 2.392 . . . . 2.93 107.546 -170.014 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 90.36 24.9 27.54 Favored Glycine 0 CA--C 1.529 0.958 0 C-N-CA 124.59 1.09 . . . . 1.51 111.943 -176.853 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -87.19 173.42 9.24 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.742 0.817 . . . . 1.88 110.744 176.673 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.76 -13.84 1.96 Allowed 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 126.913 2.085 . . . . 3.75 115.765 -167.048 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 73.8 mm-40 -37.71 -41.66 0.51 Allowed 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 126.494 1.917 . . . . 3.61 114.424 -173.251 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.605 ' H ' HD22 ' A' ' 78' ' ' LEU . 1.1 mm? -48.86 -41.65 33.92 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 123.584 0.753 . . . . 0.95 112.522 177.368 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 31.5 m -71.59 110.09 5.94 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 121.836 0.827 . . . . 0.76 110.585 178.602 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 24.6 mp0 -59.55 -42.99 93.64 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 114.786 -1.097 . . . . 3.6 110.09 -178.84 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 2.6 m -52.32 -55.18 23.2 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.836 0.854 . . . . 1.58 112.278 177.168 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -67.39 -41.65 84.63 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 108.505 -0.924 . . . . 2.78 108.505 -173.089 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -53.01 -52.16 59.34 Favored 'General case' 0 CA--C 1.517 -0.307 0 C-N-CA 123.496 0.718 . . . . 0.58 109.151 171.718 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 12.5 tttt -73.56 -23.14 59.93 Favored 'General case' 0 N--CA 1.438 -1.039 0 CA-C-N 116.05 -0.523 . . . . 4.59 110.465 -171.209 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 21.9 m -63.49 -43.64 96.68 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.599 0.76 . . . . 1.62 110.22 167.232 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.6 tt -59.33 -61.77 2.38 Favored 'General case' 0 CA--C 1.533 0.3 0 N-CA-C 108.6 -0.889 . . . . 2.32 108.6 169.957 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 35.3 ttp -47.18 -49.27 22.99 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 112.412 0.523 . . . . 2.49 112.412 -177.616 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -52.42 -40.7 62.49 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 125.851 1.66 . . . . 0.49 112.274 -173.604 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -90.83 -36.98 13.9 Favored 'General case' 0 C--O 1.226 -0.155 0 C-N-CA 122.355 0.262 . . . . 0.5 111.351 179.52 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -57.7 -44.44 85.88 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 122.319 0.248 . . . . 0.37 111.044 177.897 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 8.8 t0 -66.45 120.6 13.64 Favored 'General case' 0 N--CA 1.442 -0.845 0 N-CA-C 108.292 -1.003 . . . . 1.75 108.292 174.461 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 49.1 p30 -104.35 11.13 35.05 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 112.63 0.604 . . . . 3.31 112.63 176.022 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -95.01 -52.89 4.03 Favored 'General case' 0 C--N 1.342 0.279 0 CA-C-N 118.731 0.696 . . . . 1.39 110.414 173.626 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 97.38 47.94 2.1 Favored Glycine 0 CA--C 1.53 1.025 0 N-CA-C 108.676 -1.77 . . . . 0.89 108.676 -156.383 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 36.2 p30 -128.29 -64.78 0.93 Allowed 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 126.355 1.862 . . . . 1.94 110.055 175.036 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 140.13 -49.39 0.8 Allowed Glycine 0 CA--C 1.522 0.516 0 C-N-CA 125.31 1.433 . . . . 0.86 109.52 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 23.2 pttm -53.22 128.39 27.84 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 109.473 -0.565 . . . . 5.27 109.473 174.455 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 5.6 mt -118.6 107.94 22.94 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.325 0 C-N-CA 125.518 1.527 . . . . 0.72 108.233 -175.912 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -66.97 163.8 44.3 Favored Glycine 0 CA--C 1.532 1.102 0 N-CA-C 110.993 -0.843 . . . . 0.59 110.993 172.477 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' ALA . . . . . 0.46 ' HB2' ' CZ ' ' A' ' 48' ' ' PHE . . . -51.93 -38.78 57.65 Favored 'General case' 0 C--N 1.339 0.13 0 O-C-N 122.104 -0.645 . . . . 0.72 109.631 168.215 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -59.59 -55.63 32.03 Favored 'General case' 0 N--CA 1.444 -0.758 0 CA-C-N 115.142 -0.935 . . . . 2.45 109.91 178.788 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -52.66 -46.37 67.16 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.616 0.766 . . . . 2.23 110.679 175.357 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 85.4 t80 -56.51 -57.64 11.46 Favored 'General case' 0 CA--C 1.536 0.406 0 O-C-N 121.816 -0.553 . . . . 4.17 111.349 177.548 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 30.8 tt0 -55.97 -37.81 69.56 Favored 'General case' 0 CA--C 1.533 0.299 0 O-C-N 121.748 -0.595 . . . . 2.18 110.294 177.183 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -56.8 -60.8 3.04 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 123.42 0.688 . . . . 4.58 109.872 178.531 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 12.0 ptm -57.47 -43.41 84.02 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 119.822 -0.751 . . . . 5.7 109.65 178.543 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 107' ' ' VAL . . . . . 0.519 HG11 HG13 ' A' ' 44' ' ' VAL . 57.1 t -69.65 -16.88 20.88 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 N-CA-C 112.126 0.417 . . . . 1.39 112.126 -175.297 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -76.01 -23.52 55.22 Favored 'General case' 0 CA--C 1.538 0.483 0 O-C-N 120.123 -1.61 . . . . 2.6 110.903 175.981 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 15.5 t . . . . . 0 C--O 1.252 1.216 0 CA-C-O 116.36 -1.781 . . . . 2.46 114.017 -164.456 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 110' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 111' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.8 mpt? . . . . . 0 N--CA 1.474 0.743 0 N-CA-C 107.62 -1.252 . . . . 8.41 107.62 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 30.7 t -148.79 -179.3 6.89 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 104.746 -2.316 . . . . 3.19 104.746 159.485 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 2.3 pp -54.5 -31.51 23.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 C-N-CA 124.987 1.315 . . . . 1.2 111.392 -174.441 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 2.3 t -51.88 -44.03 63.56 Favored 'General case' 0 N--CA 1.436 -1.142 0 C-N-CA 125.401 1.48 . . . . 1.73 111.14 174.319 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 23.3 t0 -98.18 42.25 1.1 Allowed 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 126.538 1.935 . . . . 3.41 109.423 -173.132 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 97.4 t -136.73 -59.95 0.44 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.101 0 C-N-CA 124.997 1.319 . . . . 1.72 108.611 177.646 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -170.87 -47.24 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.116 0 N-CA-C 107.395 -1.335 . . . . 1.36 107.395 -177.432 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 20.3 m -49.08 -22.84 1.01 Allowed 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 116.639 2.088 . . . . 1.09 116.639 -166.92 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -49.35 -42.16 40.99 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 119.823 1.192 . . . . 0.88 112.291 169.107 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -68.42 -40.05 81.35 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 121.829 0.823 . . . . 2.07 110.41 176.593 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -61.28 -47.19 87.15 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 115.797 -0.638 . . . . 4.96 109.834 -177.788 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 34.6 pt -65.57 -38.22 81.87 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.11 0 CA-C-O 119.163 -0.446 . . . . 1.11 109.797 -177.711 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.93 -46.46 78.46 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 118.341 0.519 . . . . 0.61 111.274 173.378 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.95 -61.04 2.93 Favored 'General case' 0 C--O 1.234 0.262 0 O-C-N 121.961 -0.462 . . . . 0.65 111.012 174.273 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -51.27 -44.79 61.89 Favored 'General case' 0 CA--C 1.528 0.099 0 C-N-CA 123.56 0.744 . . . . 0.52 111.167 -176.892 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.438 HD23 ' HG2' ' A' ' 17' ' ' GLN . 0.8 OUTLIER -48.72 -44.41 38.23 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 125.54 1.536 . . . . 3.3 111.903 177.907 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.438 ' HG2' HD23 ' A' ' 16' ' ' LEU . 2.9 mm100 -86.67 -49.39 7.53 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 119.222 0.919 . . . . 3.3 110.946 178.616 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 55.3 tp10 -50.63 -47.45 58.37 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.978 0.911 . . . . 3.9 110.803 -177.682 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 74.6 m -112.52 58.86 0.64 Allowed 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 124.757 1.223 . . . . 1.62 108.031 177.262 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 56.8 ttt180 -82.82 -54.17 5.31 Favored 'General case' 0 CA--C 1.52 -0.176 0 O-C-N 121.522 -0.736 . . . . 4.04 109.701 178.257 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 36.6 m-20 -58.73 143.41 82.37 Favored Pre-proline 0 N--CA 1.449 -0.476 0 CA-C-N 115.171 -0.922 . . . . 2.14 110.285 -173.5 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -64.57 134.89 43.11 Favored 'Trans proline' 0 N--CA 1.449 -1.137 0 C-N-CA 122.406 2.07 . . . . 1.2 110.402 -173.817 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 69.5 m-20 63.15 36.87 11.8 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 127.643 2.377 . . . . 2.67 111.699 178.457 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 6.1 m -102.64 0.35 33.08 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 123.907 0.883 . . . . 0.65 110.88 173.51 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -70.89 138.12 49.89 Favored 'General case' 0 N--CA 1.449 -0.487 0 O-C-N 121.35 -0.844 . . . . 2.29 110.582 -174.482 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -131.84 148.49 70.11 Favored Pre-proline 0 N--CA 1.452 -0.328 0 C-N-CA 123.965 0.906 . . . . 2.51 109.395 170.731 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_endo -65.67 -71.64 0.02 OUTLIER 'Trans proline' 0 N--CA 1.451 -0.973 0 C-N-CA 123.741 2.961 . . . . 0.62 111.007 -178.856 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 53.7 mt-30 -51.8 -46.22 64.15 Favored 'General case' 0 C--O 1.233 0.205 0 C-N-CA 123.879 0.872 . . . . 2.17 110.982 -178.725 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 16.9 tptt -47.75 -60.33 2.65 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 123.418 0.687 . . . . 2.74 110.007 171.689 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.475 ' CE1' HD21 ' A' ' 68' ' ' LEU . 82.3 t80 -56.34 -47.06 79.57 Favored 'General case' 0 C--O 1.222 -0.362 0 C-N-CA 122.805 0.442 . . . . 2.23 110.846 -179.425 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 9.0 m-30 -54.34 -40.54 68.13 Favored 'General case' 0 CA--C 1.531 0.233 0 O-C-N 121.166 -0.959 . . . . 4.86 111.411 -178.956 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 33.4 mt-30 -73.1 -54.75 7.73 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 110.331 -0.248 . . . . 3.16 110.331 176.263 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -57.85 -39.07 76.87 Favored 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 123.15 0.58 . . . . 0.71 110.332 -172.213 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 10.9 m -86.1 6.72 27.81 Favored 'General case' 0 N--CA 1.444 -0.744 0 C-N-CA 124.815 1.246 . . . . 2.14 111.558 -177.748 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 75.23 -16.53 3.58 Favored Glycine 0 CA--C 1.531 1.063 0 O-C-N 119.366 -2.084 . . . . 0.67 113.093 169.186 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 12.7 mt -56.15 -29.55 60.92 Favored 'General case' 0 N--CA 1.441 -0.89 0 C-N-CA 126.425 1.89 . . . . 1.64 112.995 178.615 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 8.1 t -70.34 -32.96 70.91 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 123.521 0.728 . . . . 1.79 111.41 170.523 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 2.4 tptt -74.79 -36.7 62.5 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 108.397 -0.964 . . . . 5.11 108.397 178.76 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 41.2 mtt -66.5 119.86 12.39 Favored 'General case' 0 N--CA 1.443 -0.788 0 N-CA-C 109.223 -0.658 . . . . 2.31 109.223 173.512 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 16.4 t -63.46 161.97 13.44 Favored 'General case' 0 N--CA 1.453 -0.293 0 O-C-N 121.804 -0.56 . . . . 3.09 109.651 174.454 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -37.7 -44.14 0.69 Allowed 'General case' 0 CA--C 1.527 0.091 0 C-N-CA 126.095 1.758 . . . . 0.84 112.055 178.427 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 39.5 m-20 -39.92 -56.87 1.72 Allowed 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 125.937 1.695 . . . . 2.12 111.565 174.761 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 9.1 mm100 -75.98 -36.68 59.15 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 122.991 0.516 . . . . 2.52 110.177 -176.589 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 4.2 t -61.17 -35.31 64.91 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.584 0 N-CA-C 108.721 -0.844 . . . . 0.96 108.721 179.029 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 80.4 tttt -56.56 -50.03 73.11 Favored 'General case' 0 CA--C 1.531 0.235 0 O-C-N 121.157 -0.964 . . . . 3.4 111.589 172.843 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -55.08 -52.51 62.98 Favored 'General case' 0 C--O 1.233 0.206 0 N-CA-C 110.072 -0.344 . . . . 2.62 110.072 176.92 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 2.4 m -59.53 -45.3 94.05 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 C-N-CA 119.151 -1.019 . . . . 0.77 110.803 179.688 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 10.9 m-85 -47.43 -48.96 26.22 Favored 'General case' 0 C--N 1.34 0.165 0 C-N-CA 124.072 0.949 . . . . 4.57 111.912 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 4.4 mtt180 -61.01 -28.41 69.02 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 120.199 -0.601 . . . . 3.3 111.877 179.638 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 7.6 t80 -72.18 -40.81 67.64 Favored 'General case' 0 N--CA 1.452 -0.343 0 O-C-N 121.955 -0.465 . . . . 4.18 110.067 170.568 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 5.0 mm -66.82 -51.55 54.35 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-O 118.356 -0.831 . . . . 1.62 111.654 -176.047 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -66.4 76.36 0.1 Allowed 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 107.361 -1.348 . . . . 2.26 107.361 171.312 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -66.95 -30.25 70.33 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 123.665 0.786 . . . . 2.15 109.621 178.819 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 38.5 p-10 -65.63 -44.01 87.78 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 123.545 0.738 . . . . 2.5 110.689 169.69 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . 0.297 0.0 OUTLIER 101.54 10.76 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 130.031 3.332 . . . . 4.88 112.809 173.74 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 7.7 p -71.7 -39.77 69.97 Favored 'General case' 0 CA--C 1.528 0.133 0 N-CA-C 112.488 0.551 . . . . 1.71 112.488 -170.68 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 113.37 -26.39 10.34 Favored Glycine 0 CA--C 1.527 0.81 0 N-CA-C 111.61 -0.596 . . . . 1.81 111.61 -179.444 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 86.5 m-85 -79.58 134.81 36.48 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 107.734 -1.209 . . . . 3.15 107.734 166.927 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -92.62 71.94 5.01 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 105.526 -2.027 . . . . 2.67 105.526 172.367 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.42 157.23 11.52 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-N 113.981 -1.463 . . . . 1.61 108.979 179.544 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -45.0 -51.18 10.14 Favored 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 123.642 0.777 . . . . 4.24 111.578 -172.976 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 20.2 mp0 -59.06 -30.6 68.18 Favored 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 114.427 1.269 . . . . 4.32 114.427 178.708 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -59.35 -41.66 89.72 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 121.354 1.888 . . . . 2.66 109.013 169.865 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -74.45 12.12 0.84 Allowed 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 123.632 0.773 . . . . 2.34 112.44 174.905 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 32.2 ttpt -104.08 2.7 32.37 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 125.298 1.439 . . . . 2.64 109.644 166.344 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 34.4 p90 -151.17 27.78 0.68 Allowed 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 119.126 0.875 . . . . 5.6 113.342 171.881 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -56.54 -64.24 0.93 Allowed 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 119.209 0.913 . . . . 2.52 109.962 -179.585 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.475 HD21 ' CE1' ' A' ' 30' ' ' PHE . 7.1 mp -81.3 -17.02 50.74 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 112.873 0.694 . . . . 2.37 112.873 -179.657 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 68.3 mm-40 -54.62 -33.17 60.08 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 119.653 1.115 . . . . 1.61 110.31 174.856 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.2 mtpt -62.85 -23.43 67.3 Favored 'General case' 0 CA--C 1.535 0.383 0 O-C-N 121.962 -0.461 . . . . 3.39 112.239 176.317 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 2.1 m-30 -98.31 -49.31 4.74 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 125.144 1.378 . . . . 3.16 110.162 -174.983 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -137.47 135.71 37.07 Favored 'General case' 0 C--N 1.341 0.202 0 C-N-CA 125.12 1.368 . . . . 4.23 108.769 -169.76 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 2.1 p -61.86 -32.95 73.34 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 124.805 1.242 . . . . 3.41 113.978 -165.849 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -119.88 27.15 6.9 Favored Glycine 0 CA--C 1.524 0.599 0 C-N-CA 125.114 1.34 . . . . 1.55 110.761 -173.392 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.37 153.53 38.23 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 117.408 0.604 . . . . 2.0 110.77 179.182 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.48 17.14 0.07 Allowed 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 115.823 1.786 . . . . 3.29 115.823 -161.349 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 68.5 mm-40 -55.47 -35.38 65.44 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-O 122.271 1.034 . . . . 3.71 111.623 -176.603 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.414 ' H ' HD22 ' A' ' 78' ' ' LEU . 0.0 OUTLIER -56.75 -37.56 71.21 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 115.11 -0.95 . . . . 0.76 111.507 177.242 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 54.2 m -74.57 107.63 6.82 Favored 'General case' 0 C--N 1.344 0.338 0 CA-C-N 118.994 0.815 . . . . 0.76 109.295 -178.804 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 15.9 pt-20 -56.68 -41.48 77.37 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 114.513 -1.222 . . . . 2.68 110.834 -178.221 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 66.1 m -59.39 -54.36 47.55 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 122.976 0.51 . . . . 1.39 112.096 177.404 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 -59.48 -45.51 91.46 Favored 'General case' 0 C--O 1.232 0.171 0 O-C-N 121.423 -0.798 . . . . 3.03 110.631 178.509 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -53.94 -47.86 70.84 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 121.696 0.76 . . . . 0.55 109.71 174.529 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 14.8 mmtp -65.4 -29.71 70.45 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 123.892 0.877 . . . . 4.85 111.357 -177.078 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.2 t -56.47 -46.61 80.32 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 119.285 0.948 . . . . 1.98 110.314 170.449 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 28.3 mt -64.2 -57.41 9.59 Favored 'General case' 0 C--O 1.235 0.319 0 O-C-N 121.761 -0.587 . . . . 2.58 109.914 174.798 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 2.0 tpt -40.82 -52.89 2.97 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 123.675 0.79 . . . . 2.98 111.39 176.811 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -53.6 -48.4 69.3 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 126.792 2.037 . . . . 0.51 111.875 -170.634 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -80.25 -47.44 14.59 Favored 'General case' 0 N--CA 1.457 -0.108 0 C-N-CA 121.186 -0.206 . . . . 0.61 110.752 178.206 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -54.66 -38.38 66.87 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 120.664 0.269 . . . . 0.58 110.996 -176.1 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -78.27 103.79 8.44 Favored 'General case' 0 N--CA 1.442 -0.842 0 CA-C-N 116.436 -0.347 . . . . 1.09 110.197 178.191 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 9.4 m-80 -95.71 27.66 3.38 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 123.558 0.743 . . . . 2.87 110.339 -177.664 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 45.2 m-20 -119.49 -51.07 2.3 Favored 'General case' 0 N--CA 1.46 0.041 0 C-N-CA 124.558 1.143 . . . . 1.44 109.332 178.095 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 91.84 42.28 4.78 Favored Glycine 0 CA--C 1.527 0.829 0 N-CA-C 108.771 -1.732 . . . . 0.94 108.771 -158.343 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 33.5 p30 -121.36 -63.21 1.35 Allowed 'General case' 0 C--N 1.342 0.253 0 C-N-CA 124.035 0.934 . . . . 2.26 110.586 172.88 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 126.79 -31.91 3.8 Favored Glycine 0 CA--C 1.521 0.46 0 N-CA-C 111.261 -0.735 . . . . 1.0 111.261 177.745 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 25.7 pttm -58.29 101.11 0.07 Allowed 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 107.92 -1.141 . . . . 5.12 107.92 162.954 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' ILE . . . . . 0.413 HG21 ' CD2' ' A' ' 103' ' ' PHE . 26.7 mt -94.57 147.99 5.3 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 N-CA-C 107.106 -1.442 . . . . 1.28 107.106 176.102 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -117.01 170.33 13.38 Favored Glycine 0 CA--C 1.523 0.572 0 N-CA-C 109.683 -1.367 . . . . 0.54 109.683 175.927 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -59.59 -48.93 79.73 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 108.691 -0.855 . . . . 0.69 108.691 178.783 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -54.22 -54.73 36.01 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 111.86 0.319 . . . . 3.02 111.86 177.201 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -47.65 -53.99 13.27 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.525 1.13 . . . . 1.64 110.439 175.931 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' PHE . . . . . 0.413 ' CD2' HG21 ' A' ' 98' ' ' ILE . 0.1 OUTLIER -70.67 -38.83 73.82 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 119.37 -0.932 . . . . 3.86 111.305 -177.548 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -57.53 -49.79 75.2 Favored 'General case' 0 C--O 1.221 -0.404 0 C-N-CA 124.133 0.973 . . . . 2.79 108.652 -179.154 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -50.53 -54.19 24.36 Favored 'General case' 0 CA--C 1.528 0.129 0 CA-C-N 118.819 0.736 . . . . 3.89 110.367 176.887 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.12 -56.89 16.12 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 116.529 -0.305 . . . . 3.66 111.013 -178.018 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 42.5 t -50.23 -45.71 24.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 C-N-CA 124.299 1.04 . . . . 1.53 111.359 177.878 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 10.9 t-160 -72.44 -11.12 60.55 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 125.053 1.341 . . . . 3.05 111.016 -172.295 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 30.0 t . . . . . 0 C--O 1.252 1.188 0 C-N-CA 122.986 0.514 . . . . 3.33 112.035 178.394 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 110' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 111' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 18.3 mmt . . . . . 0 N--CA 1.471 0.576 0 N-CA-C 108.414 -0.958 . . . . 9.36 108.414 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 32.5 m -133.12 -178.11 4.82 Favored 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 106.329 -1.73 . . . . 4.0 106.329 172.804 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 2.6 pp -45.27 -42.97 3.13 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.384 0 C-N-CA 124.536 1.134 . . . . 2.45 111.947 -179.794 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.434 HG22 ' H ' ' A' ' 4' ' ' THR . 0.6 OUTLIER -81.22 57.69 3.28 Favored 'General case' 0 N--CA 1.439 -1.015 0 C-N-CA 126.322 1.849 . . . . 2.29 107.099 178.227 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 174.42 -48.92 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 126.324 1.85 . . . . 3.82 108.952 176.161 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -46.13 -41.89 4.37 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.307 0 C-N-CA 125.766 1.626 . . . . 1.89 112.224 -170.642 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -175.71 -60.11 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 105.867 -1.901 . . . . 1.64 105.867 -171.556 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 2.6 m -50.83 -29.18 11.07 Favored 'General case' 0 N--CA 1.445 -0.694 0 C-N-CA 124.736 1.214 . . . . 1.1 113.617 -170.12 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -49.73 -46.44 50.35 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 119.547 1.067 . . . . 0.86 113.14 171.415 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 42.5 t0 -66.18 -43.39 87.0 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-O 122.707 1.241 . . . . 1.87 108.911 179.921 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -64.38 -50.21 68.57 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 115.399 -0.819 . . . . 2.28 109.581 -175.486 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 9.5 pt -60.18 -41.17 85.79 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.677 0 O-C-N 121.249 -0.907 . . . . 1.21 111.341 176.477 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -54.74 -42.27 71.4 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 118.999 0.818 . . . . 1.1 111.014 174.181 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.84 -54.08 44.41 Favored 'General case' 0 CA--C 1.533 0.299 0 O-C-N 121.61 -0.681 . . . . 1.09 111.064 171.373 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.403 ' HB2' HG23 ' A' ' 33' ' ' THR . . . -51.9 -44.64 63.86 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 124.89 1.276 . . . . 1.15 111.379 -174.855 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.9 tp -48.12 -48.37 34.04 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 125.483 1.513 . . . . 2.59 109.958 174.557 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 23.7 mt-30 -82.46 -28.01 31.51 Favored 'General case' 0 CA--C 1.528 0.125 0 N-CA-C 113.381 0.882 . . . . 3.17 113.381 -178.921 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . 0.275 0.2 OUTLIER -71.82 -37.65 70.29 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 119.942 1.246 . . . . 3.69 109.386 176.865 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 44.4 m -92.36 38.22 1.01 Allowed 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.184 1.394 . . . . 2.5 112.407 174.153 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.93 -37.39 67.2 Favored 'General case' 0 N--CA 1.47 0.534 0 O-C-N 120.444 -1.41 . . . . 8.26 109.78 172.41 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -83.92 142.05 41.48 Favored Pre-proline 0 N--CA 1.447 -0.592 0 C-N-CA 124.092 0.957 . . . . 2.03 108.889 -176.27 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -69.46 150.73 70.41 Favored 'Trans proline' 0 N--CA 1.46 -0.498 0 C-N-CA 123.489 2.792 . . . . 1.39 112.008 -176.747 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 55.68 19.35 3.31 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.923 1.689 . . . . 2.29 112.945 178.57 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 55.5 m -91.82 -25.67 18.88 Favored 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 124.639 1.176 . . . . 0.95 111.087 -173.913 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 3.8 t80 -49.29 122.81 6.49 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 123.769 0.828 . . . . 3.46 109.731 178.002 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -114.79 152.52 46.46 Favored Pre-proline 0 CA--C 1.536 0.422 0 C-N-CA 124.354 1.062 . . . . 2.73 108.984 168.692 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_endo -66.42 -70.61 0.02 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.819 0 C-N-CA 123.434 2.756 . . . . 1.03 111.545 -175.948 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 -54.07 -45.72 71.81 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 123.574 0.75 . . . . 2.57 110.492 -179.196 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 22.3 tptt -45.77 -64.46 0.73 Allowed 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 123.666 0.786 . . . . 2.9 109.15 172.455 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.432 ' CZ ' HD11 ' A' ' 68' ' ' LEU . 75.4 t80 -59.32 -44.32 92.61 Favored 'General case' 0 N--CA 1.447 -0.616 0 C-N-CA 122.485 0.314 . . . . 2.26 111.455 -175.921 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 34.3 m-85 -57.17 -38.81 74.15 Favored 'General case' 0 N--CA 1.453 -0.29 0 O-C-N 121.394 -0.816 . . . . 5.02 111.054 -178.741 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 4.3 mt-30 -71.37 -51.55 23.56 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 118.643 0.656 . . . . 2.7 110.607 170.64 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.403 HG23 ' HB2' ' A' ' 15' ' ' ALA . 0.4 OUTLIER -58.67 -31.43 68.19 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 123.94 0.896 . . . . 1.3 111.804 -172.069 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.6 t -91.29 1.65 56.95 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 126.485 1.914 . . . . 1.88 110.497 -176.876 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 90.37 -36.78 3.48 Favored Glycine 0 C--N 1.335 0.523 0 O-C-N 120.682 -1.262 . . . . 1.34 110.192 170.477 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 3.3 mp -33.57 -52.57 0.4 Allowed 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 126.537 1.935 . . . . 3.05 114.865 179.158 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 10.3 t -69.39 -27.31 65.19 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 119.523 1.056 . . . . 2.47 111.49 -176.3 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 5.6 tmtp? -79.7 -39.27 31.61 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 108.994 -0.743 . . . . 3.25 108.994 176.419 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 9.6 mtt -57.67 143.31 42.02 Favored 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 123.532 0.733 . . . . 2.71 110.629 176.684 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 3.8 m -62.09 149.32 41.56 Favored 'General case' 0 N--CA 1.446 -0.627 0 O-C-N 121.873 -0.517 . . . . 1.96 109.878 172.909 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -37.89 -43.51 0.7 Allowed 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 125.054 1.342 . . . . 0.61 111.913 171.076 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -53.29 -60.99 2.59 Favored 'General case' 0 C--O 1.227 -0.087 0 C-N-CA 124.249 1.02 . . . . 2.42 110.061 178.038 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 28.7 mm100 -60.81 -39.08 87.63 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 123.092 0.557 . . . . 3.14 109.893 -178.313 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 60.1 t -60.85 -44.63 98.09 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.29 0 CA-C-N 118.823 0.738 . . . . 0.53 109.855 177.668 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 62.0 tttt -68.84 -39.64 79.85 Favored 'General case' 0 N--CA 1.451 -0.4 0 O-C-N 121.642 -0.661 . . . . 2.97 110.692 -178.061 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -59.71 -58.2 9.6 Favored 'General case' 0 C--O 1.232 0.153 0 C-N-CA 122.749 0.419 . . . . 3.22 110.2 173.211 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 14.0 m -55.63 -44.92 78.5 Favored 'Isoleucine or valine' 0 C--N 1.34 0.195 0 N-CA-C 109.59 -0.522 . . . . 0.52 109.59 -179.189 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.557 ' CZ ' HD23 ' A' ' 59' ' ' LEU . 43.3 t80 -46.43 -64.23 0.81 Allowed 'General case' 0 C--N 1.341 0.229 0 N-CA-C 109.449 -0.574 . . . . 4.15 109.449 171.723 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 63.8 mtt180 -54.67 -37.04 65.28 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 114.005 1.113 . . . . 4.56 114.005 -178.711 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 27.1 m-85 -64.08 -52.97 56.72 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 119.282 0.946 . . . . 4.97 109.981 175.991 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 35.8 mm -76.2 -20.63 15.29 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.691 0 O-C-N 121.816 -0.552 . . . . 2.78 111.773 -171.409 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 43.7 t0 -48.53 -28.64 3.51 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 128.759 2.824 . . . . 2.6 113.015 173.983 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 11.2 t-20 79.14 -56.09 0.43 Allowed 'General case' 0 C--N 1.339 0.144 0 C-N-CA 126.318 1.847 . . . . 3.55 112.65 162.624 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 29.4 p30 -69.57 -39.14 77.54 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.966 0.907 . . . . 3.02 110.08 168.086 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . 0.278 1.2 pt20 83.95 24.09 0.12 Allowed 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 129.641 3.176 . . . . 3.63 111.021 -171.922 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 89.0 p -77.14 -27.2 53.8 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 113.607 0.966 . . . . 2.38 113.607 -174.069 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 98.44 24.47 11.15 Favored Glycine 0 CA--C 1.534 1.247 0 C-N-CA 125.28 1.419 . . . . 1.99 112.397 -173.175 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 44.7 m-85 -143.22 128.05 18.3 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 118.338 1.069 . . . . 3.04 111.112 -177.543 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.557 HD23 ' CZ ' ' A' ' 48' ' ' PHE . 1.6 mm? -109.19 70.19 0.73 Allowed 'General case' 0 C--N 1.339 0.125 0 C-N-CA 127.148 2.179 . . . . 2.03 108.588 -179.685 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -54.28 159.05 2.08 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.563 1.545 . . . . 1.61 111.076 173.268 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -36.55 -54.53 0.87 Allowed 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 125.852 1.661 . . . . 4.32 112.082 176.19 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 -63.81 -45.48 89.47 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 115.957 -0.565 . . . . 3.21 110.337 -173.345 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 81.7 mt-10 -62.89 -40.23 96.9 Favored 'General case' 0 N--CA 1.449 -0.517 0 O-C-N 121.506 -0.746 . . . . 2.57 110.513 178.547 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 6.2 mt -57.18 -50.57 72.43 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 120.921 0.391 . . . . 2.28 110.294 171.122 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 14.7 ttpt -60.76 -16.06 36.21 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 126.04 1.736 . . . . 4.26 112.441 178.694 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 69.6 m-85 -130.97 49.28 2.34 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.009 0.924 . . . . 6.31 110.354 170.089 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 68.3 t80 -85.77 -76.88 0.32 Allowed 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 124.419 1.088 . . . . 3.45 110.716 -178.214 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.432 HD11 ' CZ ' ' A' ' 30' ' ' PHE . 90.9 mt -61.15 -9.09 4.14 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 113.171 0.804 . . . . 2.52 113.171 -176.643 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 80.8 mm-40 -47.96 -61.97 1.7 Allowed 'General case' 0 N--CA 1.452 -0.353 0 O-C-N 121.492 -0.755 . . . . 1.65 110.346 168.617 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -83.79 48.01 1.38 Allowed 'General case' 0 CA--C 1.537 0.448 0 O-C-N 121.22 -0.925 . . . . 3.83 110.252 -177.267 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -153.12 -58.21 0.13 Allowed 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.165 0.986 . . . . 3.11 108.352 -167.712 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -108.55 -37.24 5.99 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 126.176 1.79 . . . . 3.76 109.904 175.291 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 1.4 p 78.81 107.8 0.07 Allowed 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 125.154 1.381 . . . . 3.24 108.734 -172.984 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 72.81 48.83 19.97 Favored Glycine 0 CA--C 1.527 0.8 0 N-CA-C 110.323 -1.111 . . . . 1.4 110.323 -176.118 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -79.11 -146.9 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.758 0.823 . . . . 1.45 109.795 173.68 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 7.2 tpt180 -102.7 -30.91 10.61 Favored 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 113.317 0.858 . . . . 3.53 113.317 -171.249 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -31.02 -33.19 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 129.717 3.207 . . . . 3.75 115.907 -175.302 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.409 ' H ' HD22 ' A' ' 78' ' ' LEU . 0.3 OUTLIER -39.94 -46.05 1.98 Allowed 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.727 1.211 . . . . 1.36 110.856 171.636 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 7.3 m -72.17 125.64 27.81 Favored 'General case' 0 C--N 1.343 0.311 0 C-N-CA 119.541 -0.864 . . . . 0.85 110.936 176.136 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -69.33 -38.52 78.23 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-O 118.086 -0.959 . . . . 2.9 111.738 177.904 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 19.1 m -48.47 -69.73 0.11 Allowed 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 119.768 1.167 . . . . 1.15 111.365 168.458 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -48.84 -45.46 40.69 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 123.757 0.823 . . . . 3.29 110.524 -176.514 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 1.2 m -60.31 -49.88 75.86 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 121.693 0.759 . . . . 1.05 110.276 177.043 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 24.2 ttpp -64.76 -29.8 70.78 Favored 'General case' 0 N--CA 1.439 -0.997 0 CA-C-N 115.966 -0.561 . . . . 4.73 110.696 -173.432 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 9.5 m -56.7 -33.75 66.77 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 119.476 1.034 . . . . 1.34 112.083 169.615 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.2 tt -71.68 -61.76 1.66 Allowed 'General case' 0 C--O 1.236 0.356 0 N-CA-C 108.25 -1.018 . . . . 2.58 108.25 169.832 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 2.1 ttm -46.11 -53.71 9.85 Favored 'General case' 0 C--O 1.221 -0.414 0 C-N-CA 123.335 0.654 . . . . 2.86 111.105 -174.003 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -42.96 -37.85 2.02 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 127.579 2.351 . . . . 0.81 113.34 179.92 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -97.62 -44.78 6.64 Favored 'General case' 0 C--O 1.227 -0.103 0 CA-C-O 120.897 0.38 . . . . 0.62 110.676 -175.746 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -53.9 -43.09 69.41 Favored 'General case' 0 N--CA 1.456 -0.15 0 C-N-CA 123.863 0.865 . . . . 0.55 110.926 176.792 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -73.72 72.84 1.51 Allowed 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 124.772 1.229 . . . . 1.18 109.541 -178.749 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 48.8 p-10 -77.17 51.83 0.86 Allowed 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.752 1.221 . . . . 2.76 112.313 -172.68 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 31.9 p30 -163.29 -46.26 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 126.281 1.833 . . . . 3.7 109.847 -175.017 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 99.98 55.05 1.01 Allowed Glycine 0 CA--C 1.525 0.699 0 N-CA-C 110.183 -1.167 . . . . 0.72 110.183 173.739 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -123.84 -46.97 1.95 Allowed 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 126.33 1.852 . . . . 2.35 109.918 175.01 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 123.5 -36.64 2.97 Favored Glycine 0 CA--C 1.529 0.953 0 C-N-CA 125.436 1.493 . . . . 0.66 111.342 178.042 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 39.9 mmtt -71.8 128.86 37.11 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 108.501 -0.926 . . . . 6.11 108.501 177.875 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 23.0 mt -119.39 116.31 50.4 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.253 0 C-N-CA 124.256 1.022 . . . . 0.73 108.644 -173.916 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -81.28 167.45 49.19 Favored Glycine 0 CA--C 1.528 0.878 0 N-CA-C 110.863 -0.895 . . . . 0.48 110.863 174.072 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -57.99 -37.81 74.94 Favored 'General case' 0 C--O 1.224 -0.28 0 N-CA-C 109.572 -0.529 . . . . 0.6 109.572 172.737 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 60.2 mt-10 -56.65 -67.08 0.34 Allowed 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 124.064 0.946 . . . . 2.94 109.49 175.013 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -40.04 -50.07 2.56 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.142 0.977 . . . . 1.38 111.393 175.551 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -66.89 -55.45 14.66 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 112.01 0.374 . . . . 2.91 112.01 -176.371 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 10.8 tt0 -53.58 -44.43 69.33 Favored 'General case' 0 C--O 1.221 -0.41 0 C-N-CA 124.212 1.005 . . . . 2.08 109.28 178.826 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -50.86 -62.46 1.59 Allowed 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 119.266 0.939 . . . . 3.98 110.426 173.721 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.03 -42.6 94.72 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 120.726 -0.389 . . . . 3.17 110.9 -173.67 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 57.2 t -58.85 -48.63 85.68 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.327 0 C-N-CA 124.103 0.961 . . . . 1.28 111.3 176.171 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 50.5 t-80 -72.81 -18.19 61.49 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 125.445 1.498 . . . . 2.44 110.834 -170.761 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 22.9 t . . . . . 0 C--O 1.254 1.332 0 CA-C-O 114.989 -2.434 . . . . 2.58 113.41 -179.856 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 110' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 111' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 52.6 mtt . . . . . 0 N--CA 1.472 0.654 0 N-CA-C 107.504 -1.295 . . . . 7.77 107.504 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.0 m 149.23 -86.05 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 130.055 3.342 . . . . 2.79 105.889 -175.187 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.637 HG22 HG12 ' A' ' 47' ' ' VAL . 1.5 pp -75.31 -33.34 27.78 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 CA-C-O 121.803 0.811 . . . . 1.4 111.514 -171.038 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 10.2 t -69.03 -7.03 31.8 Favored 'General case' 0 N--CA 1.426 -1.653 0 C-N-CA 126.284 1.834 . . . . 1.79 111.662 -175.242 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 52.1 t0 -148.08 60.63 1.11 Allowed 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 108.026 -1.102 . . . . 2.64 108.026 -179.474 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 3.1 p -145.38 -48.71 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.192 0 C-N-CA 123.842 0.857 . . . . 1.8 110.477 174.945 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -178.78 -48.83 0.01 OUTLIER 'General case' 0 CA--C 1.528 0.12 0 C-N-CA 126.121 1.768 . . . . 1.36 106.536 -175.267 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 2.3 m -50.94 -24.02 3.31 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 115.67 1.729 . . . . 0.94 115.67 -170.858 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -53.98 -41.51 67.96 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 119.543 1.065 . . . . 0.71 112.273 172.124 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -74.4 -36.89 63.52 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 121.391 0.615 . . . . 1.97 109.931 178.546 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -56.26 -52.84 63.0 Favored 'General case' 0 C--O 1.234 0.263 0 C-N-CA 124.253 1.021 . . . . 2.84 108.277 179.18 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 34.0 pt -63.14 -39.99 87.35 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.401 0 CA-C-N 115.087 -0.96 . . . . 0.9 110.153 -177.278 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -52.43 -45.8 66.14 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 118.999 0.818 . . . . 0.9 110.971 175.645 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.58 -59.6 5.19 Favored 'General case' 0 CA--C 1.533 0.322 0 O-C-N 122.144 -0.347 . . . . 0.79 110.949 174.06 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -47.83 -44.3 28.77 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 124.055 0.942 . . . . 0.67 111.933 -179.488 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -55.23 -37.04 66.66 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 125.058 1.343 . . . . 3.39 110.831 -179.146 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -87.55 -42.73 12.54 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 122.478 0.311 . . . . 5.2 110.368 -178.869 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -68.36 -36.99 80.03 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 118.073 0.397 . . . . 2.5 110.878 -174.189 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 39.5 m -116.83 69.05 0.75 Allowed 'General case' 0 C--N 1.339 0.119 0 C-N-CA 124.573 1.149 . . . . 1.44 108.445 172.634 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 48.8 ttt180 -88.71 -55.19 3.81 Favored 'General case' 0 N--CA 1.456 -0.151 0 N-CA-C 109.352 -0.611 . . . . 5.3 109.352 -179.247 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.419 ' O ' ' NH2' ' A' ' 76' ' ' ARG . 0.1 OUTLIER -60.53 138.03 92.59 Favored Pre-proline 0 C--O 1.224 -0.253 0 C-N-CA 124.43 1.092 . . . . 3.25 110.167 175.935 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -71.81 148.44 52.19 Favored 'Trans proline' 0 N--CA 1.458 -0.608 0 C-N-CA 123.462 2.775 . . . . 2.32 111.294 -176.683 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.4 t70 82.83 4.14 1.01 Allowed 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 127.396 2.278 . . . . 2.45 111.27 179.176 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 18.2 m -87.13 -7.28 58.17 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.621 1.168 . . . . 0.78 112.935 -177.89 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -86.09 82.97 7.88 Favored 'General case' 0 CA--C 1.534 0.356 0 O-C-N 120.041 -1.662 . . . . 2.99 113.196 -155.594 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -65.31 139.93 97.62 Favored Pre-proline 0 CA--C 1.534 0.364 0 O-C-N 121.64 -0.662 . . . . 2.19 110.364 175.0 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -68.06 -63.18 0.05 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.17 0 C-N-CA 122.605 2.204 . . . . 0.83 111.53 -176.263 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -53.94 -42.63 69.04 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 124.21 1.004 . . . . 2.7 110.88 179.446 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -54.32 -61.56 2.23 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 123.052 0.541 . . . . 4.51 109.714 174.858 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 8.4 t80 -53.72 -53.88 45.85 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-O 122.252 1.025 . . . . 2.16 110.839 -177.238 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.548 ' CE1' ' HA ' ' A' ' 107' ' ' VAL . 2.7 t80 -40.0 -56.32 1.87 Allowed 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.275 1.43 . . . . 4.77 111.81 175.2 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -70.55 -41.51 72.37 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 123.55 0.74 . . . . 2.59 110.27 -179.457 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.2 t -63.86 -38.38 90.88 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 118.403 0.547 . . . . 1.46 110.926 -170.512 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 38.5 m -60.33 -57.09 14.26 Favored 'General case' 0 N--CA 1.443 -0.789 0 N-CA-C 107.656 -1.239 . . . . 3.33 107.656 170.777 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 116.92 21.13 4.67 Favored Glycine 0 CA--C 1.525 0.708 0 N-CA-C 110.266 -1.134 . . . . 1.5 110.266 -172.896 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 1.8 mt -65.72 -24.6 67.02 Favored 'General case' 0 N--CA 1.451 -0.4 0 O-C-N 121.199 -1.177 . . . . 1.89 109.587 176.203 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.406 ' HB2' ' CZ ' ' A' ' 31' ' ' PHE . 21.5 t -63.49 -18.6 63.97 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.196 0.598 . . . . 2.43 110.4 173.07 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.24 -27.41 16.17 Favored 'General case' 0 N--CA 1.447 -0.585 0 O-C-N 121.665 -0.647 . . . . 5.52 110.0 176.814 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 27.4 mmt -69.11 134.23 49.06 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 121.425 0.631 . . . . 3.58 111.231 176.189 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 73.8 m -65.6 151.28 46.84 Favored 'General case' 0 N--CA 1.452 -0.326 0 O-C-N 121.876 -0.515 . . . . 1.63 110.715 175.892 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -39.25 -41.2 0.85 Allowed 'General case' 0 C--O 1.224 -0.241 0 C-N-CA 125.595 1.558 . . . . 0.51 111.998 172.488 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 65.6 m-20 -50.13 -59.83 3.54 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 124.049 0.94 . . . . 1.44 110.744 175.864 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -72.11 -35.03 69.06 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 109.181 -0.674 . . . . 3.51 109.181 -173.357 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 79.0 t -59.64 -43.04 90.3 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 O-C-N 121.584 -0.698 . . . . 0.46 109.869 174.084 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 60.6 tttt -69.5 -42.02 75.29 Favored 'General case' 0 CA--C 1.536 0.417 0 O-C-N 120.809 -1.182 . . . . 2.55 110.573 178.961 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -50.82 -61.41 2.23 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.33 0.652 . . . . 3.22 110.349 171.475 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.637 HG12 HG22 ' A' ' 3' ' ' ILE . 18.0 m -54.85 -46.99 75.67 Favored 'Isoleucine or valine' 0 C--N 1.34 0.178 0 CA-C-O 118.214 -0.898 . . . . 0.5 110.821 178.499 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 25.6 t80 -43.99 -52.72 6.81 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 119.127 0.876 . . . . 4.34 111.175 174.704 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 78.2 mtp180 -60.55 -37.38 81.04 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 120.499 -0.481 . . . . 3.4 111.451 179.569 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 11.5 t80 -64.64 -34.19 77.71 Favored 'General case' 0 CA--C 1.534 0.348 0 O-C-N 122.274 -0.266 . . . . 3.94 110.479 175.837 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.445 HG22 HD21 ' A' ' 59' ' ' LEU . 6.4 mm -68.58 -53.4 27.87 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 N-CA-C 109.909 -0.404 . . . . 1.42 109.909 175.503 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -78.06 60.6 2.43 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.754 0.822 . . . . 2.15 111.507 -172.026 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -52.05 -32.32 33.95 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 126.916 2.086 . . . . 1.97 113.334 -172.466 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 11.3 p-10 -72.25 -33.46 67.51 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.813 1.245 . . . . 2.57 111.728 178.278 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . 0.279 0.8 OUTLIER 75.33 22.18 1.73 Allowed 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 127.166 2.187 . . . . 4.77 114.698 -179.616 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 99.3 p -50.2 -29.13 8.7 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 120.039 1.291 . . . . 1.74 112.467 173.851 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 107.59 -24.99 22.66 Favored Glycine 0 C--N 1.338 0.681 0 N-CA-C 109.335 -1.506 . . . . 1.47 109.335 -172.595 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 96.8 m-85 -115.35 135.04 54.55 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 124.274 1.03 . . . . 2.53 108.813 -179.63 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.445 HD21 HG22 ' A' ' 51' ' ' ILE . 6.6 mt -71.72 75.7 0.84 Allowed 'General case' 0 N--CA 1.448 -0.552 0 N-CA-C 106.896 -1.52 . . . . 2.69 106.896 160.318 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -66.02 160.77 23.0 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 108.635 -0.876 . . . . 2.86 108.635 172.63 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -52.38 -39.01 60.28 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.91 0.884 . . . . 3.8 113.269 -170.199 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -66.2 -49.8 66.06 Favored 'General case' 0 N--CA 1.453 -0.31 0 O-C-N 121.714 -0.616 . . . . 3.49 110.293 -175.517 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -61.25 -31.76 71.56 Favored 'General case' 0 C--N 1.329 -0.317 0 O-C-N 121.25 -0.907 . . . . 3.02 110.816 174.08 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -53.78 -36.58 62.57 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 117.867 0.303 . . . . 2.44 111.558 168.996 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 33.0 ttpt -61.53 -9.18 5.28 Favored 'General case' 0 CA--C 1.54 0.564 0 O-C-N 121.292 -0.88 . . . . 2.31 112.487 173.612 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 76.8 m-85 -128.56 28.63 5.39 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 124.301 1.04 . . . . 4.43 111.424 171.43 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -59.08 -62.85 1.58 Allowed 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 118.652 0.66 . . . . 3.46 109.856 -177.031 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 47.1 mt -92.44 -9.42 41.64 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.442 0.697 . . . . 3.03 112.14 -178.249 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 43.9 mm-40 -54.19 -33.42 58.12 Favored 'General case' 0 N--CA 1.463 0.193 0 O-C-N 121.514 -0.741 . . . . 1.64 110.989 171.423 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.45 -28.69 63.56 Favored 'General case' 0 CA--C 1.533 0.311 0 O-C-N 122.155 -0.341 . . . . 3.24 111.294 176.376 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 4.4 m-30 -85.82 -58.59 2.59 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 108.501 -0.925 . . . . 3.12 108.501 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -140.73 127.85 20.87 Favored 'General case' 0 C--N 1.34 0.174 0 N-CA-C 109.141 -0.688 . . . . 3.34 109.141 -171.302 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 5.9 p -55.33 -27.1 44.84 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 123.973 0.909 . . . . 3.02 112.269 -179.096 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -106.1 22.84 30.47 Favored Glycine 0 CA--C 1.526 0.722 0 CA-C-O 118.54 -1.144 . . . . 1.84 112.04 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -54.48 -68.29 0.2 Allowed 'General case' 0 C--N 1.343 0.289 0 CA-C-N 118.805 1.303 . . . . 3.44 111.819 -174.12 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' ARG . . . . . 0.419 ' NH2' ' O ' ' A' ' 21' ' ' ASP . 1.2 tpt180 -173.52 -47.73 0.01 OUTLIER 'General case' 0 C--N 1.339 0.136 0 N-CA-C 112.735 0.643 . . . . 3.2 112.735 178.7 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -39.71 -31.31 0.1 Allowed 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 129.191 2.996 . . . . 3.7 114.598 -163.135 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.409 ' H ' HD22 ' A' ' 78' ' ' LEU . 0.3 OUTLIER -31.03 -51.95 0.17 Allowed 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 126.353 1.861 . . . . 1.36 112.158 165.322 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -82.89 121.78 27.4 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 122.91 0.484 . . . . 2.7 110.304 178.576 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -55.62 -31.03 61.93 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 116.215 -0.448 . . . . 3.17 111.617 176.414 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 7.9 t -58.58 -60.58 3.59 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 108.711 -0.848 . . . . 1.28 108.711 -176.659 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -65.42 -41.88 93.11 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 122.799 0.44 . . . . 2.92 110.216 -174.315 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 1.2 m -49.01 -52.1 27.04 Favored 'General case' 0 C--N 1.344 0.333 0 N-CA-C 109.709 -0.478 . . . . 0.98 109.709 169.816 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 51.5 mtmt -70.37 -29.1 65.67 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-O 118.311 -0.852 . . . . 4.63 112.729 -178.779 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 10.8 m -57.6 -46.41 84.1 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 120.783 1.628 . . . . 1.98 110.085 168.691 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -60.48 -57.39 12.96 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 109.202 -0.666 . . . . 2.2 109.202 175.271 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 17.0 ttp -47.78 -52.51 18.47 Favored 'General case' 0 C--O 1.225 -0.224 0 C-N-CA 124.026 0.93 . . . . 3.09 111.477 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -51.89 -44.27 63.67 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 126.407 1.883 . . . . 0.65 111.524 -172.01 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -80.58 -52.49 7.54 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-O 119.619 -0.229 . . . . 0.68 110.595 175.964 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -48.54 -44.6 36.55 Favored 'General case' 0 C--N 1.339 0.122 0 C-N-CA 123.876 0.87 . . . . 0.47 111.858 -175.682 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -72.72 80.39 1.12 Allowed 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 109.286 -0.635 . . . . 0.93 109.286 177.624 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 45.3 p-10 -76.97 50.4 0.72 Allowed 'General case' 0 CA--C 1.537 0.457 0 O-C-N 121.399 -0.813 . . . . 2.58 110.972 176.095 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 37.5 m-20 -137.01 -61.63 0.66 Allowed 'General case' 0 C--N 1.341 0.214 0 C-N-CA 126.381 1.872 . . . . 1.46 109.412 178.398 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 105.04 45.8 1.33 Allowed Glycine 0 CA--C 1.534 1.247 0 C-N-CA 125.263 1.411 . . . . 1.01 110.339 -161.618 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -127.18 -57.69 1.3 Allowed 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 125.359 1.464 . . . . 2.16 110.554 172.696 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 123.5 -25.19 6.32 Favored Glycine 0 CA--C 1.531 1.056 0 C-N-CA 124.83 1.205 . . . . 0.66 111.734 176.505 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 19.1 mtpp -78.98 112.83 16.57 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 106.459 -1.682 . . . . 4.1 106.459 175.824 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 5.9 mt -100.15 140.76 18.52 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.292 0 N-CA-C 107.95 -1.13 . . . . 0.72 107.95 -175.723 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -114.45 177.41 17.56 Favored Glycine 0 C--N 1.334 0.418 0 N-CA-C 110.82 -0.912 . . . . 0.61 110.82 176.952 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -61.17 -39.07 88.76 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 109.511 -0.551 . . . . 0.65 109.511 176.564 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -55.91 -63.71 1.09 Allowed 'General case' 0 N--CA 1.449 -0.509 0 O-C-N 123.536 0.523 . . . . 2.3 109.987 173.432 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -49.1 -47.77 44.94 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.012 0.925 . . . . 2.2 110.837 -179.718 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 58.2 t80 -62.16 -55.86 24.55 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 123.114 0.565 . . . . 4.28 111.162 -179.088 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 14.2 tt0 -52.58 -42.42 64.48 Favored 'General case' 0 C--O 1.219 -0.544 0 C-N-CA 123.558 0.743 . . . . 2.56 109.379 175.542 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -53.02 -57.32 10.76 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 124.16 0.984 . . . . 3.96 110.093 178.438 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -55.19 -51.59 66.05 Favored 'General case' 0 C--O 1.23 0.071 0 CA-C-O 121.493 0.663 . . . . 3.36 109.499 175.564 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 107' ' ' VAL . . . . . 0.548 ' HA ' ' CE1' ' A' ' 31' ' ' PHE . 92.2 t -73.03 -5.97 7.34 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 CA-C-N 115.533 -0.758 . . . . 1.47 112.978 -172.369 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 78.8 t60 -91.41 -8.63 47.35 Favored 'General case' 0 CA--C 1.536 0.436 0 O-C-N 120.721 -1.237 . . . . 3.02 110.421 174.096 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 21.1 t . . . . . 0 C--O 1.252 1.208 0 CA-C-O 114.39 -2.719 . . . . 2.37 113.91 -168.89 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 110' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 111' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.428 ' HB3' ' CB ' ' A' ' 5' ' ' ASP . 12.3 mmt . . . . . 0 N--CA 1.471 0.578 0 CA-C-O 118.425 -0.798 . . . . 7.45 108.873 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 50.6 m -96.24 -169.72 1.97 Allowed 'General case' 0 N--CA 1.454 -0.23 0 O-C-N 124.36 1.037 . . . . 2.67 108.801 175.332 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.473 HG21 HG12 ' A' ' 47' ' ' VAL . 1.6 pp -58.6 -35.97 57.53 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 O-C-N 121.781 -0.574 . . . . 1.82 110.469 -178.414 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 1.5 t -86.41 53.43 2.8 Favored 'General case' 0 N--CA 1.44 -0.942 0 C-N-CA 126.202 1.801 . . . . 3.09 108.094 -168.77 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.428 ' CB ' ' HB3' ' A' ' 1' ' ' MET . 4.8 m-20 -174.65 -56.51 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.144 0 N-CA-C 107.494 -1.298 . . . . 4.55 107.494 -170.595 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 13.9 t -46.97 -40.67 5.15 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.236 0 C-N-CA 126.081 1.752 . . . . 1.59 110.942 -175.914 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.578 HD23 ' CE ' ' A' ' 39' ' ' MET . 4.5 tp -164.62 -55.1 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 105.823 -1.917 . . . . 1.51 105.823 175.381 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -52.09 -15.96 0.68 Allowed 'General case' 0 N--CA 1.445 -0.69 0 N-CA-C 115.482 1.66 . . . . 0.81 115.482 -168.118 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -50.72 -49.39 57.79 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 120.63 1.559 . . . . 0.81 111.36 168.179 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -64.55 -40.33 95.39 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-O 122.462 1.125 . . . . 2.22 109.753 -178.739 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -67.5 -49.57 62.87 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-N 115.395 -0.82 . . . . 2.67 109.247 -175.705 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 19.1 pt -60.1 -40.78 84.33 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.802 0 O-C-N 121.634 -0.666 . . . . 0.76 110.764 174.972 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -54.28 -47.8 71.94 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 119.179 0.899 . . . . 0.78 111.019 174.302 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.45 -58.49 8.37 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 121.861 -0.524 . . . . 0.74 110.739 174.583 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.459 ' HB2' ' CG2' ' A' ' 33' ' ' THR . . . -46.91 -47.06 21.62 Favored 'General case' 0 C--O 1.232 0.165 0 C-N-CA 126.81 2.044 . . . . 0.72 111.736 -178.322 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -55.75 -41.7 74.33 Favored 'General case' 0 N--CA 1.445 -0.709 0 C-N-CA 125.751 1.621 . . . . 2.72 108.883 -179.121 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 17.1 tt0 -83.06 -50.95 7.98 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 108.991 -0.744 . . . . 2.91 108.991 -175.093 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.9 pp20? -61.88 -34.55 76.22 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 115.835 -0.62 . . . . 2.3 110.937 -170.849 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 96.6 m -121.39 67.04 0.88 Allowed 'General case' 0 C--O 1.235 0.305 0 C-N-CA 123.802 0.841 . . . . 2.07 109.189 168.238 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 16.6 ttp180 -84.23 -3.07 57.95 Favored 'General case' 0 N--CA 1.469 0.491 0 O-C-N 121.102 -0.999 . . . . 4.28 112.908 174.809 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -113.28 152.17 44.94 Favored Pre-proline 0 CA--C 1.537 0.464 0 C-N-CA 123.798 0.839 . . . . 2.69 112.064 -162.961 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -63.67 123.83 12.66 Favored 'Trans proline' 0 N--CA 1.453 -0.894 0 C-N-CA 122.891 2.394 . . . . 1.28 111.21 -169.549 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.9 t0 67.78 19.0 9.71 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 125.328 1.451 . . . . 3.26 112.336 173.654 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 26.6 m -83.14 -16.62 46.03 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.318 1.047 . . . . 0.94 111.784 176.986 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.416 ' HZ ' ' HB1' ' A' ' 15' ' ' ALA . 0.1 OUTLIER -94.53 98.36 10.78 Favored 'General case' 0 CA--C 1.539 0.538 0 O-C-N 121.922 -0.486 . . . . 4.06 111.116 -155.87 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -78.8 155.61 77.94 Favored Pre-proline 0 CA--C 1.535 0.381 0 O-C-N 121.725 -0.61 . . . . 2.81 110.667 -179.073 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -71.28 -61.2 0.05 OUTLIER 'Trans proline' 0 N--CA 1.45 -1.072 0 C-N-CA 122.595 2.197 . . . . 0.77 111.666 -176.632 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 -59.39 -38.06 79.55 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 118.317 0.508 . . . . 2.46 110.646 -179.212 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 1.1 tptp -55.09 -62.55 1.59 Allowed 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 109.635 -0.506 . . . . 4.12 109.635 170.7 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -53.74 -55.25 27.97 Favored 'General case' 0 C--O 1.218 -0.555 0 C-N-CA 124.335 1.054 . . . . 2.43 109.947 -174.845 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.466 ' CE1' ' HA ' ' A' ' 107' ' ' VAL . 3.4 t80 -33.03 -66.71 0.13 Allowed 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 128.774 2.83 . . . . 4.76 112.4 176.47 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 24.6 mt-30 -61.22 -46.31 90.96 Favored 'General case' 0 C--O 1.226 -0.16 0 N-CA-C 109.574 -0.528 . . . . 3.06 109.574 179.668 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.459 ' CG2' ' HB2' ' A' ' 15' ' ' ALA . 0.7 OUTLIER -59.08 -30.5 68.12 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 113.239 0.829 . . . . 0.67 113.239 -178.411 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 23.6 t -84.06 -2.67 57.13 Favored 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 125.082 1.353 . . . . 1.46 109.961 179.932 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 79.68 2.59 88.33 Favored Glycine 0 C--N 1.337 0.633 0 N-CA-C 110.728 -0.949 . . . . 0.68 110.728 174.726 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.438 ' HB3' HG13 ' A' ' 107' ' ' VAL . 96.0 mt -68.06 -22.08 64.96 Favored 'General case' 0 N--CA 1.442 -0.833 0 O-C-N 121.507 -0.996 . . . . 1.39 110.941 -172.338 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 13.9 t -71.49 -28.03 63.63 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 123.716 0.806 . . . . 2.15 109.871 172.697 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 12.9 tttt -84.56 -36.49 22.09 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 124.012 0.925 . . . . 4.31 108.899 -179.642 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.578 ' CE ' HD23 ' A' ' 7' ' ' LEU . 0.0 OUTLIER -55.69 128.51 35.13 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 121.228 0.537 . . . . 2.55 110.139 176.02 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 28.8 t -64.11 154.69 33.78 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 109.152 -0.684 . . . . 2.34 109.152 176.457 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -40.21 -43.45 1.68 Allowed 'General case' 0 C--N 1.34 0.174 0 C-N-CA 124.654 1.182 . . . . 1.06 111.368 173.396 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 50.6 m-80 -45.92 -64.11 0.82 Allowed 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.617 1.167 . . . . 2.35 110.764 172.874 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.652 ' O ' HG13 ' A' ' 47' ' ' VAL . 46.2 mt-30 -64.71 -39.35 93.5 Favored 'General case' 0 C--O 1.219 -0.504 0 C-N-CA 124.028 0.931 . . . . 3.48 110.555 -176.803 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.434 HG13 HG11 ' A' ' 107' ' ' VAL . 75.6 t -61.73 -46.45 96.5 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 CA-C-N 119.592 1.087 . . . . 0.55 110.007 179.613 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 12.3 tttt -63.26 -36.48 83.81 Favored 'General case' 0 CA--C 1.535 0.382 0 O-C-N 121.834 -0.541 . . . . 3.08 109.983 177.312 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -62.03 -52.44 63.95 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 122.555 0.342 . . . . 3.12 111.081 174.003 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.652 HG13 ' O ' ' A' ' 43' ' ' GLN . 1.5 m -57.41 -47.37 84.91 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.306 0 O-C-N 121.563 -0.711 . . . . 1.36 109.275 -179.526 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.541 ' CZ ' ' HB2' ' A' ' 100' ' ' ALA . 40.6 t80 -43.41 -58.86 2.38 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.285 1.034 . . . . 4.54 111.159 171.116 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 67.7 mtp180 -63.99 -36.31 83.57 Favored 'General case' 0 N--CA 1.465 0.312 0 O-C-N 121.558 -0.714 . . . . 3.29 112.867 178.626 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -55.49 -44.8 76.87 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 118.822 0.737 . . . . 3.59 109.556 175.976 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.494 HD11 ' CE1' ' A' ' 71' ' ' PHE . 3.1 mp -70.53 -48.07 61.35 Favored 'Isoleucine or valine' 0 C--O 1.236 0.357 0 CA-C-O 117.914 -1.041 . . . . 1.97 112.01 176.791 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 26.4 t0 -70.29 68.4 0.34 Allowed 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 123.537 0.735 . . . . 1.9 110.453 -178.04 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 20.1 t30 -56.53 -41.17 76.33 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 126.794 2.038 . . . . 2.16 110.976 -177.341 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -67.61 -14.65 63.13 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.273 1.029 . . . . 2.29 112.116 175.433 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 8.9 mt-30 49.36 57.44 6.48 Favored 'General case' 0 C--N 1.341 0.205 0 C-N-CA 125.223 1.409 . . . . 2.84 110.342 -179.195 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 95.9 p -89.86 -18.74 25.62 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 115.434 -0.803 . . . . 1.55 110.314 176.242 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 80.96 19.9 66.46 Favored Glycine 0 CA--C 1.529 0.941 0 N-CA-C 110.652 -0.979 . . . . 1.35 110.652 -169.532 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 77.0 m-85 -145.49 131.5 19.26 Favored 'General case' 0 CA--C 1.515 -0.389 0 C-N-CA 123.982 0.913 . . . . 2.14 109.336 179.26 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.487 HD23 ' CE1' ' A' ' 48' ' ' PHE . 0.4 OUTLIER -77.89 81.04 4.32 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 104.618 -2.364 . . . . 1.88 104.618 160.672 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -67.8 166.86 14.54 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 114.098 -1.41 . . . . 2.63 108.176 168.596 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -53.22 -48.1 68.44 Favored 'General case' 0 N--CA 1.452 -0.338 0 O-C-N 121.286 -0.884 . . . . 3.89 112.332 -172.394 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.58 -39.34 80.07 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 111.646 0.239 . . . . 4.77 111.646 -172.09 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -53.03 -36.96 61.11 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 118.692 0.678 . . . . 2.38 112.386 173.333 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 25.4 mt -67.46 -29.23 68.63 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 118.187 0.449 . . . . 2.34 110.204 176.816 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 27.5 ttpt -69.31 -2.39 10.63 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 118.515 -0.755 . . . . 2.5 111.306 170.172 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 17.1 p90 -148.26 44.01 1.04 Allowed 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 119.96 1.255 . . . . 5.15 113.97 166.59 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 50.8 t80 -71.99 -68.54 0.45 Allowed 'General case' 0 CA--C 1.538 0.499 0 O-C-N 120.894 -1.129 . . . . 2.28 110.393 -172.154 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 3.0 mp -73.38 -9.99 59.27 Favored 'General case' 0 C--O 1.234 0.242 0 C-N-CA 124.437 1.095 . . . . 2.05 112.33 173.863 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.66 -26.27 61.41 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 119.007 0.821 . . . . 2.64 111.326 178.622 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -92.47 -17.03 25.07 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.473 1.109 . . . . 2.67 111.061 178.631 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.494 ' CE1' HD11 ' A' ' 51' ' ' ILE . 9.9 m-30 -82.05 -69.43 0.62 Allowed 'General case' 0 C--O 1.224 -0.275 0 N-CA-C 107.496 -1.298 . . . . 3.13 107.496 175.256 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 25.9 tp10 -97.79 -49.44 4.82 Favored 'General case' 0 C--O 1.227 -0.094 0 C-N-CA 123.451 0.7 . . . . 3.42 109.148 -173.486 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 82.62 109.12 0.06 Allowed 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 124.751 1.22 . . . . 3.17 110.161 -172.417 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 93.58 32.53 7.62 Favored Glycine 0 CA--C 1.53 0.984 0 C-N-CA 124.541 1.067 . . . . 1.3 111.123 -174.933 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -85.92 -156.39 0.28 Allowed 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 123.922 0.889 . . . . 1.46 109.34 171.088 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.25 1.07 55.32 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 113.685 0.995 . . . . 3.52 113.685 -164.232 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -42.5 -37.41 1.62 Allowed 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 126.711 2.004 . . . . 2.86 113.443 -168.07 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.823 ' H ' HD22 ' A' ' 78' ' ' LEU . 0.2 OUTLIER -57.97 -45.47 86.67 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.24 1.416 . . . . 0.98 112.017 177.094 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 88.2 m -64.0 108.32 1.48 Allowed 'General case' 0 C--O 1.235 0.319 0 C-N-CA 124.064 0.946 . . . . 0.81 110.679 -179.434 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 8.5 mp0 -69.24 -38.83 78.67 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-N 114.644 -1.162 . . . . 3.44 110.572 -173.516 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 16.0 m -51.2 -52.61 42.71 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 119.455 1.025 . . . . 1.32 111.172 176.692 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 18.4 tt0 -67.3 -48.81 66.54 Favored 'General case' 0 N--CA 1.446 -0.643 0 C-N-CA 124.084 0.954 . . . . 4.33 109.709 -176.064 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -52.87 -46.22 67.78 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 122.164 0.983 . . . . 0.72 108.938 178.089 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 17.1 tttt -69.73 -33.6 72.69 Favored 'General case' 0 N--CA 1.444 -0.766 0 C-N-CA 125.55 1.54 . . . . 4.24 111.316 -179.545 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.6 t -58.73 -48.11 82.29 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 119.71 1.141 . . . . 1.64 109.145 172.464 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -57.16 -55.43 34.9 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 108.905 -0.776 . . . . 2.38 108.905 173.984 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 5.9 ttt -47.39 -47.0 26.48 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 112.341 0.497 . . . . 3.85 112.341 177.151 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -60.19 -46.12 90.82 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 125.592 1.557 . . . . 0.49 111.193 -169.912 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -84.84 -33.56 22.86 Favored 'General case' 0 C--O 1.227 -0.11 0 N-CA-C 111.776 0.287 . . . . 0.71 111.776 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -63.63 -39.19 93.72 Favored 'General case' 0 N--CA 1.456 -0.15 0 CA-C-N 117.982 0.356 . . . . 0.38 111.114 176.362 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 24.0 t0 -67.26 117.46 9.29 Favored 'General case' 0 N--CA 1.446 -0.651 0 N-CA-C 108.808 -0.812 . . . . 1.69 108.808 176.806 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 9.7 m-20 -100.1 10.76 40.76 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 118.649 -0.691 . . . . 2.72 111.369 178.51 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 25.9 m-20 -103.62 -56.25 2.24 Favored 'General case' 0 C--N 1.343 0.301 0 CA-C-N 119.017 0.826 . . . . 1.38 111.004 175.089 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 99.57 48.47 1.66 Allowed Glycine 0 CA--C 1.53 1.023 0 N-CA-C 108.751 -1.74 . . . . 0.94 108.751 -156.604 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 58.6 p-10 -128.97 -48.65 1.22 Allowed 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 127.119 2.168 . . . . 2.01 109.815 177.705 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 127.55 -66.01 0.57 Allowed Glycine 0 CA--C 1.523 0.585 0 C-N-CA 126.862 2.172 . . . . 1.27 108.129 -177.791 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 60.6 pttt -48.35 135.24 14.01 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.368 1.067 . . . . 4.49 111.233 -178.863 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 4.1 mt -117.76 108.28 24.19 Favored 'Isoleucine or valine' 0 C--O 1.232 0.176 0 C-N-CA 124.54 1.136 . . . . 0.82 109.41 -173.351 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -68.7 168.24 43.68 Favored Glycine 0 CA--C 1.534 1.25 0 N-CA-C 111.572 -0.611 . . . . 0.79 111.572 171.025 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' ALA . . . . . 0.541 ' HB2' ' CZ ' ' A' ' 48' ' ' PHE . . . -62.39 -38.34 89.25 Favored 'General case' 0 C--N 1.34 0.192 0 O-C-N 121.569 -0.959 . . . . 0.88 109.893 175.375 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -53.48 -54.88 30.77 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 123.25 0.62 . . . . 2.47 110.208 172.751 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -55.46 -50.92 68.6 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.254 0.621 . . . . 1.3 111.011 178.743 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 77.5 t80 -57.12 -57.13 13.91 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.389 -0.369 . . . . 3.95 110.902 -179.704 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -54.78 -44.33 73.62 Favored 'General case' 0 C--O 1.219 -0.504 0 C-N-CA 124.17 0.988 . . . . 2.19 110.122 177.765 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -52.44 -59.32 4.58 Favored 'General case' 0 CA--C 1.523 -0.068 0 CA-C-N 119.761 1.164 . . . . 3.1 110.464 176.733 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.76 -50.66 69.81 Favored 'General case' 0 CA--C 1.531 0.236 0 N-CA-C 108.39 -0.967 . . . . 2.78 108.39 -179.215 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 107' ' ' VAL . . . . . 0.466 ' HA ' ' CE1' ' A' ' 31' ' ' PHE . 85.4 t -69.53 -13.09 16.83 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.794 0 N-CA-C 113.001 0.741 . . . . 1.48 113.001 -175.784 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 41.6 t-80 -88.09 -5.12 58.63 Favored 'General case' 0 CA--C 1.539 0.555 0 O-C-N 120.43 -1.419 . . . . 2.69 110.542 175.329 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 23.0 t . . . . . 0 C--O 1.253 1.262 0 CA-C-O 115.307 -2.283 . . . . 2.45 113.275 -175.039 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 110' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 111' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.0 tpt . . . . . 0 N--CA 1.466 0.336 0 N-CA-C 112.007 0.373 . . . . 6.99 112.007 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 50.3 m -147.04 -67.85 0.26 Allowed 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 107.109 -1.441 . . . . 2.29 107.109 172.396 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.685 HG22 HG12 ' A' ' 47' ' ' VAL . 1.6 pp -69.82 -36.4 69.49 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.285 0 CA-C-O 121.649 0.738 . . . . 1.5 111.068 176.288 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.476 ' O ' ' HB2' ' A' ' 9' ' ' ALA . 16.6 p -73.67 -2.68 24.14 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 112.53 0.567 . . . . 3.4 112.53 -173.51 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -104.23 -35.03 8.15 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 118.668 0.667 . . . . 3.72 111.417 177.702 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 17.1 m -71.57 -44.73 70.01 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.246 0 N-CA-C 112.453 0.538 . . . . 2.44 112.453 -169.476 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -175.66 -58.14 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.161 0 N-CA-C 106.16 -1.793 . . . . 1.13 106.16 -172.94 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 4.9 m -44.63 -22.81 0.09 Allowed 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 127.072 2.149 . . . . 1.07 115.84 -168.625 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.476 ' HB2' ' O ' ' A' ' 4' ' ' THR . . . -47.67 -51.15 22.69 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 120.298 1.408 . . . . 0.57 112.523 168.047 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -64.6 -39.31 93.49 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-O 122.545 1.164 . . . . 1.95 109.514 -177.961 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -67.97 -45.36 74.4 Favored 'General case' 0 N--CA 1.442 -0.849 0 C-N-CA 124.463 1.105 . . . . 2.26 109.196 -174.291 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 37.7 pt -63.37 -38.06 81.17 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.803 0 O-C-N 121.458 -0.776 . . . . 0.74 110.591 174.845 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.8 -46.32 81.65 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 118.994 0.816 . . . . 0.68 110.487 173.247 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.12 -57.51 12.51 Favored 'General case' 0 CA--C 1.533 0.314 0 O-C-N 122.032 -0.417 . . . . 0.63 110.843 173.785 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -47.48 -49.07 26.53 Favored 'General case' 0 C--O 1.232 0.15 0 C-N-CA 125.577 1.551 . . . . 0.62 110.71 -178.941 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -53.22 -45.09 68.54 Favored 'General case' 0 N--CA 1.444 -0.762 0 C-N-CA 125.185 1.394 . . . . 2.8 109.731 179.638 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -79.3 -46.84 16.93 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 109.903 -0.406 . . . . 3.67 109.903 -174.187 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -63.56 -38.08 89.76 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 110.435 -0.209 . . . . 3.56 110.435 -175.542 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 85.5 m -101.81 46.54 0.93 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.717 0.807 . . . . 1.5 110.331 175.806 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 19.1 mtp85 -69.83 -52.74 22.37 Favored 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 108.499 -0.926 . . . . 4.21 108.499 173.803 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -61.95 138.26 95.62 Favored Pre-proline 0 N--CA 1.441 -0.899 0 CA-C-N 114.174 -1.375 . . . . 2.08 110.398 -175.88 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -60.46 150.99 78.14 Favored 'Trans proline' 0 N--CA 1.452 -0.955 0 C-N-CA 122.623 2.215 . . . . 1.25 110.498 -176.672 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 16.9 t70 56.85 15.93 2.5 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.502 1.521 . . . . 3.37 114.033 176.976 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 21.0 m -87.52 -12.52 45.63 Favored 'General case' 0 CA--C 1.534 0.364 0 O-C-N 121.004 -1.06 . . . . 0.99 110.789 177.842 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -73.78 117.41 15.53 Favored 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 123.791 0.836 . . . . 2.45 110.449 -171.758 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -115.21 147.1 37.77 Favored Pre-proline 0 CA--C 1.538 0.507 0 C-N-CA 125.222 1.409 . . . . 3.34 110.943 178.037 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_endo -62.71 -76.97 0.02 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.478 0 C-N-CA 124.669 3.579 . . . . 0.71 112.557 -175.645 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.4 tt0 -50.64 -45.2 57.69 Favored 'General case' 0 N--CA 1.445 -0.703 0 C-N-CA 124.886 1.274 . . . . 3.19 111.092 -175.505 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 40.4 tptt -47.32 -68.51 0.18 Allowed 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 124.023 0.929 . . . . 2.85 108.631 170.381 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -50.41 -41.76 52.78 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.358 1.063 . . . . 2.19 112.501 -177.668 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 14.8 m-30 -54.38 -52.29 62.14 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 118.48 0.582 . . . . 4.87 110.317 179.718 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -74.27 -37.96 63.56 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 120.338 -0.545 . . . . 3.43 110.622 -179.278 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -62.58 -34.63 77.38 Favored 'General case' 0 N--CA 1.442 -0.847 0 C-N-CA 124.052 0.941 . . . . 0.81 112.457 -178.686 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 14.9 m -82.65 -0.99 49.8 Favored 'General case' 0 N--CA 1.451 -0.412 0 O-C-N 123.468 0.48 . . . . 1.77 111.382 174.024 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 76.45 -2.5 57.62 Favored Glycine 0 CA--C 1.527 0.831 0 N-CA-C 111.511 -0.636 . . . . 0.73 111.511 -177.277 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -65.29 -31.46 72.61 Favored 'General case' 0 N--CA 1.445 -0.68 0 O-C-N 121.306 -1.114 . . . . 2.31 111.819 -172.709 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 83.0 p -77.3 -15.19 59.55 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 119.392 0.996 . . . . 1.98 112.368 172.998 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.93 -35.67 21.94 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 108.804 -0.813 . . . . 5.32 108.804 175.194 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 31.8 mmt -55.94 131.51 47.36 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-O 121.834 0.826 . . . . 3.17 110.646 171.564 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 2.0 m -70.56 159.84 33.59 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 115.398 -0.819 . . . . 1.85 109.676 178.956 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -41.33 -43.82 2.58 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.363 1.065 . . . . 0.58 112.138 177.543 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 66.8 m-20 -48.52 -61.57 1.95 Allowed 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 123.959 0.904 . . . . 1.52 110.304 175.906 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 22.5 mm-40 -62.15 -44.52 96.44 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 115.568 -0.742 . . . . 2.69 109.382 -179.169 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 57.8 t -59.55 -35.35 58.66 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.63 0 CA-C-N 119.079 0.854 . . . . 0.61 110.116 -178.237 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 3.8 tttp -67.42 -44.56 78.46 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.646 0.778 . . . . 2.76 111.201 174.196 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 73.5 m-20 -60.61 -54.87 40.17 Favored 'General case' 0 C--O 1.233 0.219 0 O-C-N 121.986 -0.446 . . . . 2.97 110.216 177.902 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.685 HG12 HG22 ' A' ' 3' ' ' ILE . 3.9 m -58.15 -46.52 88.39 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.241 0 CA-C-O 118.575 -0.726 . . . . 0.57 109.567 179.237 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 4.2 t80 -41.87 -55.15 3.18 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 123.95 0.9 . . . . 4.96 110.99 170.505 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 35.9 mtt85 -59.29 -37.99 79.09 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 118.177 0.444 . . . . 3.77 111.834 177.822 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 14.5 t80 -63.94 -30.2 71.3 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 122.143 -0.348 . . . . 3.77 110.544 177.292 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.3 mm -79.7 -50.01 18.56 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 CA-C-O 118.43 -0.795 . . . . 1.5 111.212 179.519 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -69.26 72.61 0.3 Allowed 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 123.862 0.865 . . . . 2.27 108.853 -176.212 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -61.4 -31.85 71.78 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 125.684 1.594 . . . . 2.01 111.407 -168.464 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 13.5 p-10 -69.64 -32.52 71.25 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 125.395 1.478 . . . . 2.49 111.815 171.237 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 59.23 80.04 0.21 Allowed 'General case' 0 N--CA 1.445 -0.677 0 CA-C-O 122.228 1.013 . . . . 3.06 109.084 -177.577 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 4.9 p -118.08 -70.25 0.8 Allowed 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 107.844 -1.169 . . . . 2.38 107.844 175.176 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 147.68 35.04 0.05 OUTLIER Glycine 0 CA--C 1.53 1.004 0 C-N-CA 126.781 2.134 . . . . 1.78 111.589 -179.831 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 33.0 m-85 -159.71 129.38 5.38 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 105.451 -2.055 . . . . 2.14 105.451 -178.803 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -86.42 75.58 9.76 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 105.202 -2.148 . . . . 2.01 105.202 166.302 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -55.77 133.3 50.91 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 113.874 -1.512 . . . . 1.62 107.724 175.797 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -48.51 -46.07 38.0 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 119.073 0.851 . . . . 5.59 113.151 -164.411 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -56.12 -31.42 63.3 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 122.705 0.402 . . . . 3.05 111.487 -176.923 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 92.4 mt-10 -66.82 -34.34 77.59 Favored 'General case' 0 N--CA 1.453 -0.3 0 O-C-N 120.964 -1.085 . . . . 1.88 110.954 176.66 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 86.9 mt -62.78 -29.21 70.53 Favored 'General case' 0 N--CA 1.456 -0.17 0 O-C-N 122.05 -0.406 . . . . 2.74 110.459 176.343 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 65.9 tttt -60.9 -7.37 2.35 Favored 'General case' 0 CA--C 1.543 0.675 0 O-C-N 121.75 -0.594 . . . . 4.1 112.426 171.438 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 11.8 t80 -137.96 37.42 2.36 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.145 0.978 . . . . 5.73 110.596 168.214 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -75.84 -79.12 0.1 Allowed 'General case' 0 N--CA 1.464 0.231 0 O-C-N 121.434 -0.791 . . . . 2.76 110.074 178.257 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.448 ' HB3' ' HB1' ' A' ' 75' ' ' ALA . 3.7 tt -62.75 -20.03 64.55 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.258 1.023 . . . . 2.45 110.427 -169.349 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 93.7 mm-40 -46.71 -37.62 8.69 Favored 'General case' 0 CA--C 1.541 0.632 0 O-C-N 121.051 -1.03 . . . . 2.17 112.013 166.154 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.68 -38.22 69.34 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 118.977 0.808 . . . . 2.76 111.204 173.47 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 9.0 m-30 -79.4 -52.25 8.32 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 123.999 0.92 . . . . 3.21 109.698 -177.386 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -150.79 134.79 16.75 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 123.491 0.716 . . . . 3.33 109.942 -175.325 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 15.5 t -58.86 -30.33 67.65 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.584 1.154 . . . . 3.61 111.607 -179.551 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -87.72 16.29 51.06 Favored Glycine 0 CA--C 1.525 0.678 0 C-N-CA 125.515 1.531 . . . . 2.77 111.446 -174.95 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.448 ' HB1' ' HB3' ' A' ' 68' ' ' LEU . . . -59.17 171.32 0.75 Allowed 'General case' 0 N--CA 1.444 -0.767 0 C-N-CA 123.544 0.738 . . . . 1.59 112.178 171.462 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 20.5 mmm180 -89.02 -27.32 20.93 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-O 118.396 -0.811 . . . . 3.82 112.795 -176.554 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -28.15 -43.49 0.02 OUTLIER 'General case' 0 N--CA 1.461 0.088 0 C-N-CA 128.694 2.797 . . . . 3.39 115.799 -166.822 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.492 ' H ' HD22 ' A' ' 78' ' ' LEU . 0.2 OUTLIER -40.37 -55.75 2.16 Favored 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 126.491 1.916 . . . . 1.2 110.199 174.513 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.68 133.18 42.12 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-O 122.7 1.238 . . . . 1.56 109.432 176.058 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 48.5 mp0 -74.14 -32.39 63.12 Favored 'General case' 0 N--CA 1.436 -1.131 0 CA-C-N 113.623 -1.626 . . . . 3.46 110.513 -179.021 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 19.8 m -54.27 -66.12 0.45 Allowed 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 119.751 1.16 . . . . 1.3 111.009 176.36 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -49.53 -53.15 25.09 Favored 'General case' 0 N--CA 1.452 -0.342 0 O-C-N 122.151 -0.343 . . . . 3.41 111.375 177.07 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -61.9 -43.5 98.72 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-O 121.813 0.816 . . . . 1.11 110.455 -173.743 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 46.9 mmtt -64.59 -28.03 69.35 Favored 'General case' 0 C--O 1.218 -0.599 0 CA-C-O 118.6 -0.714 . . . . 5.17 110.076 179.329 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -53.72 -44.86 70.22 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 119.467 1.031 . . . . 1.75 110.151 170.411 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.5 tt -64.29 -60.0 3.71 Favored 'General case' 0 C--N 1.342 0.249 0 O-C-N 121.85 -0.531 . . . . 3.16 109.718 172.848 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 8.5 tmm? -48.06 -58.14 4.87 Favored 'General case' 0 CA--C 1.536 0.429 0 O-C-N 123.94 0.775 . . . . 2.76 110.734 -173.772 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -38.64 -49.19 1.53 Allowed 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 128.105 2.562 . . . . 0.5 112.45 179.315 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -82.56 -51.79 7.45 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 110.162 -0.31 . . . . 0.53 110.162 -178.14 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -48.83 -40.12 28.09 Favored 'General case' 0 CA--C 1.528 0.128 0 C-N-CA 124.267 1.027 . . . . 0.38 112.221 -179.528 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -72.97 83.43 1.24 Allowed 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 109.79 -0.448 . . . . 0.91 109.79 179.121 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 46.3 m-80 -74.79 37.39 0.11 Allowed 'General case' 0 CA--C 1.539 0.526 0 O-C-N 121.383 -0.823 . . . . 2.94 111.772 177.761 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 20.5 m-20 -121.92 -55.48 1.89 Allowed 'General case' 0 N--CA 1.458 -0.054 0 C-N-CA 124.872 1.269 . . . . 1.24 108.392 174.398 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 93.2 43.53 4.03 Favored Glycine 0 CA--C 1.531 1.071 0 N-CA-C 109.008 -1.637 . . . . 0.76 109.008 -159.28 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -122.05 -55.73 1.87 Allowed 'General case' 0 C--N 1.34 0.182 0 C-N-CA 125.069 1.347 . . . . 2.44 109.655 174.701 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 135.51 -58.49 0.67 Allowed Glycine 0 CA--C 1.528 0.875 0 N-CA-C 110.901 -0.879 . . . . 0.7 110.901 -174.136 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 18.8 mttt -63.78 113.59 3.49 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 109.089 -0.708 . . . . 4.07 109.089 -176.957 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 6.7 mt -90.8 150.78 3.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 N-CA-C 107.427 -1.323 . . . . 1.0 107.427 174.959 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -126.94 -178.35 15.27 Favored Glycine 0 CA--C 1.522 0.495 0 N-CA-C 109.711 -1.355 . . . . 0.54 109.711 171.734 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -62.95 -42.67 99.89 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-N 117.288 0.544 . . . . 0.84 109.976 -174.146 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -58.39 -63.51 1.25 Allowed 'General case' 0 N--CA 1.449 -0.515 0 CA-C-O 118.237 -0.887 . . . . 2.62 110.282 177.37 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -45.48 -50.79 12.43 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 119.126 0.876 . . . . 1.24 111.949 175.399 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 57.6 t80 -60.98 -54.07 49.49 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 109.628 -0.508 . . . . 3.27 109.628 -175.407 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 24.9 tt0 -59.34 -46.13 89.46 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 123.769 0.828 . . . . 2.48 110.68 -179.259 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -49.58 -58.84 4.48 Favored 'General case' 0 C--O 1.23 0.038 0 CA-C-N 119.214 0.916 . . . . 3.74 110.416 175.298 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.61 -50.2 68.09 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 120.669 -0.412 . . . . 2.71 110.589 -176.318 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 55.3 t -54.43 -39.29 44.12 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.304 0 C-N-CA 123.02 0.528 . . . . 1.28 111.227 177.912 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 13.1 t60 -66.31 -19.93 65.95 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 124.247 1.019 . . . . 2.13 110.536 -178.161 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 4.3 t . . . . . 0 C--O 1.253 1.261 0 CA-C-O 117.506 -1.235 . . . . 3.58 110.406 -179.989 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 110' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 111' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.3 mmt . . . . . 0 N--CA 1.471 0.623 0 N-CA-C 107.514 -1.291 . . . . 8.45 107.514 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 42.1 t -159.96 -174.2 4.45 Favored 'General case' 0 N--CA 1.448 -0.547 0 N-CA-C 105.451 -2.055 . . . . 2.38 105.451 166.705 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.451 ' CG2' HG12 ' A' ' 47' ' ' VAL . 5.3 pt -44.05 -38.92 1.43 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 C-N-CA 126.155 1.782 . . . . 2.73 112.877 -175.971 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 8.2 t -51.02 -27.9 8.89 Favored 'General case' 0 N--CA 1.425 -1.687 0 C-N-CA 129.326 3.05 . . . . 2.48 113.734 178.136 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 24.8 t0 -152.72 52.1 0.76 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.662 0.785 . . . . 3.56 110.547 -178.762 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 4.5 t -118.98 -56.46 3.61 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.194 0 C-N-CA 125.139 1.376 . . . . 1.6 109.612 175.856 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 2.4 tp -167.67 -55.92 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 105.703 -1.962 . . . . 1.09 105.703 -177.004 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 70.1 m -51.53 -29.0 15.27 Favored 'General case' 0 N--CA 1.442 -0.871 0 N-CA-C 114.894 1.442 . . . . 1.03 114.894 -167.148 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -50.29 -42.86 53.14 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 121.151 -0.968 . . . . 0.89 112.171 173.132 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -69.09 -38.03 78.75 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-O 121.48 0.657 . . . . 2.07 110.462 176.293 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -58.96 -49.35 78.19 Favored 'General case' 0 C--O 1.234 0.257 0 C-N-CA 122.941 0.497 . . . . 4.94 109.716 -179.914 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 11.5 pt -65.35 -38.88 83.62 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.41 0 N-CA-C 109.277 -0.638 . . . . 1.11 109.277 -176.703 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -53.86 -47.7 70.77 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 118.321 0.509 . . . . 0.63 110.595 175.56 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.66 -59.22 5.73 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-O 120.512 0.196 . . . . 0.63 111.088 175.606 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -50.65 -46.83 58.61 Favored 'General case' 0 CA--C 1.528 0.117 0 C-N-CA 124.111 0.964 . . . . 0.58 111.637 -176.827 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 5.1 mp -51.34 -37.6 48.7 Favored 'General case' 0 C--N 1.333 -0.146 0 C-N-CA 124.417 1.087 . . . . 4.01 111.477 178.722 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -82.39 -46.62 13.31 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 109.519 -0.549 . . . . 5.28 109.519 178.306 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -70.56 -31.16 68.09 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 112.112 0.412 . . . . 2.42 112.112 -167.681 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 65.9 m -118.05 47.97 1.48 Allowed 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 125.572 1.549 . . . . 1.62 108.571 171.345 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 37.9 ttt85 -68.88 -32.22 71.72 Favored 'General case' 0 CA--C 1.534 0.339 0 O-C-N 121.673 -0.642 . . . . 5.17 109.983 173.586 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 91.8 m-20 -80.79 150.12 68.76 Favored Pre-proline 0 CA--C 1.539 0.522 0 C-N-CA 125.591 1.556 . . . . 2.25 110.924 -166.542 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -66.05 141.06 62.38 Favored 'Trans proline' 0 N--CA 1.455 -0.747 0 C-N-CA 123.105 2.537 . . . . 1.35 110.21 -174.89 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 63.97 9.18 4.4 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.583 1.553 . . . . 2.31 113.417 177.034 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 24.2 m -92.6 -9.52 40.74 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 119.568 1.077 . . . . 0.89 113.221 -171.666 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -58.43 115.21 2.84 Favored 'General case' 0 N--CA 1.448 -0.569 0 O-C-N 121.764 -0.585 . . . . 2.89 109.672 176.436 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -102.98 148.19 35.23 Favored Pre-proline 0 CA--C 1.532 0.288 0 N-CA-C 108.859 -0.793 . . . . 3.7 108.859 164.07 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -67.23 -65.94 0.04 OUTLIER 'Trans proline' 0 N--CA 1.451 -0.998 0 C-N-CA 123.254 2.636 . . . . 1.01 111.02 -177.062 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 35.4 mt-30 -58.8 -32.33 69.24 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 124.15 0.98 . . . . 2.33 110.841 -178.478 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 18.6 tptm -61.37 -66.56 0.52 Allowed 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 123.5 0.72 . . . . 2.84 109.943 173.093 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 51.3 t80 -54.38 -47.69 72.38 Favored 'General case' 0 C--O 1.221 -0.402 0 C-N-CA 122.975 0.51 . . . . 2.36 109.896 -176.93 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 3.8 t80 -39.01 -58.47 1.11 Allowed 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 126.514 1.926 . . . . 5.19 112.078 172.566 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 30.8 tt0 -72.09 -47.02 54.44 Favored 'General case' 0 N--CA 1.45 -0.458 0 N-CA-C 109.291 -0.633 . . . . 3.09 109.291 -176.803 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -57.63 -34.42 69.29 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 123.197 0.599 . . . . 0.83 110.977 -177.043 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 26.1 t -81.4 -5.03 57.46 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 125.942 1.697 . . . . 1.45 109.876 -177.862 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 74.69 4.13 69.65 Favored Glycine 0 CA--C 1.527 0.841 0 O-C-N 119.11 -2.244 . . . . 0.91 111.608 171.912 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.419 ' HB3' HG13 ' A' ' 107' ' ' VAL . 89.8 mt -60.78 -33.98 73.8 Favored 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 124.814 1.246 . . . . 1.75 109.16 178.147 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 21.1 t -61.64 -33.97 74.86 Favored 'General case' 0 N--CA 1.462 0.156 0 C-N-CA 123.952 0.901 . . . . 2.34 111.229 172.72 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 25.9 tttt -80.6 -36.86 32.18 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 108.403 -0.962 . . . . 4.58 108.403 -176.747 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 25.8 mmt -69.36 135.45 50.37 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-O 121.689 0.757 . . . . 3.9 111.832 -179.573 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 2.6 m -69.89 154.19 42.29 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 123.356 0.662 . . . . 1.82 110.671 179.593 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -42.27 -40.02 2.29 Favored 'General case' 0 C--O 1.222 -0.359 0 C-N-CA 123.853 0.861 . . . . 0.48 112.099 175.301 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 62.8 m-20 -47.52 -59.46 3.23 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.232 1.013 . . . . 1.56 110.94 175.259 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 2.6 mm100 -69.19 -40.17 78.24 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 109.441 -0.577 . . . . 2.61 109.441 -176.977 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 89.6 t -62.58 -36.6 75.85 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.525 0 CA-C-N 118.748 0.704 . . . . 0.49 109.53 -178.386 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 48.2 tttm -66.26 -46.09 78.3 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 123.213 0.605 . . . . 3.06 109.824 174.372 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -55.31 -57.83 10.19 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 117.93 0.332 . . . . 3.1 110.935 176.141 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.451 HG12 ' CG2' ' A' ' 3' ' ' ILE . 4.7 m -55.77 -46.08 79.67 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.239 0 CA-C-O 118.858 -0.592 . . . . 0.49 109.929 179.218 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -45.24 -53.69 7.97 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 118.603 0.638 . . . . 4.84 110.677 172.017 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 68.3 mtp180 -61.39 -43.42 98.89 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 119.057 0.844 . . . . 3.22 111.721 -179.868 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 13.6 m-85 -62.52 -38.63 90.69 Favored 'General case' 0 C--O 1.235 0.313 0 O-C-N 121.835 -0.541 . . . . 4.76 110.751 179.678 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.405 HG21 ' CD1' ' A' ' 67' ' ' PHE . 38.6 mm -82.65 -39.93 16.3 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 CA-C-O 118.053 -0.975 . . . . 2.14 112.005 -174.988 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 60.8 t0 -64.12 74.62 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 125.313 1.445 . . . . 1.98 108.141 169.097 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -54.49 155.38 4.02 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 106.612 -1.625 . . . . 3.21 106.612 164.647 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 76.22 -47.15 0.55 Allowed 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 118.757 0.708 . . . . 3.11 111.97 -173.686 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 8.3 mt-30 61.12 45.83 8.73 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.578 0.751 . . . . 3.63 110.351 -174.087 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 34.3 p -53.6 -33.02 53.51 Favored 'General case' 0 C--N 1.34 0.156 0 C-N-CA 124.703 1.201 . . . . 1.65 111.24 173.938 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 121.34 -23.78 7.5 Favored Glycine 0 CA--C 1.528 0.872 0 N-CA-C 109.633 -1.387 . . . . 1.43 109.633 -167.152 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 65.9 m-85 -126.38 151.89 47.03 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 123.785 0.834 . . . . 2.37 110.107 -176.165 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 18.6 mt -80.56 82.33 6.6 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 105.316 -2.105 . . . . 2.61 105.316 152.516 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -65.17 146.89 54.39 Favored 'General case' 0 CA--C 1.549 0.909 0 CA-C-N 113.268 -1.787 . . . . 2.38 108.416 173.122 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -45.22 -55.87 5.39 Favored 'General case' 0 C--O 1.234 0.287 0 O-C-N 120.668 -1.27 . . . . 3.89 114.324 -171.34 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -51.35 -30.69 19.52 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.781 0.832 . . . . 3.62 111.547 179.041 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -68.34 -45.82 71.85 Favored 'General case' 0 N--CA 1.444 -0.754 0 O-C-N 121.749 -0.595 . . . . 2.9 110.465 178.532 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.74 -30.21 71.34 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 119.556 -0.858 . . . . 2.9 110.156 178.236 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 12.1 ttpp -57.5 -5.96 0.41 Allowed 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.772 1.229 . . . . 2.05 113.465 171.111 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 36.7 p90 -137.67 27.72 2.73 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 119.864 1.211 . . . . 5.02 112.395 165.476 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.405 ' CD1' HG21 ' A' ' 51' ' ' ILE . 63.8 t80 -53.99 -73.38 0.05 OUTLIER 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 124.543 1.137 . . . . 2.81 112.263 -176.136 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.81 -26.0 65.86 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 108.909 -0.774 . . . . 3.87 108.909 -171.636 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -52.22 -38.43 57.98 Favored 'General case' 0 C--O 1.226 -0.151 0 C-N-CA 126.861 2.065 . . . . 2.82 111.231 174.313 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 20.8 mtpt -63.34 -29.29 70.62 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 117.997 0.362 . . . . 3.18 111.744 176.383 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -79.59 -56.18 4.49 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 124.126 0.97 . . . . 5.37 108.875 -178.5 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -104.24 -123.52 0.21 Allowed 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 108.023 -1.102 . . . . 4.16 108.023 -173.971 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 21.8 p -157.29 -5.64 0.1 Allowed 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 116.577 2.066 . . . . 2.73 116.577 175.608 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -169.33 66.25 0.17 Allowed Glycine 0 C--N 1.334 0.465 0 N-CA-C 108.222 -1.951 . . . . 1.87 108.222 175.528 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -89.02 -106.46 0.08 Allowed 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 117.385 0.593 . . . . 1.74 109.557 -171.16 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 9.4 tpt180 -151.11 50.49 0.84 Allowed 'General case' 0 N--CA 1.457 -0.109 0 CA-C-O 122.194 0.997 . . . . 4.68 110.474 -174.421 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -95.85 -18.05 20.66 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 126.008 1.723 . . . . 4.77 108.946 178.636 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -71.54 -42.86 67.37 Favored 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 124.375 1.07 . . . . 1.15 110.632 -179.204 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.91 126.5 28.73 Favored 'General case' 0 C--N 1.343 0.308 0 C-N-CA 118.401 -1.32 . . . . 1.11 109.47 179.485 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -61.91 -37.41 84.56 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 114.098 -1.41 . . . . 3.62 109.412 174.514 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -66.75 -60.16 2.93 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 117.994 0.361 . . . . 1.98 111.09 -179.083 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -52.94 -41.57 64.62 Favored 'General case' 0 N--CA 1.454 -0.246 0 O-C-N 121.135 -0.978 . . . . 3.11 110.797 177.071 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 4.4 m -59.44 -60.32 4.03 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 119.355 -0.938 . . . . 0.82 110.911 173.144 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 35.4 pttt -61.37 -27.52 68.58 Favored 'General case' 0 C--O 1.213 -0.848 0 C-N-CA 123.511 0.724 . . . . 6.27 110.603 -168.732 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 34.8 m -48.26 -47.3 36.2 Favored 'General case' 0 C--N 1.326 -0.426 0 O-C-N 121.251 -0.906 . . . . 1.48 110.832 170.822 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 11.6 mt -75.09 -54.42 7.18 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 109.183 -0.673 . . . . 2.31 109.183 171.349 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 1.6 tpt -54.67 -20.09 7.49 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 115.178 1.547 . . . . 5.62 115.178 -175.808 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -83.12 -61.17 1.93 Allowed 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 127.057 2.143 . . . . 0.84 109.457 -179.128 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -80.89 -34.14 33.76 Favored 'General case' 0 N--CA 1.455 -0.213 0 O-C-N 121.903 -0.498 . . . . 0.9 111.917 -171.654 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -60.2 -38.94 84.82 Favored 'General case' 0 C--O 1.227 -0.086 0 CA-C-N 118.418 0.554 . . . . 0.51 109.69 172.256 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -66.18 -62.67 1.36 Allowed 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 109.549 -0.538 . . . . 1.9 109.549 176.842 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 10.1 p30 43.59 23.13 0.04 OUTLIER 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 126.553 1.941 . . . . 3.55 115.038 -173.668 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 52.4 m-20 -95.78 -45.44 6.99 Favored 'General case' 0 C--N 1.338 0.091 0 C-N-CA 124.373 1.069 . . . . 1.93 108.339 171.947 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 97.75 41.49 3.34 Favored Glycine 0 CA--C 1.53 0.97 0 N-CA-C 109.463 -1.455 . . . . 1.26 109.463 -158.604 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . 0.252 1.7 p30 -127.74 -54.81 1.32 Allowed 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 118.416 1.108 . . . . 2.08 111.917 171.604 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 114.49 -34.37 4.94 Favored Glycine 0 CA--C 1.53 1.009 0 C-N-CA 124.611 1.101 . . . . 0.87 112.46 176.868 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 52.8 pttt -70.1 127.85 34.26 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-N 118.858 1.329 . . . . 3.98 108.058 173.105 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 8.7 mt -117.46 107.45 22.24 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.156 0 N-CA-C 108.307 -0.998 . . . . 1.08 108.307 -173.185 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -61.88 163.59 24.22 Favored Glycine 0 CA--C 1.526 0.752 0 N-CA-C 111.04 -0.824 . . . . 0.48 111.04 172.967 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -51.01 -42.86 60.68 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 109.039 -0.726 . . . . 0.62 109.039 168.359 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 8.8 tt0 -57.64 -56.74 18.01 Favored 'General case' 0 N--CA 1.445 -0.68 0 C-N-CA 124.121 0.968 . . . . 2.73 110.044 179.003 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -50.87 -48.07 60.29 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.68 0.792 . . . . 1.5 110.98 176.22 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 79.5 t80 -58.31 -54.56 45.67 Favored 'General case' 0 CA--C 1.538 0.492 0 O-C-N 121.745 -0.597 . . . . 4.04 110.896 179.052 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 13.0 mt-30 -61.96 -29.0 69.94 Favored 'General case' 0 C--O 1.221 -0.422 0 CA-C-O 118.001 -0.999 . . . . 4.05 112.534 177.519 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 23.5 mm-40 -63.01 -59.37 4.91 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 120.288 1.404 . . . . 3.29 107.778 172.374 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 5.6 tpt -54.99 -41.6 71.42 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 110.231 -0.285 . . . . 3.21 110.231 -176.378 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' VAL . . . . . 0.419 HG13 ' HB3' ' A' ' 36' ' ' LEU . 52.8 t -78.4 -54.86 11.35 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.51 0 N-CA-C 113.153 0.797 . . . . 1.3 113.153 -177.142 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 4.5 t-80 -72.05 -8.77 56.47 Favored 'General case' 0 C--N 1.326 -0.425 0 O-C-N 119.508 -1.995 . . . . 3.65 111.057 -175.702 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 33.2 t . . . . . 0 C--O 1.254 1.319 0 CA-C-O 115.084 -2.389 . . . . 2.79 113.643 167.14 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 110' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 111' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 29.6 mtt . . . . . 0 N--CA 1.471 0.579 0 CA-C-O 119.384 -0.341 . . . . 7.29 111.242 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.7 m -86.4 -143.93 0.11 Allowed 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 108.83 -0.804 . . . . 2.44 108.83 -168.304 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.521 HG22 HG12 ' A' ' 47' ' ' VAL . 1.3 pp -45.93 -33.43 1.6 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 C-N-CA 124.76 1.224 . . . . 1.24 112.393 179.083 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 9.1 t -64.87 -8.96 17.49 Favored 'General case' 0 N--CA 1.432 -1.361 0 C-N-CA 127.542 2.337 . . . . 1.64 111.541 -176.087 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 29.8 t0 -132.83 7.35 4.05 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 126.681 1.992 . . . . 2.4 109.477 -175.838 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 77.7 t -90.6 -61.31 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.344 0.347 0 O-C-N 121.574 -0.704 . . . . 1.51 109.827 174.361 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -166.26 -60.32 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.196 0 N-CA-C 107.517 -1.29 . . . . 1.1 107.517 -174.116 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 27.5 m -41.45 -25.89 0.05 Allowed 'General case' 0 C--O 1.221 -0.437 0 C-N-CA 126.959 2.103 . . . . 1.18 115.969 -169.846 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -48.09 -47.33 34.26 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 119.81 1.186 . . . . 0.88 112.387 171.416 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -64.71 -41.32 96.08 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-O 122.477 1.132 . . . . 1.75 109.716 179.838 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -68.88 -45.49 70.82 Favored 'General case' 0 N--CA 1.445 -0.683 0 C-N-CA 124.285 1.034 . . . . 2.39 109.384 -172.674 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 32.4 pt -60.93 -37.46 77.02 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.807 0 O-C-N 121.256 -0.902 . . . . 1.0 111.076 175.564 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.85 -43.95 77.58 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 118.68 0.673 . . . . 0.88 110.626 173.52 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.02 -57.12 14.22 Favored 'General case' 0 CA--C 1.534 0.363 0 O-C-N 121.946 -0.471 . . . . 0.78 110.524 172.803 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -47.31 -43.57 22.75 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.845 1.258 . . . . 0.77 111.222 -179.596 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.62 -36.99 77.43 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 126.16 1.784 . . . . 3.3 110.9 -177.614 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -91.38 -42.98 10.02 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 122.818 0.447 . . . . 2.79 110.005 -175.047 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -69.58 -32.9 71.94 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-O 119.792 -0.146 . . . . 3.54 110.973 -176.531 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 62.1 m -109.15 55.83 0.63 Allowed 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.927 0.891 . . . . 1.6 108.615 175.312 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.88 -53.67 12.48 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 121.608 0.718 . . . . 5.23 109.977 -168.156 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -69.66 140.28 89.32 Favored Pre-proline 0 N--CA 1.445 -0.709 0 CA-C-N 114.266 -1.334 . . . . 3.18 107.592 176.934 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -51.16 -70.92 0.05 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.659 0 C-N-CA 124.386 3.391 . . . . 4.12 112.089 -164.225 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 12.3 p-10 -77.08 49.35 0.66 Allowed 'General case' 0 CA--C 1.543 0.675 0 O-C-N 121.493 -0.754 . . . . 3.32 112.582 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 2.8 m -122.13 27.76 7.85 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 124.367 1.067 . . . . 1.42 110.151 174.851 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 12.0 t80 -109.1 135.91 49.46 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 124.695 1.198 . . . . 4.3 108.704 -179.869 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 -122.13 142.86 37.61 Favored Pre-proline 0 N--CA 1.451 -0.422 0 N-CA-C 107.696 -1.224 . . . . 3.82 107.696 169.639 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -64.86 -59.03 0.18 Allowed 'Trans proline' 0 N--CA 1.452 -0.963 0 C-N-CA 123.601 2.868 . . . . 0.77 111.296 -177.054 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -52.44 -50.66 62.18 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.307 0.643 . . . . 2.54 110.818 -179.179 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 12.6 tptp -45.53 -65.14 0.58 Allowed 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.433 1.093 . . . . 2.86 108.852 170.105 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -50.49 -44.36 55.86 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 124.879 1.272 . . . . 2.91 112.873 -176.957 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 13.5 m-85 -56.35 -46.54 79.92 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-N 120.036 1.289 . . . . 4.61 111.006 -178.189 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 -70.32 -46.53 64.03 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 109.454 -0.573 . . . . 2.89 109.454 178.019 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -63.8 -33.39 75.56 Favored 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 124.764 1.226 . . . . 0.89 113.137 -174.073 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.4 t -85.67 -1.32 57.04 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 125.319 1.448 . . . . 1.44 109.669 178.843 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 76.95 -11.83 13.61 Favored Glycine 0 CA--C 1.531 1.054 0 O-C-N 121.396 -0.815 . . . . 0.72 112.238 179.309 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 32.6 mt -55.93 -33.84 65.07 Favored 'General case' 0 N--CA 1.444 -0.728 0 C-N-CA 126.518 1.927 . . . . 1.38 112.525 -177.654 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 46.9 t -69.23 -32.95 72.52 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 118.803 0.729 . . . . 2.03 111.301 173.292 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 10.6 tttt -75.43 -34.79 61.02 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 108.563 -0.903 . . . . 4.24 108.563 -179.078 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 36.3 mtt -57.34 124.69 19.75 Favored 'General case' 0 N--CA 1.442 -0.848 0 N-CA-C 109.601 -0.518 . . . . 2.78 109.601 171.946 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 6.0 m -63.34 160.48 15.89 Favored 'General case' 0 N--CA 1.452 -0.337 0 O-C-N 121.537 -0.727 . . . . 1.86 110.73 176.46 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -41.6 -41.99 2.34 Favored 'General case' 0 C--O 1.224 -0.253 0 C-N-CA 125.005 1.322 . . . . 0.49 112.332 176.22 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 75.8 m-20 -48.69 -61.13 2.19 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.223 0.609 . . . . 1.54 109.886 175.514 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 9.0 mm-40 -62.84 -46.43 87.95 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 115.83 -0.623 . . . . 2.66 109.682 -178.997 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 62.6 t -58.82 -39.07 76.19 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 CA-C-N 119.789 1.177 . . . . 0.45 110.77 -176.836 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 6.7 ttmt -64.27 -48.43 75.77 Favored 'General case' 0 CA--C 1.536 0.432 0 O-C-N 121.366 -0.834 . . . . 4.55 110.707 172.861 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 78.1 m-20 -61.19 -51.1 70.45 Favored 'General case' 0 CA--C 1.535 0.387 0 O-C-N 121.807 -0.558 . . . . 3.41 110.06 -176.178 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.521 HG12 HG22 ' A' ' 3' ' ' ILE . 9.0 m -58.8 -46.65 90.8 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.27 0 CA-C-O 118.412 -0.804 . . . . 0.59 110.105 174.485 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 11.8 t80 -45.65 -48.71 14.82 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 119.291 0.951 . . . . 4.36 111.233 173.257 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 86.3 mtt-85 -61.19 -36.28 79.44 Favored 'General case' 0 CA--C 1.532 0.277 0 O-C-N 121.608 -0.682 . . . . 4.26 112.169 176.377 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 25.1 t80 -64.89 -33.76 76.78 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 118.805 0.729 . . . . 3.71 110.071 173.158 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 14.1 mm -67.25 -58.0 7.83 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.284 0 CA-C-O 117.895 -1.05 . . . . 1.55 111.721 176.583 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -73.18 70.97 1.15 Allowed 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 119.21 0.914 . . . . 2.37 109.457 -173.663 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 15.5 t30 -59.9 -32.63 70.93 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 125.967 1.707 . . . . 2.01 111.887 -170.791 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 17.2 p-10 -74.3 -21.05 59.91 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.473 1.109 . . . . 2.34 111.607 174.494 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 8.1 mt-30 49.92 63.07 2.33 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 126.496 1.919 . . . . 3.15 111.389 -178.103 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.2 p -93.71 -38.82 11.11 Favored 'General case' 0 CA--C 1.521 -0.149 0 CA-C-N 115.698 -0.683 . . . . 1.38 109.978 167.572 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 99.72 18.49 22.82 Favored Glycine 0 CA--C 1.53 0.971 0 CA-C-O 119.71 -0.494 . . . . 1.6 111.925 -169.329 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 36.7 m-85 -135.14 137.64 42.96 Favored 'General case' 0 C--O 1.238 0.454 0 N-CA-C 108.717 -0.846 . . . . 2.61 108.717 163.991 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -90.91 70.79 6.48 Favored 'General case' 0 C--O 1.231 0.099 0 C-N-CA 126.067 1.747 . . . . 1.73 107.87 168.89 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -63.56 165.64 7.78 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 123.314 0.646 . . . . 1.77 110.59 177.411 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -48.93 -47.38 43.64 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.147 0.979 . . . . 4.32 111.601 -176.837 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -73.74 -18.8 60.94 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 115.679 -0.691 . . . . 3.09 112.56 -177.03 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -70.51 -48.79 53.88 Favored 'General case' 0 CA--C 1.522 -0.105 0 N-CA-C 108.58 -0.896 . . . . 2.67 108.58 165.445 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.622 HD11 HD23 ' A' ' 86' ' ' LEU . 0.2 OUTLIER -49.37 -41.96 40.65 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 115.642 -0.708 . . . . 2.6 110.208 176.861 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 30.3 ttpt -55.02 -8.15 0.25 Allowed 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 114.5 1.296 . . . . 2.16 114.5 176.636 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 32.2 p90 -136.46 18.94 3.12 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 120.584 1.538 . . . . 5.6 113.564 168.37 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 2.7 t80 -42.48 -75.92 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.042 1.337 . . . . 2.52 114.107 -172.562 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.504 HD23 ' CD2' ' A' ' 71' ' ' PHE . 1.5 mt -73.89 -0.2 15.3 Favored 'General case' 0 CA--C 1.532 0.267 0 O-C-N 121.251 -0.905 . . . . 2.23 111.529 178.223 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -72.34 -19.17 61.69 Favored 'General case' 0 CA--C 1.532 0.257 0 O-C-N 120.599 -1.313 . . . . 2.7 110.714 -176.552 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.0 -29.6 68.58 Favored 'General case' 0 CA--C 1.534 0.332 0 O-C-N 122.006 -0.434 . . . . 2.89 111.321 163.654 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.504 ' CD2' HD23 ' A' ' 68' ' ' LEU . 2.5 m-30 -90.56 -65.02 1.05 Allowed 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 108.576 -0.898 . . . . 3.25 108.576 -176.479 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -117.33 119.47 35.25 Favored 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 107.922 -1.14 . . . . 3.08 107.922 -172.79 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 4.2 p -49.22 -34.45 14.91 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 123.73 0.812 . . . . 2.28 112.324 179.536 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -111.81 36.69 4.04 Favored Glycine 0 CA--C 1.524 0.643 0 C-N-CA 124.903 1.239 . . . . 1.1 110.925 -178.92 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.77 175.68 1.08 Allowed 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 117.617 0.708 . . . . 1.69 110.602 169.397 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.63 3.63 28.1 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 114.523 1.305 . . . . 5.19 114.523 -164.989 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -55.26 -26.51 40.42 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.092 0.957 . . . . 3.05 112.639 -162.702 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.44 ' H ' HD22 ' A' ' 78' ' ' LEU . 0.2 OUTLIER -62.73 -41.81 99.36 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.324 1.45 . . . . 0.88 112.155 173.86 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 53.9 m -64.06 106.29 1.03 Allowed 'General case' 0 C--O 1.236 0.36 0 N-CA-C 108.862 -0.792 . . . . 1.5 108.862 175.059 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -56.54 -37.33 70.35 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-N 115.611 -0.722 . . . . 3.06 110.478 174.945 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -49.85 -69.72 0.11 Allowed 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 119.394 0.997 . . . . 2.16 112.153 176.129 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 21.6 mt-10 -53.95 -48.18 70.56 Favored 'General case' 0 C--N 1.343 0.285 0 CA-C-N 119.357 0.981 . . . . 4.66 110.611 178.557 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -54.76 -51.82 64.49 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-O 121.658 0.742 . . . . 0.66 109.392 -175.036 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.93 -34.64 73.72 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 124.624 1.17 . . . . 5.02 110.29 -176.268 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 73.4 m -61.07 -48.73 80.34 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 120.14 1.336 . . . . 1.23 110.82 174.039 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.622 HD23 HD11 ' A' ' 64' ' ' LEU . 6.3 tp -54.02 -59.26 4.88 Favored 'General case' 0 C--N 1.342 0.271 0 N-CA-C 108.254 -1.017 . . . . 3.27 108.254 172.981 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 1.7 ttt -47.99 -50.47 27.39 Favored 'General case' 0 CA--C 1.538 0.501 0 O-C-N 123.771 0.669 . . . . 3.61 111.818 -179.014 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -54.92 -51.79 64.98 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 126.141 1.777 . . . . 0.68 111.275 -173.031 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -73.58 -49.08 28.1 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 120.112 -0.635 . . . . 0.51 110.29 177.43 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -48.99 -33.97 12.11 Favored 'General case' 0 C--N 1.339 0.14 0 C-N-CA 123.537 0.735 . . . . 0.56 111.598 -178.781 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 17.3 t0 -79.75 112.13 16.73 Favored 'General case' 0 N--CA 1.439 -0.995 0 C-N-CA 124.41 1.084 . . . . 1.18 112.483 -179.574 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 10.0 m120 -80.41 35.4 0.34 Allowed 'General case' 0 CA--C 1.539 0.534 0 O-C-N 120.958 -1.089 . . . . 2.54 112.312 176.85 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -142.92 -55.04 0.41 Allowed 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 119.727 1.148 . . . . 1.94 111.783 -174.465 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 88.25 40.4 6.52 Favored Glycine 0 CA--C 1.533 1.206 0 N-CA-C 109.283 -1.527 . . . . 1.44 109.283 -152.066 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 20.5 p30 -113.63 -65.03 1.23 Allowed 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 126.087 1.755 . . . . 1.9 109.227 169.254 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 129.45 -32.61 3.18 Favored Glycine 0 CA--C 1.524 0.598 0 C-N-CA 124.751 1.167 . . . . 0.84 111.001 -177.575 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 19.2 pttm -63.03 121.71 14.25 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 107.549 -1.278 . . . . 5.65 107.549 173.994 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 14.4 mt -123.57 118.56 54.73 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 C-N-CA 124.996 1.318 . . . . 0.71 107.726 -172.945 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -86.31 174.0 46.69 Favored Glycine 0 CA--C 1.531 1.041 0 N-CA-C 110.9 -0.88 . . . . 0.63 110.9 172.607 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -60.51 -42.22 95.94 Favored 'General case' 0 C--O 1.224 -0.271 0 O-C-N 122.222 -0.575 . . . . 0.87 109.643 175.915 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 -57.08 -57.46 12.48 Favored 'General case' 0 N--CA 1.447 -0.575 0 C-N-CA 123.39 0.676 . . . . 2.19 109.726 177.031 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 -48.36 -51.25 27.24 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 121.669 0.747 . . . . 1.31 110.213 177.017 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 12.5 t80 -61.24 -54.31 45.77 Favored 'General case' 0 CA--C 1.534 0.334 0 O-C-N 121.944 -0.473 . . . . 2.84 111.632 -176.992 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 23.9 tt0 -58.59 -45.27 89.45 Favored 'General case' 0 C--O 1.225 -0.185 0 C-N-CA 125.487 1.515 . . . . 2.64 110.885 -178.085 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 55.1 mt-10 -49.2 -54.21 17.64 Favored 'General case' 0 C--N 1.34 0.168 0 CA-C-N 119.219 0.918 . . . . 3.16 110.154 175.042 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 2.5 tpp -64.61 -52.84 55.39 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 116.088 -0.506 . . . . 4.58 110.117 -177.649 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 50.1 t -53.62 -37.72 32.07 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.225 0 C-N-CA 123.493 0.717 . . . . 1.37 111.647 -179.912 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 10.4 t-80 -63.9 -21.35 66.42 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 124.967 1.307 . . . . 3.39 110.487 -178.904 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 18.4 t . . . . . 0 C--O 1.252 1.193 0 N-CA-C 112.564 0.579 . . . . 3.7 112.564 -177.96 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 110' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 111' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 39.6 mtt . . . . . 0 N--CA 1.478 0.947 0 CA-C-O 119.344 -0.36 . . . . 8.04 111.246 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 44.0 t -142.98 -150.06 0.3 Allowed 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 105.463 -2.051 . . . . 2.75 105.463 -177.127 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.483 HG22 HG12 ' A' ' 47' ' ' VAL . 0.2 OUTLIER -50.68 -27.46 4.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 C-N-CA 124.285 1.034 . . . . 1.92 112.932 178.055 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -56.04 -40.16 73.08 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-O 122.04 0.924 . . . . 2.13 108.985 178.49 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 41.9 t0 -89.7 42.46 1.09 Allowed 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 128.04 2.536 . . . . 3.34 109.248 -172.793 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 40.3 t -144.94 -63.96 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.341 0.21 0 C-N-CA 125.075 1.35 . . . . 1.53 109.319 -176.926 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 10.8 tp -166.52 -57.16 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.131 0 N-CA-C 107.074 -1.454 . . . . 1.19 107.074 -174.858 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 1.6 m -42.01 -29.27 0.21 Allowed 'General case' 0 N--CA 1.446 -0.638 0 C-N-CA 128.553 2.741 . . . . 0.99 115.465 -165.3 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -45.89 -49.08 15.94 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.925 0.89 . . . . 0.61 112.139 173.798 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -61.52 -45.16 95.38 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 122.419 1.104 . . . . 1.79 109.283 -179.076 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -67.04 -47.28 71.85 Favored 'General case' 0 N--CA 1.445 -0.708 0 C-N-CA 124.608 1.163 . . . . 2.3 109.044 -171.768 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 19.2 pt -63.62 -39.59 85.92 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.801 0 O-C-N 121.774 -0.578 . . . . 0.97 111.175 176.221 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.44 -46.54 83.48 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 118.733 0.697 . . . . 0.67 110.779 173.852 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.59 -53.16 61.5 Favored 'General case' 0 CA--C 1.531 0.232 0 O-C-N 121.752 -0.593 . . . . 0.61 110.642 173.744 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.477 ' HB1' ' CZ ' ' A' ' 30' ' ' PHE . . . -51.81 -43.92 63.28 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 124.683 1.193 . . . . 0.57 111.172 -178.818 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -54.6 -35.74 63.7 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 124.539 1.136 . . . . 2.88 111.079 176.972 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 4.7 mt-30 -86.43 -43.89 12.45 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 118.238 0.472 . . . . 3.03 111.383 179.326 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.12 -45.5 92.79 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-O 121.689 0.757 . . . . 3.48 109.608 179.94 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 4.2 t -99.01 36.91 1.61 Allowed 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 126.216 1.806 . . . . 2.53 110.035 -175.229 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 57.7 ttp180 -74.14 -45.98 45.39 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 108.895 -0.78 . . . . 5.82 108.895 -178.719 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -81.56 147.88 60.68 Favored Pre-proline 0 N--CA 1.446 -0.665 0 N-CA-C 108.008 -1.108 . . . . 2.28 108.008 -163.111 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -65.1 146.7 87.63 Favored 'Trans proline' 0 N--CA 1.452 -0.951 0 C-N-CA 121.803 1.669 . . . . 1.27 110.923 -168.053 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 53.02 46.08 27.49 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 126.102 1.761 . . . . 2.6 112.203 177.043 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 3.0 m -118.01 6.5 12.14 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.147 1.379 . . . . 0.78 112.79 -179.172 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 2.8 t80 -81.7 83.98 6.95 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 119.86 -1.775 . . . . 2.61 110.358 -172.748 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -69.77 138.31 88.07 Favored Pre-proline 0 CA--C 1.539 0.522 0 N-CA-C 109.051 -0.722 . . . . 2.71 109.051 166.798 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -64.54 -60.97 0.12 Allowed 'Trans proline' 0 N--CA 1.45 -1.042 0 C-N-CA 122.674 2.249 . . . . 0.6 111.21 -179.393 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -59.6 -45.74 91.03 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 122.914 0.486 . . . . 2.12 110.456 -177.425 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -49.36 -60.44 2.82 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 109.769 -0.456 . . . . 4.37 109.769 174.389 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.477 ' CZ ' ' HB1' ' A' ' 15' ' ' ALA . 7.6 t80 -63.25 -41.53 99.08 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-O 120.783 0.325 . . . . 3.82 111.176 -173.068 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -46.0 -54.81 7.75 Favored 'General case' 0 C--O 1.235 0.297 0 C-N-CA 125.243 1.417 . . . . 5.28 110.257 173.388 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -72.2 -49.29 36.57 Favored 'General case' 0 N--CA 1.443 -0.811 0 N-CA-C 108.426 -0.953 . . . . 2.49 108.426 -173.348 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -54.99 -36.23 65.19 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 124.193 0.997 . . . . 0.67 111.164 -179.5 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 22.3 t -85.17 -2.33 57.91 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 123.577 0.751 . . . . 1.5 111.932 -176.143 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 82.79 0.8 90.41 Favored Glycine 0 C--N 1.339 0.736 0 CA-C-N 119.216 0.916 . . . . 0.75 112.253 168.997 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -59.33 -30.33 68.29 Favored 'General case' 0 CA--C 1.536 0.43 0 O-C-N 121.65 -0.912 . . . . 2.44 109.609 175.13 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 28.9 p -52.58 -42.31 64.39 Favored 'General case' 0 CA--C 1.523 -0.085 0 C-N-CA 124.73 1.212 . . . . 3.18 112.153 168.217 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 9.5 tttt -91.71 -28.45 17.42 Favored 'General case' 0 N--CA 1.444 -0.736 0 N-CA-C 109.52 -0.548 . . . . 5.88 109.52 -168.25 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 8.2 mmt -52.9 -46.5 68.04 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 113.599 0.963 . . . . 3.37 113.599 -175.484 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 19.4 m 93.19 147.79 0.03 OUTLIER 'General case' 0 C--N 1.34 0.164 0 C-N-CA 128.323 2.649 . . . . 2.19 109.675 -176.958 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -41.21 -36.72 0.8 Allowed 'General case' 0 N--CA 1.463 0.189 0 C-N-CA 125.682 1.593 . . . . 0.79 113.233 -174.665 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -67.76 -60.96 2.12 Favored 'General case' 0 N--CA 1.456 -0.136 0 N-CA-C 108.406 -0.961 . . . . 2.06 108.406 -174.594 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 23.3 mm100 -53.45 -49.98 66.25 Favored 'General case' 0 C--O 1.22 -0.49 0 CA-C-N 115.349 -0.841 . . . . 2.71 108.85 175.677 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 74.2 t -54.15 -46.93 67.61 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.503 0 CA-C-N 118.404 0.547 . . . . 0.65 111.222 -178.066 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 10.2 tmtt? -62.71 -43.14 99.58 Favored 'General case' 0 CA--C 1.535 0.402 0 O-C-N 121.034 -1.041 . . . . 4.17 110.801 176.881 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 80.5 m-20 -65.24 -48.13 74.37 Favored 'General case' 0 CA--C 1.537 0.449 0 O-C-N 121.483 -0.761 . . . . 3.78 110.297 -179.012 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.483 HG12 HG22 ' A' ' 3' ' ' ILE . 3.4 m -57.01 -43.87 81.76 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.213 0 O-C-N 121.241 -0.912 . . . . 0.67 110.31 174.99 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.414 ' CE2' ' HA ' ' A' ' 100' ' ' ALA . 6.9 t80 -47.87 -52.95 17.23 Favored 'General case' 0 C--N 1.344 0.327 0 N-CA-C 109.358 -0.608 . . . . 4.31 109.358 172.652 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 11.8 mtt180 -66.53 -32.72 74.25 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 113.733 1.012 . . . . 5.5 113.733 179.526 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 20.0 m-85 -56.21 -40.0 73.36 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 119.937 1.244 . . . . 4.37 110.715 170.451 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.9 mp -78.65 -44.56 25.77 Favored 'Isoleucine or valine' 0 C--O 1.241 0.607 0 O-C-N 121.82 -0.55 . . . . 1.97 111.923 -178.325 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 20.6 t0 -65.61 79.31 0.07 Allowed 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 125.131 1.372 . . . . 1.76 109.106 178.749 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 13.5 t30 -44.78 -56.86 4.12 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 126.516 1.926 . . . . 2.12 112.433 -173.474 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -60.94 -15.68 34.01 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.984 1.714 . . . . 2.52 113.421 177.188 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 13.9 mt-30 57.04 29.79 17.09 Favored 'General case' 0 C--O 1.235 0.3 0 C-N-CA 125.092 1.357 . . . . 3.11 111.331 -175.374 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.4 p -64.05 -20.77 66.17 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.541 0.737 . . . . 1.57 111.636 178.55 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 86.64 15.66 63.24 Favored Glycine 0 CA--C 1.53 0.979 0 N-CA-C 110.38 -1.088 . . . . 1.58 110.38 -172.459 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 76.6 m-85 -136.99 124.77 22.5 Favored 'General case' 0 CA--C 1.515 -0.375 0 C-N-CA 124.803 1.241 . . . . 2.83 108.612 -175.916 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -73.38 83.63 1.44 Allowed 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 104.064 -2.569 . . . . 2.62 104.064 151.972 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -66.75 164.85 16.22 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 107.206 -1.405 . . . . 3.07 107.206 166.204 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -42.07 -51.49 4.53 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 124.545 1.138 . . . . 5.94 112.347 -176.051 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -68.17 -24.31 64.95 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 113.012 0.745 . . . . 3.33 113.012 -173.226 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -57.67 -40.87 80.35 Favored 'General case' 0 C--N 1.341 0.224 0 CA-C-N 120.314 1.415 . . . . 2.35 110.218 172.152 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.2 mp -65.64 -17.95 64.97 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 120.191 -0.603 . . . . 2.64 111.514 179.858 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 29.5 ttpt -79.1 -14.3 59.21 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 118.956 0.798 . . . . 2.24 111.353 172.844 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 68.5 m-85 -145.17 61.34 1.3 Allowed 'General case' 0 C--O 1.241 0.612 0 C-N-CA 124.267 1.027 . . . . 4.87 109.996 175.054 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 18.4 t80 -91.84 -80.42 0.36 Allowed 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.974 1.31 . . . . 2.69 108.84 -175.3 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 8.2 mp -65.25 -4.79 5.68 Favored 'General case' 0 N--CA 1.465 0.301 0 O-C-N 120.683 -1.26 . . . . 2.12 113.379 170.871 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.13 -23.18 66.41 Favored 'General case' 0 N--CA 1.45 -0.466 0 O-C-N 121.262 -0.898 . . . . 2.83 111.4 171.213 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 6.8 mptt -91.52 -42.73 10.09 Favored 'General case' 0 C--N 1.342 0.277 0 CA-C-N 119.298 0.954 . . . . 3.62 110.886 167.992 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 45.0 m-85 -55.4 -50.23 70.3 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 118.447 0.567 . . . . 3.83 111.462 -177.377 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 25.2 tp10 -110.97 -66.78 1.05 Allowed 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 124.927 1.291 . . . . 3.47 108.904 -177.087 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 48.6 m 107.63 113.52 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 128.377 2.671 . . . . 3.16 109.026 -165.564 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 74.25 44.74 27.52 Favored Glycine 0 CA--C 1.527 0.842 0 N-CA-C 111.384 -0.686 . . . . 1.4 111.384 176.618 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -85.47 -118.59 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.537 0.735 . . . . 1.54 110.13 177.166 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.24 -7.08 12.41 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.242 1.017 . . . . 3.27 113.006 -169.239 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -54.38 -32.86 57.97 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 126.252 1.821 . . . . 2.93 112.871 -158.893 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.479 ' H ' HD22 ' A' ' 78' ' ' LEU . 0.5 OUTLIER -57.63 -41.72 81.94 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 124.26 1.024 . . . . 0.96 111.596 176.136 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 49.5 m -67.55 104.6 1.62 Allowed 'General case' 0 C--O 1.235 0.295 0 CA-C-N 118.957 0.799 . . . . 0.81 110.04 -178.846 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 13.9 mp0 -61.8 -36.5 81.29 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 115.66 -0.7 . . . . 3.41 110.508 -177.461 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 22.1 t -54.72 -55.68 27.32 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 118.828 0.74 . . . . 1.8 110.687 177.86 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -63.45 -47.89 79.97 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 123.991 0.917 . . . . 3.15 109.124 -178.193 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -52.96 -45.66 67.84 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 115.897 -0.592 . . . . 0.75 110.432 176.534 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 5.1 mmpt? -68.69 -37.74 79.79 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 124.249 1.02 . . . . 4.72 110.883 -178.971 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 22.7 t -51.89 -51.43 56.87 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 119.343 0.974 . . . . 1.79 109.129 171.373 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.436 HD22 ' HA ' ' A' ' 86' ' ' LEU . 1.4 tm? -62.85 -54.27 41.38 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 118.98 -0.533 . . . . 2.47 110.207 179.19 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 51.4 ttm -46.68 -50.95 17.03 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 118.254 0.479 . . . . 3.22 111.408 176.11 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -54.91 -46.66 74.9 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 125.735 1.614 . . . . 0.7 111.624 -171.009 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -82.16 -38.26 24.95 Favored 'General case' 0 CA--C 1.529 0.14 0 N-CA-C 111.779 0.289 . . . . 0.61 111.779 -179.79 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -63.98 -44.06 93.83 Favored 'General case' 0 N--CA 1.457 -0.115 0 N-CA-C 111.646 0.239 . . . . 0.41 111.646 -179.085 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -65.4 119.27 10.68 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 108.875 -0.787 . . . . 1.04 108.875 178.934 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -103.2 12.01 36.21 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 122.501 0.32 . . . . 3.14 111.508 -174.473 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 34.2 m-20 -103.45 -43.74 5.32 Favored 'General case' 0 C--N 1.34 0.159 0 C-N-CA 124.035 0.934 . . . . 1.59 109.803 179.811 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 90.33 40.17 5.82 Favored Glycine 0 CA--C 1.529 0.968 0 N-CA-C 108.95 -1.66 . . . . 0.85 108.95 -156.354 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -118.45 -59.7 1.85 Allowed 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 117.811 0.805 . . . . 2.46 110.322 177.688 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 131.11 -43.2 1.31 Allowed Glycine 0 CA--C 1.528 0.861 0 C-N-CA 123.827 0.727 . . . . 0.57 111.432 179.559 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 18.5 mtpt -69.36 123.91 22.47 Favored 'General case' 0 N--CA 1.451 -0.405 0 N-CA-C 108.771 -0.826 . . . . 5.54 108.771 176.892 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 9.7 mt -108.5 110.37 31.76 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.204 0 N-CA-C 109.854 -0.424 . . . . 0.79 109.854 -168.412 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -63.62 157.51 41.43 Favored Glycine 0 CA--C 1.532 1.113 0 N-CA-C 111.106 -0.798 . . . . 0.5 111.106 170.655 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' ALA . . . . . 0.414 ' HA ' ' CE2' ' A' ' 48' ' ' PHE . . . -55.24 -37.75 67.59 Favored 'General case' 0 C--N 1.339 0.137 0 O-C-N 121.936 -0.744 . . . . 0.66 109.745 169.798 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -55.48 -60.88 2.81 Favored 'General case' 0 N--CA 1.448 -0.53 0 C-N-CA 124.308 1.043 . . . . 2.85 109.672 176.582 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -47.87 -49.21 30.24 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.203 1.001 . . . . 1.3 111.279 176.225 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -61.34 -51.79 67.34 Favored 'General case' 0 N--CA 1.457 -0.117 0 CA-C-O 121.401 0.62 . . . . 3.08 110.99 -178.033 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 10.7 tm0? -58.61 -36.5 74.13 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-O 117.74 -1.124 . . . . 2.82 110.438 178.573 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -60.11 -61.46 2.59 Favored 'General case' 0 N--CA 1.457 -0.099 0 CA-C-N 120.012 1.278 . . . . 3.37 110.761 170.44 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 3.7 ttp -54.31 -38.73 66.28 Favored 'General case' 0 C--N 1.34 0.161 0 CA-C-O 120.881 0.372 . . . . 4.87 110.508 -173.569 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 54.6 t -70.56 -76.02 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.446 -0.673 0 C-N-CA 123.388 0.675 . . . . 1.63 110.085 174.363 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 52.8 t-80 -50.82 -44.32 59.13 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 123.668 0.787 . . . . 2.81 111.211 -167.964 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.251 1.151 0 O-C-N 124.622 1.202 . . . . 5.64 109.557 -174.425 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 110' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 111' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.512 HG22 HG12 ' A' ' 47' ' ' VAL . 1.6 pp . . . . . 0 CA--C 1.53 0.206 0 CA-C-O 121.616 0.722 . . . . 1.24 110.567 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 12.5 t -66.0 -9.85 34.12 Favored 'General case' 0 N--CA 1.426 -1.667 0 C-N-CA 127.673 2.389 . . . . 1.6899999999999999 112.078 -174.386 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 26.4 t0 -138.59 28.46 2.44 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.14 0.976 . . . . 2.8100000000000001 109.822 178.206 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 1.1 p -100.55 -46.74 11.77 Favored 'Isoleucine or valine' 0 C--N 1.344 0.327 0 O-C-N 121.682 -0.636 . . . . 1.9299999999999999 109.907 173.554 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 173.24 -58.8 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 106.956 -1.498 . . . . 1.1000000000000001 106.956 -165.742 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -43.48 -31.62 0.74 Allowed 'General case' 0 C--O 1.218 -0.556 0 C-N-CA 126.291 1.836 . . . . 1.3100000000000001 114.478 -169.386 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -45.5 -47.9 14.08 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 119.235 0.925 . . . . 0.62 112.874 173.775 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -67.21 -42.31 84.31 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-O 122.239 1.019 . . . . 1.78 109.789 -179.86 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -64.86 -43.52 92.72 Favored 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 123.734 0.814 . . . . 2.4100000000000001 109.425 -175.059 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 26.6 pt -67.1 -39.38 83.1 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.858 0 O-C-N 121.426 -0.796 . . . . 0.73999999999999999 111.02 176.522 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.63 -40.56 72.31 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 118.649 0.659 . . . . 0.65000000000000002 110.787 171.907 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.85 -57.09 10.91 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 121.914 -0.491 . . . . 0.56999999999999995 111.057 171.557 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -46.81 -47.59 21.0 Favored 'General case' 0 N--CA 1.462 0.158 0 C-N-CA 125.895 1.678 . . . . 0.56999999999999995 111.138 -177.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 16.0 tp -48.45 -48.54 37.42 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 125.941 1.696 . . . . 2.6000000000000001 109.595 178.243 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 -82.94 -43.3 16.63 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 110.517 -0.179 . . . . 3.2400000000000002 110.517 -174.297 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -66.87 -38.85 87.12 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 110.527 -0.175 . . . . 2.29 110.527 -173.561 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 56.6 m -106.92 62.55 0.63 Allowed 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 124.537 1.135 . . . . 1.52 108.084 166.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -74.95 -41.93 58.66 Favored 'General case' 0 N--CA 1.464 0.265 0 O-C-N 121.799 -0.563 . . . . 5.3099999999999996 109.514 170.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -78.81 148.39 72.4 Favored Pre-proline 0 N--CA 1.45 -0.459 0 C-N-CA 123.741 0.816 . . . . 1.98 111.126 -160.238 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -66.3 130.11 23.18 Favored 'Trans proline' 0 N--CA 1.449 -1.114 0 C-N-CA 123.006 2.471 . . . . 1.3 110.915 -175.146 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 74.4 37.62 0.56 Allowed 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 127.689 2.396 . . . . 2.9700000000000002 110.343 173.317 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 16.1 m -115.71 -6.56 12.14 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.214 1.006 . . . . 0.66000000000000003 112.759 -173.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -80.62 83.42 6.4 Favored 'General case' 0 CA--C 1.535 0.393 0 O-C-N 120.694 -1.254 . . . . 2.2999999999999998 111.248 -160.836 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -68.17 143.54 96.02 Favored Pre-proline 0 CA--C 1.534 0.332 0 O-C-N 121.596 -0.69 . . . . 2.5699999999999998 110.183 178.143 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -71.6 -62.52 0.04 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.24 0 C-N-CA 122.562 2.175 . . . . 0.65000000000000002 111.883 -175.095 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 37.1 mt-30 -55.07 -46.05 75.38 Favored 'General case' 0 C--O 1.233 0.193 0 C-N-CA 123.254 0.621 . . . . 2.3999999999999999 109.801 179.336 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 42.8 tptt -49.96 -56.64 9.82 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 116.009 -0.541 . . . . 3.2599999999999998 109.786 173.218 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 54.9 t80 -56.26 -50.97 69.84 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 111.534 0.198 . . . . 2.2599999999999998 111.534 179.841 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 31.0 m-85 -56.67 -34.6 67.53 Favored 'General case' 0 CA--C 1.532 0.272 0 O-C-N 121.319 -0.863 . . . . 5.25 112.008 -178.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 5.5 mm-40 -71.93 -58.6 3.32 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 108.568 -0.901 . . . . 3.1699999999999999 108.568 174.567 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -63.99 -25.28 68.06 Favored 'General case' 0 N--CA 1.439 -1.005 0 C-N-CA 123.945 0.898 . . . . 0.65000000000000002 111.839 -169.401 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 18.5 t -85.02 -7.83 58.97 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 126.02 1.728 . . . . 1.48 111.44 179.318 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 86.24 -11.78 62.21 Favored Glycine 0 C--N 1.338 0.674 0 N-CA-C 111.376 -0.69 . . . . 0.69999999999999996 111.376 174.512 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 93.5 mt -54.78 -42.83 72.23 Favored 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 125.516 1.526 . . . . 1.29 111.029 -179.654 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 5.3 t -72.02 -13.5 61.62 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.102 0.561 . . . . 1.8700000000000001 111.977 177.159 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -89.45 -35.94 15.71 Favored 'General case' 0 N--CA 1.452 -0.345 0 O-C-N 121.337 -0.852 . . . . 3.4900000000000002 109.863 174.469 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 59.9 mtt -57.13 152.39 13.57 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 121.603 0.716 . . . . 2.8900000000000001 111.361 174.295 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 23.8 t -78.69 154.76 29.86 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 116.213 -0.449 . . . . 1.99 109.905 174.579 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -41.0 -44.57 2.4 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 125.602 1.561 . . . . 0.56000000000000005 112.129 176.018 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 68.3 m-80 -54.33 -58.22 8.24 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.304 0.642 . . . . 1.5900000000000001 110.339 178.85 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 3.6 mm-40 -59.82 -44.61 93.93 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 123.077 0.551 . . . . 2.6699999999999999 109.849 -179.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.416 ' CG1' ' CZ ' ' A' ' 48' ' ' PHE . 53.1 t -57.91 -43.95 85.59 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 CA-C-O 121.293 0.568 . . . . 0.59999999999999998 109.523 -179.264 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 21.6 tttt -63.27 -48.92 76.14 Favored 'General case' 0 N--CA 1.452 -0.37 0 O-C-N 121.289 -0.882 . . . . 2.98 110.922 176.288 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -51.54 -54.09 31.02 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 118.18 0.446 . . . . 3.0699999999999998 110.671 176.363 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.512 HG12 HG22 ' A' ' 3' ' ' ILE 0.27 17.4 m -54.7 -44.34 70.04 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.206 0 CA-C-O 118.826 -0.607 . . . . 0.57999999999999996 110.984 178.802 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.559 ' CZ ' ' HB3' ' A' ' 103' ' ' PHE . 15.1 m-30 -54.21 -40.39 67.6 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 119.153 0.888 . . . . 5.9400000000000004 112.783 174.343 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 69.7 mtp85 -57.25 -42.02 80.72 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 118.613 0.642 . . . . 2.96 109.947 174.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 -68.64 -33.24 73.67 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 118.67 -0.681 . . . . 5.5599999999999996 110.949 176.77 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 14.0 mm -63.65 -59.81 3.72 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 CA-C-O 118.433 -0.794 . . . . 1.5 110.89 175.718 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 55.6 t0 -74.13 71.18 1.63 Allowed 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 119.194 0.906 . . . . 1.8700000000000001 110.554 -175.791 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 27.7 t30 -46.32 -47.24 18.49 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 125.888 1.675 . . . . 1.9199999999999999 111.0 176.617 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -64.39 -19.26 65.38 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 126.639 1.976 . . . . 3.96 112.12 -177.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 59.64 12.64 2.97 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 127.08 2.152 . . . . 4.6100000000000003 113.58 178.677 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 3.9 p -70.12 -10.32 58.39 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 113.83 1.048 . . . . 2.21 113.83 -170.138 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 85.71 34.89 12.4 Favored Glycine 0 CA--C 1.529 0.937 0 CA-C-N 118.933 0.788 . . . . 2.4300000000000002 111.968 172.067 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -171.05 143.71 2.01 Favored 'General case' 0 CA--C 1.519 -0.233 0 C-N-CA 127.289 2.235 . . . . 2.75 105.001 175.625 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -102.93 68.54 1.0 Allowed 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 107.309 -1.367 . . . . 2.27 107.309 176.272 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -56.81 146.45 26.16 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.744 1.618 . . . . 1.6699999999999999 110.761 179.362 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -44.89 -51.26 9.84 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 123.512 0.725 . . . . 3.54 112.953 -175.395 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -69.67 -19.62 63.59 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 121.968 -0.457 . . . . 3.2799999999999998 111.917 -173.39 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 91.4 mt-10 -77.64 -44.57 27.77 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-O 121.293 0.568 . . . . 2.3900000000000001 109.598 167.413 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 6.4 tp -53.23 -28.24 26.2 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.644 0.777 . . . . 2.6299999999999999 110.978 174.191 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 30.2 ttpt -50.67 -16.71 0.42 Allowed 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 113.904 1.076 . . . . 2.4700000000000002 113.904 169.326 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 27.5 p90 -127.48 33.93 4.76 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 120.097 1.317 . . . . 5.25 112.634 170.138 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 46.4 t80 -57.76 -67.36 0.34 Allowed 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.649 0.78 . . . . 2.4500000000000002 110.794 178.431 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 2.9 tp -85.38 -9.27 57.79 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.473 -0.767 . . . . 2.3900000000000001 112.066 -175.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 49.5 mm-40 -56.0 -18.72 10.11 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.098 0.959 . . . . 1.6100000000000001 111.399 171.405 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -83.04 -16.39 47.22 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 121.196 -0.94 . . . . 3.5499999999999998 111.476 177.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 6.3 m-30 -101.16 -53.87 2.92 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 124.674 1.189 . . . . 3.25 108.916 -179.1 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -112.83 161.2 17.21 Favored 'General case' 0 C--O 1.222 -0.371 0 N-CA-C 106.606 -1.627 . . . . 3.3500000000000001 106.606 175.8 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 24.1 m -85.66 -34.62 21.27 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 118.896 0.771 . . . . 2.0800000000000001 110.524 172.629 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -114.48 42.61 1.88 Allowed Glycine 0 CA--C 1.519 0.324 0 N-CA-C 109.568 -1.413 . . . . 1.04 109.568 -170.444 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.08 -171.57 0.92 Allowed 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 120.953 0.406 . . . . 1.28 111.01 177.552 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.7 -13.59 39.31 Favored 'General case' 0 N--CA 1.453 -0.287 0 O-C-N 121.696 -0.628 . . . . 3.0 112.545 -166.112 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -46.47 -40.59 12.64 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 126.842 2.057 . . . . 3.1099999999999999 112.802 -163.445 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.401 HD22 ' H ' ' A' ' 78' ' ' LEU . 0.2 OUTLIER -49.04 -43.1 40.37 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.607 1.163 . . . . 0.81000000000000005 112.144 175.584 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 91.8 m -69.26 104.77 2.31 Favored 'General case' 0 C--O 1.235 0.304 0 O-C-N 121.523 -0.736 . . . . 0.77000000000000002 109.98 175.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -54.77 -41.98 71.14 Favored 'General case' 0 C--O 1.219 -0.542 0 CA-C-N 115.609 -0.723 . . . . 3.0699999999999998 111.671 178.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 34.7 t -54.28 -53.91 47.37 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-O 121.463 0.649 . . . . 1.79 111.081 -178.463 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -63.36 -47.67 81.12 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 124.074 0.949 . . . . 2.8900000000000001 108.577 -178.765 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -52.22 -44.91 65.03 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 116.177 -0.465 . . . . 0.55000000000000004 111.229 174.232 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -76.42 -27.3 56.2 Favored 'General case' 0 C--O 1.221 -0.422 0 C-N-CA 124.219 1.007 . . . . 5.0899999999999999 110.718 -175.793 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 24.6 m -61.6 -45.96 91.87 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 119.089 0.859 . . . . 1.5 109.798 168.667 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -59.3 -57.91 10.96 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 110.039 -0.356 . . . . 2.7799999999999998 110.039 172.194 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 22.2 ttp -47.16 -52.64 15.05 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.22 0.608 . . . . 3.0699999999999998 111.366 178.214 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -49.65 -51.37 38.41 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 126.117 1.767 . . . . 0.5 111.537 -172.028 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -78.02 -41.73 34.81 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-O 119.853 -0.118 . . . . 0.48999999999999999 111.294 179.835 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -54.81 -41.36 70.54 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-O 120.682 0.277 . . . . 0.34999999999999998 111.036 179.263 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -77.76 80.96 4.21 Favored 'General case' 0 N--CA 1.445 -0.688 0 C-N-CA 123.245 0.618 . . . . 0.93000000000000005 111.083 -176.574 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 52.8 p-10 -76.26 41.31 0.23 Allowed 'General case' 0 CA--C 1.541 0.633 0 O-C-N 121.405 -0.809 . . . . 2.79 112.16 176.374 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 29.2 m-20 -126.11 -58.98 1.35 Allowed 'General case' 0 C--N 1.342 0.251 0 C-N-CA 126.193 1.797 . . . . 1.25 108.299 172.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 93.94 44.33 3.62 Favored Glycine 0 CA--C 1.53 0.971 0 N-CA-C 109.147 -1.581 . . . . 0.81999999999999995 109.147 -157.304 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 41.0 p-10 -124.87 -47.43 1.8 Allowed 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 124.621 1.168 . . . . 2.0499999999999998 110.318 172.395 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 115.7 -31.24 6.22 Favored Glycine 0 CA--C 1.524 0.638 0 C-N-CA 124.618 1.104 . . . . 0.64000000000000001 111.227 170.655 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 21.5 pttp -69.34 114.22 7.39 Favored 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 107.692 -1.225 . . . . 5.1600000000000001 107.692 168.715 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 19.7 mt -103.83 115.57 46.02 Favored 'Isoleucine or valine' 0 C--O 1.231 0.13 0 C-N-CA 123.551 0.74 . . . . 0.66000000000000003 109.36 -171.842 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -72.28 162.15 54.48 Favored Glycine 0 CA--C 1.534 1.267 0 CA-C-O 121.831 0.684 . . . . 0.55000000000000004 112.143 172.463 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -57.11 -40.09 76.38 Favored 'General case' 0 C--O 1.226 -0.184 0 O-C-N 121.78 -0.835 . . . . 0.59999999999999998 109.673 172.106 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -56.19 -54.18 48.23 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.978 0.911 . . . . 2.5699999999999998 110.274 177.262 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -51.66 -50.53 60.19 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.079 0.952 . . . . 1.27 110.422 176.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . 0.559 ' HB3' ' CZ ' ' A' ' 48' ' ' PHE . 3.4 m-85 -61.12 -44.22 97.68 Favored 'General case' 0 CA--C 1.534 0.364 0 O-C-N 121.87 -0.519 . . . . 3.7799999999999998 111.709 177.847 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 30.9 tt0 -57.42 -49.83 74.95 Favored 'General case' 0 C--O 1.222 -0.384 0 N-CA-C 108.796 -0.816 . . . . 2.0699999999999998 108.796 178.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -47.01 -60.39 2.48 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 123.521 0.729 . . . . 3.2400000000000002 110.548 172.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.22 -43.42 98.87 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 120.378 -0.529 . . . . 2.8500000000000001 110.976 -172.257 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 66.2 t -64.23 -38.93 83.78 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.428 0 CA-C-O 119.306 -0.378 . . . . 1.01 111.227 176.596 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 79.5 t60 -66.42 -22.48 66.23 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 124.376 1.07 . . . . 2.6000000000000001 110.055 -173.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 22.7 t . . . . . 0 C--O 1.253 1.273 0 CA-C-O 115.343 -2.265 . . . . 2.5800000000000001 112.986 176.886 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.512 HG22 HG12 ' A' ' 47' ' ' VAL . 1.6 pp . . . . . 0 CA--C 1.53 0.206 0 CA-C-O 121.616 0.722 . . . . 1.24 110.567 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 12.5 t -66.0 -9.85 34.12 Favored 'General case' 0 N--CA 1.426 -1.667 0 C-N-CA 127.673 2.389 . . . . 1.6899999999999999 112.078 -174.386 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 26.4 t0 -138.59 28.46 2.44 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.14 0.976 . . . . 2.8100000000000001 109.822 178.206 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 1.1 p -100.55 -46.74 11.77 Favored 'Isoleucine or valine' 0 C--N 1.344 0.327 0 O-C-N 121.682 -0.636 . . . . 1.9299999999999999 109.907 173.554 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 173.24 -58.8 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 106.956 -1.498 . . . . 1.1000000000000001 106.956 -165.742 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -43.48 -31.62 0.74 Allowed 'General case' 0 C--O 1.218 -0.556 0 C-N-CA 126.291 1.836 . . . . 1.3100000000000001 114.478 -169.386 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -45.5 -47.9 14.08 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 119.235 0.925 . . . . 0.62 112.874 173.775 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -67.21 -42.31 84.31 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-O 122.239 1.019 . . . . 1.78 109.789 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -64.86 -43.52 92.72 Favored 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 123.734 0.814 . . . . 2.4100000000000001 109.425 -175.059 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 26.6 pt -67.1 -39.38 83.1 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.858 0 O-C-N 121.426 -0.796 . . . . 0.73999999999999999 111.02 176.522 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.63 -40.56 72.31 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 118.649 0.659 . . . . 0.65000000000000002 110.787 171.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.85 -57.09 10.91 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 121.914 -0.491 . . . . 0.56999999999999995 111.057 171.557 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -46.81 -47.59 21.0 Favored 'General case' 0 N--CA 1.462 0.158 0 C-N-CA 125.895 1.678 . . . . 0.56999999999999995 111.138 -177.862 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 16.0 tp -48.45 -48.54 37.42 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 125.941 1.696 . . . . 2.6000000000000001 109.595 178.243 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 -82.94 -43.3 16.63 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 110.517 -0.179 . . . . 3.2400000000000002 110.517 -174.297 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -66.87 -38.85 87.12 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 110.527 -0.175 . . . . 2.29 110.527 -173.561 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 56.6 m -106.92 62.55 0.63 Allowed 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 124.537 1.135 . . . . 1.52 108.084 166.905 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -74.95 -41.93 58.66 Favored 'General case' 0 N--CA 1.464 0.265 0 O-C-N 121.799 -0.563 . . . . 5.3099999999999996 109.514 170.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -78.81 148.39 72.4 Favored Pre-proline 0 N--CA 1.45 -0.459 0 C-N-CA 123.741 0.816 . . . . 1.98 111.126 -160.238 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -66.3 130.11 23.18 Favored 'Trans proline' 0 N--CA 1.449 -1.114 0 C-N-CA 123.006 2.471 . . . . 1.3 110.915 -175.146 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 74.4 37.62 0.56 Allowed 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 127.689 2.396 . . . . 2.9700000000000002 110.343 173.317 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 16.1 m -115.71 -6.56 12.14 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.214 1.006 . . . . 0.66000000000000003 112.759 -173.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -80.62 83.42 6.4 Favored 'General case' 0 CA--C 1.535 0.393 0 O-C-N 120.694 -1.254 . . . . 2.2999999999999998 111.248 -160.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -68.17 143.54 96.02 Favored Pre-proline 0 CA--C 1.534 0.332 0 O-C-N 121.596 -0.69 . . . . 2.5699999999999998 110.183 178.143 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -71.6 -62.52 0.04 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.24 0 C-N-CA 122.562 2.175 . . . . 0.65000000000000002 111.883 -175.095 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 37.1 mt-30 -55.07 -46.05 75.38 Favored 'General case' 0 C--O 1.233 0.193 0 C-N-CA 123.254 0.621 . . . . 2.3999999999999999 109.801 179.336 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 42.8 tptt -49.96 -56.64 9.82 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 116.009 -0.541 . . . . 3.2599999999999998 109.786 173.218 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 54.9 t80 -56.26 -50.97 69.84 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 111.534 0.198 . . . . 2.2599999999999998 111.534 179.841 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 31.0 m-85 -56.67 -34.6 67.53 Favored 'General case' 0 CA--C 1.532 0.272 0 O-C-N 121.319 -0.863 . . . . 5.25 112.008 -178.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 5.5 mm-40 -71.93 -58.6 3.32 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 108.568 -0.901 . . . . 3.1699999999999999 108.568 174.567 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -63.99 -25.28 68.06 Favored 'General case' 0 N--CA 1.439 -1.005 0 C-N-CA 123.945 0.898 . . . . 0.65000000000000002 111.839 -169.401 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 18.5 t -85.02 -7.83 58.97 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 126.02 1.728 . . . . 1.48 111.44 179.318 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 86.24 -11.78 62.21 Favored Glycine 0 C--N 1.338 0.674 0 N-CA-C 111.376 -0.69 . . . . 0.69999999999999996 111.376 174.512 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 93.5 mt -54.78 -42.83 72.23 Favored 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 125.516 1.526 . . . . 1.29 111.029 -179.654 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 5.3 t -72.02 -13.5 61.62 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.102 0.561 . . . . 1.8700000000000001 111.977 177.159 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -89.45 -35.94 15.71 Favored 'General case' 0 N--CA 1.452 -0.345 0 O-C-N 121.337 -0.852 . . . . 3.4900000000000002 109.863 174.469 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 59.9 mtt -57.13 152.39 13.57 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 121.603 0.716 . . . . 2.8900000000000001 111.361 174.295 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 23.8 t -78.69 154.76 29.86 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 116.213 -0.449 . . . . 1.99 109.905 174.579 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -41.0 -44.57 2.4 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 125.602 1.561 . . . . 0.56000000000000005 112.129 176.018 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 68.3 m-80 -54.33 -58.22 8.24 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.304 0.642 . . . . 1.5900000000000001 110.339 178.85 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 3.6 mm-40 -59.82 -44.61 93.93 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 123.077 0.551 . . . . 2.6699999999999999 109.849 -179.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.416 ' CG1' ' CZ ' ' A' ' 48' ' ' PHE . 53.1 t -57.91 -43.95 85.59 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 CA-C-O 121.293 0.568 . . . . 0.59999999999999998 109.523 -179.264 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 21.6 tttt -63.27 -48.92 76.14 Favored 'General case' 0 N--CA 1.452 -0.37 0 O-C-N 121.289 -0.882 . . . . 2.98 110.922 176.288 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -51.54 -54.09 31.02 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 118.18 0.446 . . . . 3.0699999999999998 110.671 176.363 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.512 HG12 HG22 ' A' ' 3' ' ' ILE 0.27 17.4 m -54.7 -44.34 70.04 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.206 0 CA-C-O 118.826 -0.607 . . . . 0.57999999999999996 110.984 178.802 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.559 ' CZ ' ' HB3' ' A' ' 103' ' ' PHE . 15.1 m-30 -54.21 -40.39 67.6 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 119.153 0.888 . . . . 5.9400000000000004 112.783 174.343 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 69.7 mtp85 -57.25 -42.02 80.72 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 118.613 0.642 . . . . 2.96 109.947 174.906 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 -68.64 -33.24 73.67 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 118.67 -0.681 . . . . 5.5599999999999996 110.949 176.77 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 14.0 mm -63.65 -59.81 3.72 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 CA-C-O 118.433 -0.794 . . . . 1.5 110.89 175.718 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 55.6 t0 -74.13 71.18 1.63 Allowed 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 119.194 0.906 . . . . 1.8700000000000001 110.554 -175.791 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 27.7 t30 -46.32 -47.24 18.49 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 125.888 1.675 . . . . 1.9199999999999999 111.0 176.617 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -64.39 -19.26 65.38 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 126.639 1.976 . . . . 3.96 112.12 -177.905 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 59.64 12.64 2.97 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 127.08 2.152 . . . . 4.6100000000000003 113.58 178.677 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 3.9 p -70.12 -10.32 58.39 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 113.83 1.048 . . . . 2.21 113.83 -170.138 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 85.71 34.89 12.4 Favored Glycine 0 CA--C 1.529 0.937 0 CA-C-N 118.933 0.788 . . . . 2.4300000000000002 111.968 172.067 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -171.05 143.71 2.01 Favored 'General case' 0 CA--C 1.519 -0.233 0 C-N-CA 127.289 2.235 . . . . 2.75 105.001 175.625 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -102.93 68.54 1.0 Allowed 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 107.309 -1.367 . . . . 2.27 107.309 176.272 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -56.81 146.45 26.16 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.744 1.618 . . . . 1.6699999999999999 110.761 179.362 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -44.89 -51.26 9.84 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 123.512 0.725 . . . . 3.54 112.953 -175.395 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -69.67 -19.62 63.59 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 121.968 -0.457 . . . . 3.2799999999999998 111.917 -173.39 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 91.4 mt-10 -77.64 -44.57 27.77 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-O 121.293 0.568 . . . . 2.3900000000000001 109.598 167.413 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 6.4 tp -53.23 -28.24 26.2 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.644 0.777 . . . . 2.6299999999999999 110.978 174.191 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 30.2 ttpt -50.67 -16.71 0.42 Allowed 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 113.904 1.076 . . . . 2.4700000000000002 113.904 169.326 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 27.5 p90 -127.48 33.93 4.76 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 120.097 1.317 . . . . 5.25 112.634 170.138 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 46.4 t80 -57.76 -67.36 0.34 Allowed 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.649 0.78 . . . . 2.4500000000000002 110.794 178.431 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 2.9 tp -85.38 -9.27 57.79 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.473 -0.767 . . . . 2.3900000000000001 112.066 -175.79 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 49.5 mm-40 -56.0 -18.72 10.11 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.098 0.959 . . . . 1.6100000000000001 111.399 171.405 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -83.04 -16.39 47.22 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 121.196 -0.94 . . . . 3.5499999999999998 111.476 177.969 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 6.3 m-30 -101.16 -53.87 2.92 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 124.674 1.189 . . . . 3.25 108.916 -179.1 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -112.83 161.2 17.21 Favored 'General case' 0 C--O 1.222 -0.371 0 N-CA-C 106.606 -1.627 . . . . 3.3500000000000001 106.606 175.8 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 24.1 m -85.66 -34.62 21.27 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 118.896 0.771 . . . . 2.0800000000000001 110.524 172.629 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -114.48 42.61 1.88 Allowed Glycine 0 CA--C 1.519 0.324 0 N-CA-C 109.568 -1.413 . . . . 1.04 109.568 -170.444 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.08 -171.57 0.92 Allowed 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 120.953 0.406 . . . . 1.28 111.01 177.552 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.7 -13.59 39.31 Favored 'General case' 0 N--CA 1.453 -0.287 0 O-C-N 121.696 -0.628 . . . . 3.0 112.545 -166.112 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -46.47 -40.59 12.64 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 126.842 2.057 . . . . 3.1099999999999999 112.802 -163.445 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.401 HD22 ' H ' ' A' ' 78' ' ' LEU . 0.2 OUTLIER -49.04 -43.1 40.37 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.607 1.163 . . . . 0.81000000000000005 112.144 175.584 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 91.8 m -69.26 104.77 2.31 Favored 'General case' 0 C--O 1.235 0.304 0 O-C-N 121.523 -0.736 . . . . 0.77000000000000002 109.98 175.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -54.77 -41.98 71.14 Favored 'General case' 0 C--O 1.219 -0.542 0 CA-C-N 115.609 -0.723 . . . . 3.0699999999999998 111.671 178.807 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 34.7 t -54.28 -53.91 47.37 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-O 121.463 0.649 . . . . 1.79 111.081 -178.463 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -63.36 -47.67 81.12 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 124.074 0.949 . . . . 2.8900000000000001 108.577 -178.765 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -52.22 -44.91 65.03 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 116.177 -0.465 . . . . 0.55000000000000004 111.229 174.232 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -76.42 -27.3 56.2 Favored 'General case' 0 C--O 1.221 -0.422 0 C-N-CA 124.219 1.007 . . . . 5.0899999999999999 110.718 -175.793 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 24.6 m -61.6 -45.96 91.87 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 119.089 0.859 . . . . 1.5 109.798 168.667 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -59.3 -57.91 10.96 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 110.039 -0.356 . . . . 2.7799999999999998 110.039 172.194 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 22.2 ttp -47.16 -52.64 15.05 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.22 0.608 . . . . 3.0699999999999998 111.366 178.214 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -49.65 -51.37 38.41 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 126.117 1.767 . . . . 0.5 111.537 -172.028 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -78.02 -41.73 34.81 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-O 119.853 -0.118 . . . . 0.48999999999999999 111.294 179.835 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -54.81 -41.36 70.54 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-O 120.682 0.277 . . . . 0.34999999999999998 111.036 179.263 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -77.76 80.96 4.21 Favored 'General case' 0 N--CA 1.445 -0.688 0 C-N-CA 123.245 0.618 . . . . 0.93000000000000005 111.083 -176.574 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 52.8 p-10 -76.26 41.31 0.23 Allowed 'General case' 0 CA--C 1.541 0.633 0 O-C-N 121.405 -0.809 . . . . 2.79 112.16 176.374 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 29.2 m-20 -126.11 -58.98 1.35 Allowed 'General case' 0 C--N 1.342 0.251 0 C-N-CA 126.193 1.797 . . . . 1.25 108.299 172.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 93.94 44.33 3.62 Favored Glycine 0 CA--C 1.53 0.971 0 N-CA-C 109.147 -1.581 . . . . 0.81999999999999995 109.147 -157.304 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 41.0 p-10 -124.87 -47.43 1.8 Allowed 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 124.621 1.168 . . . . 2.0499999999999998 110.318 172.395 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 115.7 -31.24 6.22 Favored Glycine 0 CA--C 1.524 0.638 0 C-N-CA 124.618 1.104 . . . . 0.64000000000000001 111.227 170.655 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 21.5 pttp -69.34 114.22 7.39 Favored 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 107.692 -1.225 . . . . 5.1600000000000001 107.692 168.715 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 19.7 mt -103.83 115.57 46.02 Favored 'Isoleucine or valine' 0 C--O 1.231 0.13 0 C-N-CA 123.551 0.74 . . . . 0.66000000000000003 109.36 -171.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -72.28 162.15 54.48 Favored Glycine 0 CA--C 1.534 1.267 0 CA-C-O 121.831 0.684 . . . . 0.55000000000000004 112.143 172.463 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -57.11 -40.09 76.38 Favored 'General case' 0 C--O 1.226 -0.184 0 O-C-N 121.78 -0.835 . . . . 0.59999999999999998 109.673 172.106 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -56.19 -54.18 48.23 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.978 0.911 . . . . 2.5699999999999998 110.274 177.262 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -51.66 -50.53 60.19 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.079 0.952 . . . . 1.27 110.422 176.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . 0.559 ' HB3' ' CZ ' ' A' ' 48' ' ' PHE . 3.4 m-85 -61.12 -44.22 97.68 Favored 'General case' 0 CA--C 1.534 0.364 0 O-C-N 121.87 -0.519 . . . . 3.7799999999999998 111.709 177.847 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 30.9 tt0 -57.42 -49.83 74.95 Favored 'General case' 0 C--O 1.222 -0.384 0 N-CA-C 108.796 -0.816 . . . . 2.0699999999999998 108.796 178.877 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -47.01 -60.39 2.48 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 123.521 0.729 . . . . 3.2400000000000002 110.548 172.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.22 -43.42 98.87 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 120.378 -0.529 . . . . 2.8500000000000001 110.976 -172.257 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 66.2 t -64.23 -38.93 83.78 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.428 0 CA-C-O 119.306 -0.378 . . . . 1.01 111.227 176.596 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 79.5 t60 -66.42 -22.48 66.23 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 124.376 1.07 . . . . 2.6000000000000001 110.055 -173.899 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 22.7 t . . . . . 0 C--O 1.253 1.273 0 CA-C-O 115.343 -2.265 . . . . 2.5800000000000001 112.986 176.886 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.689 HG22 HG12 ' A' ' 47' ' ' VAL . 1.3 pp . . . . . 0 CA--C 1.543 0.679 0 N-CA-C 112.662 0.615 . . . . 1.22 112.662 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 14.8 t -68.89 -7.06 31.22 Favored 'General case' 0 N--CA 1.429 -1.491 0 C-N-CA 127.866 2.466 . . . . 1.8200000000000001 112.812 -177.241 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 47.1 t0 -153.11 44.34 0.64 Allowed 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.438 1.495 . . . . 2.54 108.891 -177.766 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 13.2 t -128.29 -59.14 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.339 0.133 0 C-N-CA 126.171 1.788 . . . . 1.55 108.936 174.49 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -172.54 -47.55 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.14 0 N-CA-C 106.986 -1.487 . . . . 1.29 106.986 -175.194 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 2.4 m -48.15 -32.66 7.24 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 114.46 1.282 . . . . 0.93999999999999995 114.46 -175.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -51.19 -40.72 59.3 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 119.363 0.983 . . . . 0.84999999999999998 113.218 174.818 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -76.04 -37.15 58.67 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 121.54 0.686 . . . . 2.1699999999999999 109.791 177.854 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 23.2 m-20 -57.47 -52.31 65.9 Favored 'General case' 0 C--O 1.234 0.278 0 C-N-CA 124.083 0.953 . . . . 2.5899999999999999 108.569 -179.43 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 28.3 pt -61.8 -39.3 82.9 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.278 0 CA-C-N 115.352 -0.84 . . . . 0.72999999999999998 109.929 -178.131 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -54.23 -44.68 71.91 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 118.267 0.485 . . . . 0.66000000000000003 111.045 174.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.96 -59.14 5.24 Favored 'General case' 0 CA--C 1.53 0.185 0 O-C-N 121.908 -0.495 . . . . 0.64000000000000001 110.84 174.495 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -48.79 -46.06 41.05 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 124.132 0.973 . . . . 0.63 112.015 -177.56 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -50.11 -44.07 52.02 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 125.369 1.468 . . . . 2.7799999999999998 109.346 177.52 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 13.7 mt-30 -85.09 -30.19 24.26 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-O 118.285 -0.864 . . . . 2.8199999999999998 112.623 -178.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -74.33 -25.56 59.62 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 119.956 1.253 . . . . 2.4300000000000002 111.207 -179.66 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 91.6 m -128.16 46.51 2.56 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.037 1.335 . . . . 1.4199999999999999 110.009 177.419 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.67 -40.43 63.7 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 119.048 0.84 . . . . 6.5599999999999996 109.309 171.769 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -62.18 133.96 94.42 Favored Pre-proline 0 N--CA 1.445 -0.702 0 C-N-CA 124.756 1.222 . . . . 3.0600000000000001 108.151 -171.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 55.1 Cg_endo -60.17 142.83 99.16 Favored 'Trans proline' 0 N--CA 1.448 -1.189 0 C-N-CA 121.957 1.771 . . . . 1.3300000000000001 109.751 -174.128 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 69.45 21.73 6.74 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.905 0.882 . . . . 3.3199999999999998 111.615 170.049 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.1 m -113.81 11.02 17.89 Favored 'General case' 0 C--N 1.347 0.458 0 C-N-CA 125.142 1.377 . . . . 0.94999999999999996 112.148 -179.531 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -84.98 114.16 21.95 Favored 'General case' 0 C--O 1.232 0.143 0 N-CA-C 107.863 -1.162 . . . . 2.2799999999999998 107.863 179.76 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -110.78 149.05 39.79 Favored Pre-proline 0 CA--C 1.534 0.331 0 C-N-CA 124.264 1.026 . . . . 2.7599999999999998 109.473 174.319 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_endo -65.7 -73.34 0.02 OUTLIER 'Trans proline' 0 N--CA 1.452 -0.917 0 C-N-CA 123.353 2.702 . . . . 0.68999999999999995 111.614 -173.578 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -49.73 -43.79 48.0 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 124.964 1.306 . . . . 2.54 110.772 -179.858 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.53 -64.57 0.77 Allowed 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 125.834 1.654 . . . . 2.7999999999999998 110.454 175.81 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 65.8 t80 -58.14 -43.51 87.35 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-O 122.85 1.31 . . . . 2.0099999999999998 110.981 -179.795 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.518 ' CE1' ' HA ' ' A' ' 107' ' ' VAL . 3.8 t80 -52.16 -51.57 57.18 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.117 0.967 . . . . 4.6500000000000004 112.1 178.485 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 30.1 mt-30 -72.56 -36.81 68.31 Favored 'General case' 0 N--CA 1.45 -0.43 0 O-C-N 121.431 -0.793 . . . . 3.8100000000000001 110.724 176.901 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -64.14 -41.18 97.3 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-N 119.139 0.881 . . . . 1.3700000000000001 110.983 -176.559 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 11.5 p -62.3 -50.3 72.19 Favored 'General case' 0 N--CA 1.441 -0.895 0 N-CA-C 106.777 -1.564 . . . . 2.8999999999999999 106.777 173.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 102.39 20.58 11.9 Favored Glycine 0 CA--C 1.521 0.464 0 N-CA-C 109.619 -1.392 . . . . 1.72 109.619 -176.829 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 32.5 mt -60.08 -24.81 64.91 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 121.866 -0.785 . . . . 1.46 109.772 168.809 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 22.8 t -62.05 -24.78 67.29 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 123.459 0.704 . . . . 2.4100000000000001 110.52 173.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -92.83 -24.74 18.4 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 123.006 0.522 . . . . 4.29 109.831 178.457 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 21.1 mmt -66.85 144.88 56.02 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 121.674 0.749 . . . . 3.8300000000000001 111.141 176.387 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 8.5 t -75.01 156.26 36.44 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.983 -0.553 . . . . 2.02 109.512 179.336 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -45.53 -43.35 11.76 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 124.335 1.054 . . . . 0.59999999999999998 111.435 176.447 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -49.96 -62.85 1.33 Allowed 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.66 0.784 . . . . 2.8700000000000001 110.587 175.339 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 1.7 mm-40 -56.25 -46.45 79.63 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 122.983 0.513 . . . . 3.1899999999999999 109.924 -179.315 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 78.4 t -58.4 -38.67 71.07 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.646 0 O-C-N 122.07 -0.394 . . . . 0.54000000000000004 110.419 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 14.7 tptt -68.68 -44.26 74.39 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 121.182 -0.948 . . . . 4.21 111.091 176.898 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 73.6 m-20 -59.09 -53.43 58.47 Favored 'General case' 0 C--O 1.232 0.163 0 N-CA-C 109.767 -0.457 . . . . 2.8999999999999999 109.767 178.85 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.689 HG12 HG22 ' A' ' 3' ' ' ILE . 7.8 m -58.2 -43.75 86.36 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 N-CA-C 109.505 -0.554 . . . . 0.65000000000000002 109.505 176.907 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.439 ' CE1' ' HB2' ' A' ' 100' ' ' ALA . 7.7 t80 -49.19 -48.69 45.01 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 118.482 0.583 . . . . 4.1600000000000001 111.019 175.274 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 73.2 mtp180 -58.73 -37.68 76.71 Favored 'General case' 0 CA--C 1.532 0.266 0 O-C-N 121.684 -0.635 . . . . 4.0199999999999996 112.432 177.583 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 9.8 m-85 -62.7 -33.71 75.66 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 118.497 0.589 . . . . 3.5699999999999998 110.18 174.122 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.3 mm -73.59 -47.14 45.97 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 CA-C-O 118.707 -0.663 . . . . 1.54 110.407 -179.303 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 20.1 t0 -73.32 65.29 0.85 Allowed 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 118.898 0.772 . . . . 1.8999999999999999 108.969 176.445 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 10.8 t30 -58.29 -36.17 72.91 Favored 'General case' 0 C--N 1.332 -0.179 0 C-N-CA 125.104 1.361 . . . . 2.29 111.863 -170.598 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -73.38 -20.06 60.85 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.438 1.095 . . . . 2.5499999999999998 111.955 175.782 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 14.0 mt-30 53.87 72.09 0.47 Allowed 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.831 1.652 . . . . 3.1099999999999999 110.954 -175.016 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 89.4 p -105.72 -28.97 10.37 Favored 'General case' 0 C--N 1.34 0.171 0 C-N-CA 123.824 0.849 . . . . 1.4099999999999999 111.909 174.609 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 87.74 7.41 74.97 Favored Glycine 0 CA--C 1.532 1.096 0 CA-C-O 119.398 -0.668 . . . . 1.53 112.063 -167.513 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 16.2 m-85 -134.11 133.57 41.23 Favored 'General case' 0 C--O 1.233 0.218 0 N-CA-C 108.214 -1.032 . . . . 2.5 108.214 164.526 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -93.33 80.58 4.42 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 126.689 1.995 . . . . 1.9399999999999999 105.809 163.716 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -63.65 153.73 35.13 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 114.393 -1.276 . . . . 1.9299999999999999 109.431 169.568 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -50.41 -46.1 56.08 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 124.345 1.058 . . . . 3.79 112.252 -173.15 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.5 tm-20 -59.56 -46.1 89.88 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 123.293 0.637 . . . . 3.6099999999999999 110.355 -177.059 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 90.3 mt-10 -59.17 -43.79 92.13 Favored 'General case' 0 N--CA 1.451 -0.425 0 O-C-N 121.763 -0.585 . . . . 2.1499999999999999 110.129 175.886 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -58.25 -37.63 75.31 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 122.289 -0.257 . . . . 2.2000000000000002 110.607 175.559 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 21.0 ttmt -58.77 -12.32 4.18 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.966 0.906 . . . . 3.0 112.968 172.287 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 9.0 t80 -123.08 28.21 7.27 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.573 1.149 . . . . 5.0599999999999996 110.47 173.176 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -66.06 -74.63 0.1 Allowed 'General case' 0 CA--C 1.53 0.181 0 O-C-N 121.247 -0.908 . . . . 2.6499999999999999 110.604 -179.764 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.484 HD22 ' HB2' ' A' ' 75' ' ' ALA . 0.4 OUTLIER -68.01 -17.2 64.35 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 121.619 -0.675 . . . . 2.9199999999999999 110.999 -164.592 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 78.0 mm-40 -51.03 -21.63 1.91 Allowed 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.911 1.684 . . . . 1.8799999999999999 112.354 166.125 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 1.9 mmpt? -80.07 -25.35 40.09 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 121.07 -1.019 . . . . 3.1499999999999999 111.385 176.077 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 16.6 m-30 -94.07 -62.7 1.3 Allowed 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 125.435 1.494 . . . . 3.1000000000000001 109.551 -179.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -105.65 -178.91 3.79 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 125.983 1.713 . . . . 2.9900000000000002 107.864 -179.276 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 20.0 m -124.04 47.45 2.06 Favored 'General case' 0 N--CA 1.461 0.101 0 C-N-CA 123.123 0.569 . . . . 2.5 111.088 177.535 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 154.18 59.39 0.01 OUTLIER Glycine 0 CA--C 1.519 0.343 0 N-CA-C 110.019 -1.232 . . . . 1.1599999999999999 110.019 179.147 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.573 ' HB3' ' OE2' ' A' ' 77' ' ' GLU . . . -91.1 -142.41 0.18 Allowed 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 108.558 -0.904 . . . . 1.6399999999999999 108.558 175.104 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -123.26 41.69 3.4 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 123.91 0.884 . . . . 5.0199999999999996 110.659 -175.831 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.573 ' OE2' ' HB3' ' A' ' 75' ' ' ALA . 4.2 mp0 -77.06 -36.84 55.64 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 125.296 1.439 . . . . 4.7800000000000002 109.028 177.557 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.487 HD22 ' H ' ' A' ' 78' ' ' LEU . 0.2 OUTLIER -52.99 -44.85 67.53 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 114.75 -1.114 . . . . 0.98999999999999999 110.54 178.026 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 23.8 m -67.87 113.47 5.63 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 121.7 0.762 . . . . 1.02 110.43 179.55 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -58.75 -41.95 87.71 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-N 114.737 -1.12 . . . . 2.8399999999999999 111.002 177.591 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 15.8 m -47.66 -60.21 2.72 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 119.066 0.848 . . . . 1.3799999999999999 111.318 173.634 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.74 -40.39 79.86 Favored 'General case' 0 N--CA 1.454 -0.229 0 O-C-N 121.896 -0.503 . . . . 3.4100000000000001 109.932 -171.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 1.1 m -53.28 -47.74 68.92 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-O 122.06 0.933 . . . . 0.66000000000000003 108.89 171.303 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 33.5 tttp -70.14 -27.77 64.82 Favored 'General case' 0 N--CA 1.44 -0.973 0 C-N-CA 124.236 1.014 . . . . 4.9000000000000004 111.473 -174.761 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 52.5 m -55.94 -47.91 76.7 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 120.195 1.362 . . . . 1.3100000000000001 109.998 168.189 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 9.0 mt -60.76 -58.21 9.43 Favored 'General case' 0 C--O 1.233 0.226 0 N-CA-C 109.47 -0.567 . . . . 2.2599999999999998 109.47 172.612 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 2.6 ttp -46.96 -43.6 19.33 Favored 'General case' 0 CA--C 1.535 0.366 0 O-C-N 123.528 0.517 . . . . 3.48 112.39 -178.092 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -56.45 -45.92 80.58 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 125.886 1.675 . . . . 0.62 111.668 -173.34 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -84.91 -44.6 13.02 Favored 'General case' 0 CA--C 1.521 -0.137 0 N-CA-C 110.575 -0.157 . . . . 0.68000000000000005 110.575 178.51 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -55.99 -45.4 79.02 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 122.706 0.403 . . . . 0.35999999999999999 110.483 -176.644 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -73.75 77.8 1.56 Allowed 'General case' 0 N--CA 1.448 -0.566 0 CA-C-O 121.274 0.559 . . . . 0.93000000000000005 109.571 177.325 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -76.19 45.48 0.37 Allowed 'General case' 0 CA--C 1.538 0.496 0 O-C-N 121.477 -0.764 . . . . 2.7000000000000002 111.827 178.286 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 62.5 m-20 -135.37 -58.93 0.78 Allowed 'General case' 0 C--N 1.338 0.07 0 C-N-CA 125.463 1.505 . . . . 1.5700000000000001 109.278 -177.517 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 103.26 45.67 1.54 Allowed Glycine 0 CA--C 1.532 1.106 0 N-CA-C 110.025 -1.23 . . . . 0.87 110.025 -163.329 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -124.6 -61.89 1.29 Allowed 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 125.078 1.351 . . . . 1.97 109.687 171.085 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 127.43 -24.28 5.3 Favored Glycine 0 CA--C 1.529 0.948 0 C-N-CA 124.678 1.133 . . . . 0.69999999999999996 111.563 177.733 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 40.0 mtpt -80.71 114.08 19.34 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 106.823 -1.547 . . . . 4.21 106.823 175.544 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 5.5 mt -95.16 153.6 3.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 N-CA-C 107.232 -1.395 . . . . 0.87 107.232 -178.09 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -132.03 -179.35 16.14 Favored Glycine 0 CA--C 1.522 0.47 0 N-CA-C 108.903 -1.679 . . . . 0.75 108.903 175.853 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . 0.439 ' HB2' ' CE1' ' A' ' 48' ' ' PHE . . . -66.06 -36.79 84.18 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 117.601 0.701 . . . . 0.69999999999999996 110.404 -177.242 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 -60.02 -59.13 5.9 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-O 118.797 -0.62 . . . . 2.5099999999999998 110.13 173.594 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -52.24 -47.98 65.44 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-O 121.767 0.794 . . . . 1.4299999999999999 110.648 -179.664 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 58.7 t80 -62.46 -54.22 43.34 Favored 'General case' 0 N--CA 1.454 -0.27 0 O-C-N 121.821 -0.55 . . . . 3.6000000000000001 110.363 -178.205 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 46.7 tt0 -55.44 -46.44 76.73 Favored 'General case' 0 C--O 1.22 -0.497 0 CA-C-O 118.294 -0.86 . . . . 2.1699999999999999 110.613 177.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -51.96 -58.88 5.19 Favored 'General case' 0 CA--C 1.522 -0.126 0 CA-C-N 119.462 1.028 . . . . 3.0899999999999999 110.075 176.67 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -55.8 -47.21 77.52 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 109.44 -0.578 . . . . 4.7300000000000004 109.44 -179.475 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' VAL . . . . . 0.518 ' HA ' ' CE1' ' A' ' 31' ' ' PHE . 76.1 t -75.35 -6.06 8.08 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.795 0 C-N-CA 124.293 1.037 . . . . 1.3999999999999999 112.552 -177.284 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 6.6 t60 -90.15 -11.58 40.75 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 120.086 -1.634 . . . . 2.7200000000000002 110.221 173.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 28.5 t . . . . . 0 C--O 1.252 1.219 0 CA-C-O 114.935 -2.459 . . . . 2.3100000000000001 114.016 -174.109 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.484 HG22 HG12 ' A' ' 47' ' ' VAL . 1.7 pp . . . . . 0 N--CA 1.465 0.289 0 CA-C-O 121.65 0.738 . . . . 1.21 111.942 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 12.9 t -65.91 -15.38 62.9 Favored 'General case' 0 N--CA 1.422 -1.844 0 C-N-CA 126.879 2.071 . . . . 1.96 111.616 -174.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 36.6 t0 -134.0 44.72 2.7 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.914 0.886 . . . . 2.8599999999999999 109.537 -179.326 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 20.1 t -121.02 -61.82 2.09 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.229 0 C-N-CA 124.912 1.285 . . . . 1.5800000000000001 109.4 177.636 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 9.1 tp -171.95 -61.55 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 104.991 -2.226 . . . . 1.6699999999999999 104.991 -174.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -33.03 -37.83 0.03 OUTLIER 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 128.921 2.888 . . . . 1.2 115.8 -173.213 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -51.27 -41.12 60.18 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 118.94 0.791 . . . . 0.80000000000000004 112.893 179.54 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.3 t0 -68.2 -45.5 73.17 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 122.86 1.314 . . . . 1.8999999999999999 108.56 177.027 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -62.62 -47.63 82.9 Favored 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 125.143 1.377 . . . . 2.5099999999999998 109.34 -170.171 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 26.6 pt -60.57 -38.28 77.8 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.877 0 C-N-CA 123.188 0.595 . . . . 0.96999999999999997 111.394 176.402 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.84 -44.72 93.94 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 118.34 0.518 . . . . 1.0700000000000001 110.045 177.484 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.85 -54.76 43.52 Favored 'General case' 0 C--O 1.234 0.247 0 O-C-N 122.174 -0.328 . . . . 0.89000000000000001 110.471 172.055 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -48.55 -46.49 39.01 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 124.549 1.14 . . . . 0.71999999999999997 111.272 -177.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -54.32 -43.44 71.17 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 124.6 1.16 . . . . 3.75 109.65 -179.475 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -77.99 -49.27 14.39 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 109.699 -0.482 . . . . 2.9700000000000002 109.699 -176.096 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -59.69 -33.2 71.29 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 122.025 0.13 . . . . 3.2000000000000002 110.904 -175.205 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 75.0 m -107.98 36.91 2.6 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 124.796 1.238 . . . . 1.3400000000000001 110.493 177.359 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 53.7 ttt-85 -78.93 -30.86 44.91 Favored 'General case' 0 C--O 1.234 0.242 0 O-C-N 121.364 -0.835 . . . . 5.3600000000000003 109.964 179.155 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 61.3 m-20 -74.27 144.87 82.18 Favored Pre-proline 0 CA--C 1.539 0.551 0 C-N-CA 123.789 0.836 . . . . 2.0499999999999998 109.613 177.212 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -64.31 140.79 72.18 Favored 'Trans proline' 0 N--CA 1.456 -0.68 0 C-N-CA 123.505 2.803 . . . . 1.3300000000000001 111.02 -176.087 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 62.73 10.83 4.45 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.084 1.353 . . . . 2.4100000000000001 113.184 177.356 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 29.3 m -92.7 16.21 12.76 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.299 1.44 . . . . 1.1200000000000001 110.957 -177.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 7.4 t80 -99.86 112.47 24.74 Favored 'General case' 0 N--CA 1.444 -0.764 0 N-CA-C 106.767 -1.568 . . . . 2.6800000000000002 106.767 179.693 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -104.42 147.64 34.7 Favored Pre-proline 0 C--O 1.235 0.303 0 N-CA-C 108.257 -1.016 . . . . 4.8600000000000003 108.257 167.598 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -62.05 -62.67 0.11 Allowed 'Trans proline' 0 N--CA 1.451 -1.015 0 C-N-CA 122.88 2.387 . . . . 0.56999999999999995 111.176 -176.013 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 48.9 mt-30 -59.0 -40.63 85.5 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 123.177 0.591 . . . . 2.2000000000000002 110.937 -173.684 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -50.45 -69.41 0.11 Allowed 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.54 1.136 . . . . 4.96 108.966 169.817 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 80.8 t80 -53.65 -43.39 68.77 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 123.583 0.753 . . . . 2.46 112.183 -175.216 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -50.59 -59.07 4.42 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 127.325 2.25 . . . . 4.7800000000000002 109.983 177.093 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.73 -48.0 76.2 Favored 'General case' 0 N--CA 1.445 -0.693 0 N-CA-C 107.972 -1.121 . . . . 3.79 107.972 -177.072 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -63.35 -35.74 81.4 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 123.514 0.726 . . . . 0.68999999999999995 112.914 -171.682 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 43.5 m -76.49 2.65 13.16 Favored 'General case' 0 N--CA 1.449 -0.518 0 O-C-N 123.705 0.628 . . . . 2.0600000000000001 110.803 176.87 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 79.62 9.42 86.86 Favored Glycine 0 C--N 1.339 0.73 0 N-CA-C 110.951 -0.859 . . . . 0.69999999999999996 110.951 169.258 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 50.0 mt -73.91 -24.06 59.63 Favored 'General case' 0 N--CA 1.441 -0.879 0 O-C-N 121.378 -1.072 . . . . 1.4199999999999999 109.818 -172.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 26.3 p -66.29 -25.69 66.97 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.34 0.656 . . . . 2.5699999999999998 111.063 168.853 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 13.1 tptt -86.27 -34.09 20.48 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 108.175 -1.046 . . . . 3.8100000000000001 108.175 -177.726 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.4 ' O ' ' CB ' ' A' ' 40' ' ' SER . 36.2 mtt -47.67 -66.88 0.33 Allowed 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 114.702 1.371 . . . . 3.7000000000000002 114.702 -177.064 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . 0.4 ' CB ' ' O ' ' A' ' 39' ' ' MET . 42.1 t 113.99 139.93 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 128.714 2.806 . . . . 1.9399999999999999 108.021 -172.788 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -37.22 -40.34 0.32 Allowed 'General case' 0 C--N 1.341 0.217 0 C-N-CA 125.206 1.402 . . . . 0.73999999999999999 112.688 173.695 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 60.8 m-80 -56.9 -61.37 2.49 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-O 122.028 0.918 . . . . 2.1099999999999999 109.703 -179.031 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.453 ' O ' HG13 ' A' ' 47' ' ' VAL . 28.8 tt0 -70.43 -35.57 73.46 Favored 'General case' 0 N--CA 1.439 -1.002 0 CA-C-N 115.165 -0.925 . . . . 3.2400000000000002 109.558 -176.244 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 51.8 t -59.26 -49.31 83.91 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.67 0 CA-C-N 119.063 0.847 . . . . 0.56000000000000005 108.994 178.653 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -55.08 -46.78 75.49 Favored 'General case' 0 N--CA 1.455 -0.221 0 O-C-N 121.361 -0.837 . . . . 2.8199999999999998 110.608 173.31 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 33.7 t0 -56.2 -55.36 34.08 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 118.076 0.398 . . . . 2.4700000000000002 110.778 178.597 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.484 HG12 HG22 ' A' ' 3' ' ' ILE . 3.1 m -52.79 -44.4 47.75 Favored 'Isoleucine or valine' 0 C--N 1.342 0.27 0 CA-C-O 118.983 -0.532 . . . . 0.79000000000000004 110.304 179.468 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 16.0 m-30 -49.98 -39.71 41.82 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 118.535 0.607 . . . . 5.6500000000000004 112.067 177.109 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 69.0 mtp180 -58.89 -30.17 67.58 Favored 'General case' 0 CA--C 1.532 0.259 0 O-C-N 121.195 -0.941 . . . . 3.2200000000000002 111.989 179.145 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 18.1 t80 -70.02 -25.14 63.44 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.503 0.721 . . . . 4.0099999999999998 110.919 178.054 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.438 HG21 ' CD1' ' A' ' 67' ' ' PHE . 4.1 mp -125.69 99.61 6.08 Favored 'Isoleucine or valine' 0 C--N 1.342 0.266 0 C-N-CA 124.066 0.946 . . . . 2.6600000000000001 111.206 -177.02 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 57.0 t0 -155.99 -49.04 0.08 Allowed 'General case' 0 C--O 1.223 -0.338 0 C-N-CA 125.979 1.712 . . . . 3.8999999999999999 106.388 166.56 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 17.6 t-20 97.62 -52.88 0.01 OUTLIER 'General case' 0 C--N 1.34 0.195 0 C-N-CA 128.31 2.644 . . . . 4.8700000000000001 107.825 -178.128 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 40.6 m-20 -56.88 -46.22 82.03 Favored 'General case' 0 CA--C 1.528 0.107 0 CA-C-O 121.455 0.645 . . . . 2.9900000000000002 110.24 169.201 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 59.26 63.32 1.61 Allowed 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 114.468 -1.242 . . . . 3.9900000000000002 109.491 -152.569 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 98.0 p -103.22 -43.69 5.39 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 127.185 2.194 . . . . 2.4700000000000002 110.424 178.821 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 108.97 -11.73 34.5 Favored Glycine 0 CA--C 1.534 1.23 0 C-N-CA 124.591 1.091 . . . . 1.8100000000000001 111.626 -166.447 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 76.6 m-85 -100.51 115.44 30.11 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 124.698 1.199 . . . . 3.3399999999999999 109.187 175.412 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -87.43 81.51 7.8 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 125.889 1.676 . . . . 1.8700000000000001 106.855 167.101 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -63.59 144.14 57.25 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 114.306 -1.316 . . . . 1.3799999999999999 109.19 174.674 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -40.26 -51.35 2.73 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 125.247 1.419 . . . . 3.48 113.95 -171.056 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -71.57 -22.27 61.76 Favored 'General case' 0 N--CA 1.452 -0.325 0 O-C-N 121.274 -0.891 . . . . 3.54 112.14 -173.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 89.0 mt-10 -67.9 -38.42 82.96 Favored 'General case' 0 N--CA 1.456 -0.171 0 O-C-N 120.725 -1.235 . . . . 2.0899999999999999 108.694 169.29 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -51.02 -47.35 61.67 Favored 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 109.231 -0.655 . . . . 2.6200000000000001 109.231 171.714 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 29.3 ttpt -54.99 -13.57 1.17 Allowed 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 114.466 1.284 . . . . 2.3199999999999998 114.466 176.234 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 78.8 m-85 -124.03 10.21 8.79 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 119.876 1.217 . . . . 5.3499999999999996 112.289 173.61 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.438 ' CD1' HG21 ' A' ' 51' ' ' ILE . 85.5 t80 -49.76 -64.51 0.79 Allowed 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.89 1.276 . . . . 2.77 111.548 -169.321 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 70.2 mt -65.2 -12.86 55.7 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 113.443 0.905 . . . . 2.4199999999999999 113.443 -176.79 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 11.1 mm-40 -61.31 -30.66 70.64 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 120.458 1.481 . . . . 1.6699999999999999 110.505 -179.796 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.9 mptm? -59.74 -30.03 68.56 Favored 'General case' 0 CA--C 1.531 0.247 0 O-C-N 122.157 -0.339 . . . . 2.8399999999999999 111.897 172.344 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 9.4 m-30 -86.75 -53.75 4.76 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 123.305 0.642 . . . . 3.1000000000000001 109.659 -179.438 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -143.22 123.29 13.63 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.275 1.03 . . . . 3.7000000000000002 108.493 -174.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 79.8 p -44.7 -37.12 3.5 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 126.423 1.889 . . . . 2.3999999999999999 112.26 174.585 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -106.4 28.44 13.54 Favored Glycine 0 CA--C 1.525 0.669 0 C-N-CA 125.883 1.706 . . . . 1.48 111.946 -172.649 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -71.42 -165.85 0.16 Allowed 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 117.956 0.878 . . . . 1.4199999999999999 111.681 174.546 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 6.0 tpt180 -113.48 -9.75 13.27 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 115.626 1.713 . . . . 3.1099999999999999 115.626 -158.412 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 55.1 mm-40 -59.35 -6.9 1.11 Allowed 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 114.06 1.133 . . . . 4.5700000000000003 114.06 -175.827 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.576 HD22 ' H ' ' A' ' 78' ' ' LEU . 0.9 OUTLIER -57.31 -39.97 76.92 Favored 'General case' 0 N--CA 1.446 -0.673 0 O-C-N 121.105 -0.997 . . . . 1.3400000000000001 110.562 171.922 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 4.1 m -76.84 129.95 36.95 Favored 'General case' 0 C--N 1.345 0.385 0 C-N-CA 118.987 -1.085 . . . . 0.95999999999999996 109.875 177.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -65.45 -43.81 89.22 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-N 115.285 -0.87 . . . . 3.25 110.677 177.497 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 73.7 m -50.11 -62.86 1.33 Allowed 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 119.41 1.005 . . . . 1.1799999999999999 111.761 171.755 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -54.09 -42.51 69.45 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 118.207 0.458 . . . . 2.9399999999999999 111.074 -177.532 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 5.8 m -57.7 -53.62 56.08 Favored 'General case' 0 C--N 1.34 0.179 0 CA-C-O 121.913 0.863 . . . . 0.89000000000000001 109.785 173.824 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 8.5 tptt -58.67 -38.58 78.48 Favored 'General case' 0 N--CA 1.445 -0.722 0 C-N-CA 125.91 1.684 . . . . 3.9700000000000002 110.591 -170.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 67.4 m -52.1 -46.99 65.49 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 118.988 0.813 . . . . 1.25 111.696 170.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -65.66 -56.38 12.44 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 108.298 -1.001 . . . . 2.2200000000000002 108.298 177.542 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 3.5 ttp -45.3 -45.27 12.08 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.456 0.702 . . . . 3.4300000000000002 111.991 178.628 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -58.84 -43.57 90.78 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 126.086 1.755 . . . . 0.67000000000000004 112.21 -171.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -90.27 -31.66 16.88 Favored 'General case' 0 N--CA 1.461 0.098 0 C-N-CA 122.552 0.341 . . . . 0.64000000000000001 111.45 -179.694 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -62.05 -48.56 79.69 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 123.025 0.53 . . . . 0.34000000000000002 110.675 175.525 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -71.24 114.41 9.28 Favored 'General case' 0 N--CA 1.446 -0.626 0 N-CA-C 108.856 -0.794 . . . . 1.01 108.856 178.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 8.0 m-80 -110.22 37.14 2.8 Favored 'General case' 0 N--CA 1.463 0.202 0 N-CA-C 109.661 -0.496 . . . . 3.1000000000000001 109.661 -179.135 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 32.9 m-20 -119.06 -47.53 2.48 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 125.093 1.357 . . . . 1.4299999999999999 110.195 173.333 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 89.75 41.56 5.63 Favored Glycine 0 CA--C 1.53 0.989 0 N-CA-C 108.672 -1.771 . . . . 0.87 108.672 -155.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -121.94 -55.03 1.91 Allowed 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.363 1.065 . . . . 2.6899999999999999 110.134 -179.861 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 121.44 -38.15 2.74 Favored Glycine 0 CA--C 1.527 0.828 0 C-N-CA 124.19 0.9 . . . . 0.69999999999999996 111.253 176.78 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 77.9 mttt -69.58 121.87 17.95 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 107.384 -1.339 . . . . 4.1600000000000001 107.384 176.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 9.0 mt -105.71 127.65 60.49 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.323 0 N-CA-C 108.603 -0.888 . . . . 0.70999999999999996 108.603 -173.728 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -85.11 158.88 33.46 Favored Glycine 0 CA--C 1.528 0.905 0 N-CA-C 110.387 -1.085 . . . . 0.55000000000000004 110.387 169.688 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -51.27 -34.82 34.52 Favored 'General case' 0 C--N 1.34 0.176 0 O-C-N 122.044 -0.68 . . . . 0.80000000000000004 109.896 167.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 25.8 tt0 -61.67 -62.27 1.92 Allowed 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 123.57 0.748 . . . . 2.48 110.67 179.021 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -44.57 -48.61 10.31 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.164 0.985 . . . . 2.1899999999999999 110.167 172.613 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -65.72 -42.05 91.53 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 115.956 -0.566 . . . . 2.7599999999999998 111.522 -175.682 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 12.4 tt0 -61.19 -43.8 98.3 Favored 'General case' 0 C--O 1.222 -0.38 0 CA-C-O 118.166 -0.921 . . . . 2.7200000000000002 108.962 173.697 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -54.15 -53.16 57.2 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 120.032 1.287 . . . . 3.1200000000000001 110.916 176.57 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.97 -54.42 47.15 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 108.449 -0.945 . . . . 2.7000000000000002 108.449 -179.026 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 92.5 t -74.9 -15.74 16.04 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 CA-C-N 115.308 -0.86 . . . . 1.5600000000000001 112.866 -169.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 3.0 t60 -98.15 3.86 49.05 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 120.423 -1.423 . . . . 2.6200000000000001 111.186 175.521 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 31.3 t . . . . . 0 C--O 1.254 1.297 0 CA-C-O 115.995 -1.955 . . . . 2.3999999999999999 111.37 179.491 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.61 HG22 HG12 ' A' ' 47' ' ' VAL . 1.2 pp . . . . . 0 CA--C 1.539 0.538 0 CA-C-O 121.119 0.485 . . . . 1.78 110.275 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 2.8 t -82.44 52.37 2.04 Favored 'General case' 0 N--CA 1.438 -1.063 0 C-N-CA 125.979 1.712 . . . . 3.0899999999999999 108.919 179.885 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -174.64 -50.89 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.126 0 C-N-CA 125.026 1.33 . . . . 3.1099999999999999 108.394 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 24.2 t -51.08 -46.71 31.52 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 C-N-CA 124.144 0.978 . . . . 1.8600000000000001 111.683 -177.734 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 11.7 tp -164.34 -58.47 0.03 OUTLIER 'General case' 0 CA--C 1.517 -0.305 0 N-CA-C 106.901 -1.518 . . . . 1.6200000000000001 106.901 -177.229 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 2.3 m -49.26 -26.08 2.76 Favored 'General case' 0 C--O 1.215 -0.747 0 CA-C-O 117.785 -1.103 . . . . 0.98999999999999999 112.948 -171.382 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -36.86 -48.46 0.75 Allowed 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 114.402 1.26 . . . . 1.0600000000000001 114.402 168.741 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -70.17 -44.39 68.89 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-O 122.69 1.233 . . . . 2.0899999999999999 109.375 -179.825 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -64.0 -41.57 97.44 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 124.612 1.165 . . . . 2.6000000000000001 110.434 -173.365 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 45.8 pt -60.6 -39.74 82.38 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.811 0 O-C-N 121.289 -0.882 . . . . 1.4399999999999999 110.299 175.153 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.16 -41.16 99.21 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 118.347 0.521 . . . . 1.0 109.788 178.86 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.48 -59.7 4.98 Favored 'General case' 0 CA--C 1.536 0.415 0 O-C-N 122.229 -0.294 . . . . 0.77000000000000002 110.416 171.701 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -48.78 -47.52 41.9 Favored 'General case' 0 C--O 1.234 0.248 0 C-N-CA 125.842 1.657 . . . . 0.66000000000000003 111.589 -176.525 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 18.9 tp -48.52 -43.86 35.63 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 126.199 1.799 . . . . 3.0699999999999998 110.227 178.164 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -90.73 -42.98 10.4 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 110.052 -0.351 . . . . 2.9199999999999999 110.052 -173.106 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -65.86 -34.46 78.2 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 122.379 0.271 . . . . 2.3100000000000001 111.374 -173.657 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 58.2 m -123.18 62.93 1.01 Allowed 'General case' 0 C--O 1.234 0.263 0 C-N-CA 124.038 0.935 . . . . 1.8100000000000001 108.495 171.777 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 36.4 ttt180 -82.5 -18.75 40.49 Favored 'General case' 0 CA--C 1.535 0.392 0 O-C-N 121.715 -0.616 . . . . 5.9100000000000001 111.729 176.817 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -97.21 147.34 32.81 Favored Pre-proline 0 C--O 1.235 0.341 0 C-N-CA 124.986 1.315 . . . . 2.23 111.314 -166.429 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_endo -60.0 127.94 24.93 Favored 'Trans proline' 0 N--CA 1.452 -0.934 0 C-N-CA 123.049 2.499 . . . . 1.25 111.233 -173.658 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 41.7 m-20 76.29 18.44 1.87 Allowed 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 126.925 2.09 . . . . 2.9199999999999999 111.944 169.36 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 7.2 m -90.15 -17.09 28.25 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.494 0.718 . . . . 0.69999999999999996 111.989 -178.615 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -86.01 97.15 10.11 Favored 'General case' 0 CA--C 1.534 0.362 0 O-C-N 121.731 -0.606 . . . . 3.75 111.313 -157.857 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -80.44 155.47 74.02 Favored Pre-proline 0 CA--C 1.534 0.331 0 C-N-CA 123.918 0.887 . . . . 2.71 110.548 -178.938 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -70.81 -63.27 0.04 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.209 0 C-N-CA 122.534 2.156 . . . . 0.63 111.243 -177.636 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 38.2 mt-30 -61.12 -31.93 71.63 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 122.765 0.426 . . . . 2.46 110.867 -178.245 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.79 -64.43 0.96 Allowed 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 109.337 -0.616 . . . . 3.4100000000000001 109.337 171.014 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 4.8 t80 -54.82 -48.38 72.88 Favored 'General case' 0 C--O 1.22 -0.469 0 C-N-CA 123.281 0.632 . . . . 2.21 110.676 -174.355 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -34.99 -64.09 0.29 Allowed 'General case' 0 C--O 1.234 0.267 0 C-N-CA 127.741 2.417 . . . . 5.1100000000000003 111.837 171.86 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 -66.75 -48.61 68.58 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 108.747 -0.834 . . . . 3.3199999999999998 108.747 -177.408 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -60.63 -25.57 66.39 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 123.582 0.753 . . . . 0.67000000000000004 112.238 -174.627 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 30.7 t -89.82 -3.53 58.08 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 126.616 1.967 . . . . 1.4299999999999999 111.086 -179.472 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 80.61 5.85 89.68 Favored Glycine 0 C--N 1.335 0.52 0 N-CA-C 111.326 -0.709 . . . . 0.68000000000000005 111.326 172.359 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 80.7 mt -68.55 -26.57 65.48 Favored 'General case' 0 N--CA 1.445 -0.695 0 O-C-N 121.831 -0.805 . . . . 1.49 109.902 -177.153 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 24.2 t -64.02 -30.61 71.67 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.604 1.162 . . . . 2.1499999999999999 111.387 169.117 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -86.6 -38.09 17.46 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 109.296 -0.631 . . . . 4.0 109.296 -176.353 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 28.6 mtt -56.18 128.13 34.1 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-O 120.968 0.413 . . . . 3.1499999999999999 111.039 174.66 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 7.7 m -63.73 158.67 21.03 Favored 'General case' 0 N--CA 1.452 -0.335 0 O-C-N 121.74 -0.6 . . . . 2.1000000000000001 110.057 173.428 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -43.01 -41.55 3.46 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 124.231 1.013 . . . . 0.71999999999999997 111.983 177.005 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 7.8 m120 -55.0 -58.46 7.53 Favored 'General case' 0 N--CA 1.457 -0.093 0 C-N-CA 123.787 0.835 . . . . 2.5299999999999998 110.075 177.648 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 13.4 mm-40 -60.49 -48.0 83.68 Favored 'General case' 0 C--O 1.219 -0.527 0 N-CA-C 109.555 -0.535 . . . . 2.8500000000000001 109.555 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 77.1 t -54.55 -48.69 70.16 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 CA-C-N 118.975 0.807 . . . . 0.56000000000000005 110.489 -179.645 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 63.9 tttt -74.9 -24.05 58.47 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 121.087 -1.008 . . . . 3.1499999999999999 111.812 -178.784 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 61.3 t0 -66.66 -65.46 0.68 Allowed 'General case' 0 CA--C 1.529 0.151 0 N-CA-C 108.782 -0.821 . . . . 2.8399999999999999 108.782 168.888 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.61 HG12 HG22 ' A' ' 3' ' ' ILE . 15.2 m -47.35 -50.88 7.2 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 C-N-CA 123.678 0.791 . . . . 0.58999999999999997 110.805 179.406 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 20.9 m-85 -55.29 -43.77 75.07 Favored 'General case' 0 C--O 1.225 -0.225 0 CA-C-N 118.843 0.747 . . . . 6.7199999999999998 111.975 177.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 84.0 mtm180 -68.37 -36.44 79.2 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 119.169 0.895 . . . . 6.0899999999999999 112.261 176.524 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 49.4 t80 -63.96 -41.2 97.64 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 118.448 0.567 . . . . 2.9100000000000001 109.509 -179.819 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.0 mp -78.02 -32.52 17.46 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 CA-C-O 118.607 -0.711 . . . . 2.0699999999999998 111.975 177.003 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 52.4 t0 -66.98 75.57 0.12 Allowed 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 119.354 0.979 . . . . 1.8600000000000001 108.983 170.501 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 25.3 t-20 -54.73 156.46 3.58 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 107.699 -1.223 . . . . 3.3700000000000001 107.699 167.922 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 72.23 -44.77 0.6 Allowed 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 123.916 0.886 . . . . 3.48 113.118 -173.861 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 59.09 52.09 6.53 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 124.207 1.003 . . . . 3.8399999999999999 111.312 -172.645 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 16.6 p -57.78 -6.98 0.6 Allowed 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.3 1.44 . . . . 1.9399999999999999 113.093 166.419 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 73.78 14.07 80.18 Favored Glycine 0 CA--C 1.527 0.808 0 N-CA-C 110.0 -1.24 . . . . 1.5900000000000001 110.0 -167.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 -148.06 141.93 25.78 Favored 'General case' 0 N--CA 1.441 -0.894 0 C-N-CA 124.929 1.292 . . . . 3.3999999999999999 108.207 -179.235 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 4.9 mp -95.25 78.99 3.49 Favored 'General case' 0 N--CA 1.435 -1.212 0 N-CA-C 105.26 -2.126 . . . . 3.1800000000000002 105.26 161.333 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -63.19 170.39 2.92 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-N 113.754 -1.566 . . . . 1.5 109.224 175.733 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -48.7 -57.33 6.45 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 120.059 1.299 . . . . 4.0800000000000001 111.727 -171.255 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -45.32 -35.4 3.48 Favored 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 115.258 1.577 . . . . 3.5099999999999998 115.258 172.082 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -57.86 -44.08 86.37 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 121.213 1.824 . . . . 2.3799999999999999 109.379 174.498 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -77.89 16.81 0.65 Allowed 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 115.219 -0.901 . . . . 2.4399999999999999 111.259 175.439 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 26.7 ttpt -106.22 5.78 30.19 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.825 1.25 . . . . 2.4199999999999999 109.019 161.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 25.3 p90 -152.8 30.28 0.51 Allowed 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 118.606 0.639 . . . . 5.75 112.189 171.631 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 27.4 t80 -57.83 -61.75 2.3 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 119.116 0.871 . . . . 2.4399999999999999 108.916 -179.277 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 1.3 mp -82.58 -13.91 55.75 Favored 'General case' 0 CA--C 1.535 0.374 0 O-C-N 120.951 -1.093 . . . . 2.46 113.238 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 48.9 mm-40 -69.5 14.06 0.11 Allowed 'General case' 0 CA--C 1.544 0.734 0 O-C-N 121.146 -0.971 . . . . 1.5800000000000001 112.114 176.881 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.86 -25.85 12.46 Favored 'General case' 0 CA--C 1.533 0.293 0 O-C-N 120.21 -1.556 . . . . 3.6400000000000001 110.326 165.28 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -81.14 -48.26 12.37 Favored 'General case' 0 N--CA 1.456 -0.159 0 N-CA-C 108.184 -1.043 . . . . 7.5300000000000002 108.184 173.629 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -120.7 177.46 5.07 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 123.688 0.795 . . . . 4.0300000000000002 110.672 -175.073 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 7.0 m -96.32 -28.16 14.62 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.704 1.202 . . . . 2.1499999999999999 111.031 165.581 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -113.08 15.01 23.46 Favored Glycine 0 CA--C 1.527 0.802 0 C-N-CA 123.706 0.669 . . . . 1.26 112.081 -166.504 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -72.09 157.58 37.52 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 117.288 0.544 . . . . 2.0699999999999998 111.059 -176.567 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.87 18.41 0.1 Allowed 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 115.597 1.702 . . . . 3.4300000000000002 115.597 -159.228 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 73.1 mm-40 -58.96 -34.25 71.57 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 122.43 1.109 . . . . 3.96 111.718 -173.229 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.534 HD22 ' H ' ' A' ' 78' ' ' LEU . 0.1 OUTLIER -55.21 -35.4 64.83 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 114.764 -1.107 . . . . 0.76000000000000001 111.912 175.759 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 52.6 m -76.6 106.03 8.01 Favored 'General case' 0 C--N 1.342 0.273 0 CA-C-N 119.117 0.871 . . . . 0.84999999999999998 109.758 -179.045 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -56.17 -41.33 75.32 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 114.942 -1.027 . . . . 3.1699999999999999 110.92 -176.605 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 69.8 m -62.38 -53.33 56.61 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.103 0.561 . . . . 1.49 111.864 -178.266 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -58.7 -46.63 86.84 Favored 'General case' 0 C--O 1.233 0.229 0 O-C-N 121.482 -0.761 . . . . 3.1699999999999999 110.341 176.773 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -50.0 -51.17 43.87 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-O 121.545 0.688 . . . . 0.55000000000000004 109.764 175.176 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 89.2 mttt -66.62 -28.25 68.34 Favored 'General case' 0 C--O 1.22 -0.481 0 C-N-CA 124.969 1.308 . . . . 5.0199999999999996 111.61 -177.517 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 3.4 t -60.79 -47.19 87.46 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 119.561 1.073 . . . . 1.71 109.446 171.14 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -63.67 -51.3 65.72 Favored 'General case' 0 C--O 1.234 0.28 0 O-C-N 121.871 -0.518 . . . . 3.2400000000000002 110.412 174.744 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 31.6 ttm -45.82 -50.97 13.6 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 123.263 0.352 . . . . 3.0899999999999999 111.747 173.659 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -54.6 -46.27 73.76 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 125.831 1.652 . . . . 0.47999999999999998 111.863 -169.177 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -86.54 -41.29 14.45 Favored 'General case' 0 C--O 1.226 -0.157 0 N-CA-C 111.635 0.235 . . . . 0.45000000000000001 111.635 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -59.16 -39.3 82.03 Favored 'General case' 0 CA--C 1.521 -0.135 0 CA-C-N 118.092 0.406 . . . . 0.31 111.288 179.761 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 15.7 t0 -67.04 112.56 4.45 Favored 'General case' 0 N--CA 1.443 -0.811 0 N-CA-C 108.206 -1.035 . . . . 1.5900000000000001 108.206 174.087 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 76.0 m-20 -93.14 4.97 53.09 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-O 118.747 -0.644 . . . . 2.6499999999999999 110.908 -179.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 49.8 m-20 -99.71 -56.22 2.45 Favored 'General case' 0 C--N 1.345 0.404 0 CA-C-N 118.904 0.775 . . . . 1.21 110.975 -178.799 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 99.44 50.62 1.4 Allowed Glycine 0 CA--C 1.53 1.025 0 N-CA-C 108.69 -1.764 . . . . 0.80000000000000004 108.69 -156.63 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 30.1 p-10 -134.74 -50.63 0.78 Allowed 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 126.191 1.796 . . . . 1.9199999999999999 110.544 176.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 126.9 -46.87 1.05 Allowed Glycine 0 CA--C 1.521 0.428 0 C-N-CA 124.785 1.183 . . . . 0.82999999999999996 110.716 170.473 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 6.3 ptpp? -57.21 136.29 56.46 Favored 'General case' 0 C--O 1.241 0.649 0 CA-C-N 117.282 0.541 . . . . 4.3600000000000003 109.542 171.304 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 8.1 mt -125.41 114.6 40.45 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.197 0 C-N-CA 124.538 1.135 . . . . 0.67000000000000004 108.646 -172.001 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -71.13 160.16 54.01 Favored Glycine 0 CA--C 1.531 1.032 0 N-CA-C 110.121 -1.192 . . . . 0.56000000000000005 110.121 172.643 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -57.76 -36.91 72.75 Favored 'General case' 0 C--O 1.227 -0.12 0 O-C-N 121.848 -0.796 . . . . 1.0800000000000001 109.354 171.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -47.51 -69.57 0.12 Allowed 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.98 0.912 . . . . 4.0199999999999996 111.847 166.256 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -44.01 -46.46 8.36 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.428 1.091 . . . . 2.1499999999999999 111.942 179.045 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -67.38 -50.16 60.88 Favored 'General case' 0 CA--C 1.541 0.629 0 O-C-N 121.997 -0.439 . . . . 3.7400000000000002 111.869 -178.698 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 5.7 tm0? -62.22 -32.75 73.46 Favored 'General case' 0 C--O 1.223 -0.301 0 C-N-CA 124.083 0.953 . . . . 2.21 110.618 178.189 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -60.1 -60.11 4.35 Favored 'General case' 0 N--CA 1.456 -0.156 0 CA-C-N 119.123 0.874 . . . . 4.2999999999999998 109.523 169.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 7.7 tpt -54.0 -44.32 70.77 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-O 121.072 0.463 . . . . 2.7799999999999998 109.919 -174.019 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 46.0 t -72.44 -64.59 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.595 0 CA-C-N 115.872 -0.604 . . . . 1.26 111.403 178.825 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 22.5 t60 -58.17 -36.19 72.66 Favored 'General case' 0 C--N 1.331 -0.233 0 O-C-N 121.038 -1.039 . . . . 3.4700000000000002 110.529 -169.529 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 80.6 p . . . . . 0 C--O 1.251 1.175 0 C-N-CA 125.938 1.695 . . . . 5.71 113.166 173.622 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.57 HG22 HG12 ' A' ' 47' ' ' VAL . 2.9 pt . . . . . 0 N--CA 1.463 0.181 0 CA-C-O 121.509 0.671 . . . . 1.6399999999999999 112.237 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 11.9 t -54.51 -37.44 65.35 Favored 'General case' 0 N--CA 1.424 -1.763 0 C-N-CA 126.281 1.832 . . . . 2.27 112.355 -178.753 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 39.5 t0 -112.58 45.17 1.34 Allowed 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.769 0.828 . . . . 3.0600000000000001 109.994 -175.635 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 66.1 t -120.05 -64.4 1.63 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.21 0 C-N-CA 124.23 1.012 . . . . 1.4199999999999999 109.724 175.367 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -169.89 -54.45 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 106.704 -1.591 . . . . 1.1699999999999999 106.704 -173.849 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 2.5 m -34.7 -29.61 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 129.507 3.123 . . . . 0.85999999999999999 116.446 -172.185 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -49.08 -49.77 40.09 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 119.076 0.853 . . . . 0.78000000000000003 111.939 172.781 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -63.03 -42.15 99.7 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-O 122.51 1.147 . . . . 2.0899999999999999 109.484 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -68.29 -43.68 77.18 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-N 115.197 -0.911 . . . . 2.4199999999999999 108.905 -171.647 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 10.0 pt -61.92 -37.49 78.37 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.943 0 O-C-N 121.21 -0.931 . . . . 1.3200000000000001 111.526 174.029 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.44 -44.57 89.22 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 118.928 0.785 . . . . 0.78000000000000003 110.305 175.331 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.21 -56.26 24.4 Favored 'General case' 0 CA--C 1.535 0.4 0 O-C-N 122.198 -0.314 . . . . 0.56000000000000005 110.737 173.018 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -53.72 -44.19 69.67 Favored 'General case' 0 N--CA 1.457 -0.097 0 C-N-CA 124.691 1.196 . . . . 0.59999999999999998 111.256 -175.579 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.9 tt -51.29 -38.72 54.4 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 125.302 1.441 . . . . 3.4199999999999999 110.838 177.428 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 13.0 tt0 -89.18 -43.54 10.94 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 117.725 0.238 . . . . 2.8999999999999999 110.807 -177.328 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -69.15 -34.74 75.46 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 117.865 0.302 . . . . 3.1600000000000001 111.104 -175.528 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 19.6 t -108.29 52.62 0.71 Allowed 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 125.303 1.441 . . . . 2.9500000000000002 109.462 175.416 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 5.8 ttt-85 -92.41 -46.92 7.43 Favored 'General case' 0 C--O 1.231 0.112 0 C-N-CA 123.426 0.69 . . . . 4.1500000000000004 109.516 179.027 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -62.72 148.67 90.89 Favored Pre-proline 0 CA--C 1.537 0.471 0 C-N-CA 125.523 1.529 . . . . 2.8100000000000001 109.483 178.665 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -67.83 138.58 45.12 Favored 'Trans proline' 0 N--CA 1.451 -1.022 0 C-N-CA 122.123 1.882 . . . . 1.3100000000000001 111.386 -175.364 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 64.48 25.58 13.31 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 126.165 1.786 . . . . 2.3599999999999999 111.695 170.78 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 8.6 m -91.53 -13.62 31.78 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 124.558 1.143 . . . . 1.05 111.574 -179.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 3.4 t80 -54.51 120.6 6.89 Favored 'General case' 0 CA--C 1.534 0.339 0 O-C-N 121.635 -0.666 . . . . 4.0199999999999996 111.325 179.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -119.43 155.37 54.11 Favored Pre-proline 0 CA--C 1.537 0.477 0 C-N-CA 125.393 1.477 . . . . 2.4199999999999999 109.665 169.674 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -67.19 -82.21 0.01 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.706 0 C-N-CA 123.736 2.958 . . . . 1.01 112.083 -176.085 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 47.1 mt-30 -49.31 -45.64 45.61 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 124.584 1.154 . . . . 1.77 111.189 -176.481 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -39.41 -68.2 0.18 Allowed 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 125.111 1.364 . . . . 2.6099999999999999 110.004 166.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 25.2 t80 -65.05 -38.21 90.1 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 122.421 0.288 . . . . 3.0299999999999998 111.291 -174.764 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 9.0 m-30 -57.41 -43.0 83.37 Favored 'General case' 0 CA--C 1.53 0.189 0 O-C-N 121.345 -0.847 . . . . 4.8700000000000001 110.323 179.001 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -69.73 -52.45 25.31 Favored 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 109.481 -0.563 . . . . 2.7400000000000002 109.481 174.643 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -63.64 -26.72 68.8 Favored 'General case' 0 N--CA 1.446 -0.63 0 C-N-CA 123.033 0.533 . . . . 0.98999999999999999 111.559 -170.141 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 25.8 t -93.42 1.14 56.97 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 125.488 1.515 . . . . 1.6799999999999999 111.787 178.623 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 88.79 -11.46 68.75 Favored Glycine 0 C--N 1.337 0.632 0 C-N-CA 124.276 0.941 . . . . 1.05 111.288 171.398 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 52.8 mt -65.15 -38.17 89.72 Favored 'General case' 0 N--CA 1.44 -0.936 0 C-N-CA 124.578 1.151 . . . . 1.4399999999999999 111.367 -167.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 46.0 m -70.13 -20.6 63.16 Favored 'General case' 0 N--CA 1.461 0.106 0 CA-C-N 118.524 0.602 . . . . 3.0299999999999998 111.954 174.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 13.2 tttt -86.65 -38.04 17.44 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 108.678 -0.86 . . . . 4.1100000000000003 108.678 -178.76 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 31.1 mmt -58.87 131.47 51.08 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-O 121.588 0.709 . . . . 3.1600000000000001 109.625 169.331 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -68.63 158.47 34.0 Favored 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 108.659 -0.867 . . . . 2.1600000000000001 108.659 179.575 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -41.82 -42.58 2.71 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 124.407 1.083 . . . . 0.71999999999999997 112.408 177.606 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -52.34 -55.11 23.71 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.523 0.729 . . . . 2.5099999999999998 111.535 174.707 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 16.9 mm100 -69.0 -39.1 79.52 Favored 'General case' 0 N--CA 1.454 -0.234 0 O-C-N 122.04 -0.413 . . . . 2.8900000000000001 110.426 -177.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 94.2 t -59.1 -41.14 82.65 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 O-C-N 121.568 -0.707 . . . . 0.63 109.408 175.736 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 83.2 tttt -64.47 -40.21 95.26 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.21 0.604 . . . . 2.5600000000000001 111.023 175.772 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -57.5 -64.65 0.82 Allowed 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 118.759 0.709 . . . . 3.23 110.513 173.164 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.57 HG12 HG22 ' A' ' 3' ' ' ILE . 14.9 m -53.61 -45.27 59.64 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.306 0 N-CA-C 110.32 -0.252 . . . . 0.69999999999999996 110.32 -175.71 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.833 ' CZ ' ' HB2' ' A' ' 100' ' ' ALA . 14.6 t80 -40.96 -44.83 2.43 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 125.16 1.384 . . . . 4.71 112.72 172.67 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 47.4 mtp180 -58.63 -30.34 67.21 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 119.107 0.867 . . . . 3.02 112.071 -178.046 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -79.0 -38.07 37.6 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 123.291 0.636 . . . . 4.1299999999999999 109.509 -178.559 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 4.1 mp -66.72 176.14 0.44 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.939 0 C-N-CA 124.319 1.048 . . . . 2.4199999999999999 108.398 168.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 18.5 t70 73.67 -51.05 0.7 Allowed 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 127.199 2.2 . . . . 3.8599999999999999 111.209 -174.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 7.1 t30 77.51 -42.09 0.38 Allowed 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 125.442 1.497 . . . . 1.8500000000000001 112.581 175.456 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 86.1 m-20 -48.48 -52.32 22.94 Favored 'General case' 0 C--N 1.342 0.242 0 N-CA-C 108.237 -1.023 . . . . 2.8700000000000001 108.237 165.302 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 91.88 -1.88 0.17 Allowed 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 128.817 2.847 . . . . 4.3300000000000001 110.477 -164.565 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 95.5 p -46.75 -41.86 15.89 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 126.936 2.094 . . . . 2.1699999999999999 111.309 168.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 87.3 -14.16 58.31 Favored Glycine 0 CA--C 1.528 0.892 0 C-N-CA 123.747 0.689 . . . . 2.5099999999999998 113.073 -174.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 33.6 m-85 -76.86 100.75 5.63 Favored 'General case' 0 CA--C 1.511 -0.524 0 N-CA-C 107.064 -1.458 . . . . 2.3799999999999999 107.064 165.113 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 8.6 mp -68.87 87.93 0.37 Allowed 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 106.137 -1.801 . . . . 2.75 106.137 163.012 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -67.28 152.18 46.18 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.133 1.373 . . . . 1.47 108.415 168.015 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -46.4 -53.83 10.27 Favored 'General case' 0 CA--C 1.535 0.374 0 O-C-N 121.229 -0.919 . . . . 3.7599999999999998 112.973 -173.192 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -55.38 -27.7 49.2 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.256 0.622 . . . . 3.1699999999999999 112.509 179.739 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 64.9 mt-10 -75.18 -29.29 60.34 Favored 'General case' 0 C--N 1.33 -0.268 0 O-C-N 120.083 -1.635 . . . . 2.0099999999999998 111.074 177.376 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 17.4 mt -66.42 -20.65 66.11 Favored 'General case' 0 N--CA 1.449 -0.476 0 O-C-N 121.82 -0.55 . . . . 2.3599999999999999 110.498 173.165 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 26.6 ttpt -63.52 -6.83 5.63 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.299 0.64 . . . . 2.1400000000000001 111.843 168.054 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 20.6 p90 -135.33 31.37 3.18 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 120.061 1.3 . . . . 5.2000000000000002 112.561 169.306 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -50.92 -70.45 0.08 Allowed 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 123.567 0.747 . . . . 2.21 112.304 -178.327 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 2.4 tp -77.94 -20.47 52.71 Favored 'General case' 0 CA--C 1.533 0.318 0 O-C-N 121.059 -1.026 . . . . 2.4900000000000002 111.63 -179.8 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.07 -13.09 10.05 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.638 1.175 . . . . 2.3999999999999999 111.111 175.684 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.56 -34.11 77.17 Favored 'General case' 0 N--CA 1.449 -0.479 0 O-C-N 120.996 -1.065 . . . . 2.7799999999999998 111.991 170.413 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -90.62 -61.86 1.58 Allowed 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 108.06 -1.089 . . . . 7.0800000000000001 108.06 178.09 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -104.1 -176.65 3.14 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 124.467 1.107 . . . . 3.5800000000000001 108.418 -170.368 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 66.3 m -124.55 -15.57 6.55 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 119.639 1.109 . . . . 2.3399999999999999 113.686 -177.801 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -131.72 39.34 1.78 Allowed Glycine 0 CA--C 1.525 0.681 0 C-N-CA 125.151 1.358 . . . . 1.28 111.007 -176.256 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -74.9 -134.51 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.183 0.993 . . . . 1.72 110.286 173.839 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 5.4 tpt85 -124.47 -4.14 7.8 Favored 'General case' 0 CA--C 1.534 0.362 0 O-C-N 121.028 -1.045 . . . . 3.8999999999999999 113.028 -168.057 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -57.18 -23.52 48.17 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.274 1.03 . . . . 3.1200000000000001 112.956 -163.177 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.821 HD22 ' H ' ' A' ' 78' ' ' LEU . 0.0 OUTLIER -56.07 -42.19 76.27 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 125.104 1.362 . . . . 0.95999999999999996 111.834 173.31 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 90.6 m -71.78 102.44 2.84 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 121.599 0.714 . . . . 0.82999999999999996 110.258 -176.127 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -52.35 -42.1 63.62 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 114.663 -1.153 . . . . 3.0899999999999999 111.754 -179.278 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 65.7 m -57.76 -40.64 80.25 Favored 'General case' 0 CA--C 1.531 0.23 0 O-C-N 121.342 -0.849 . . . . 1.24 112.308 177.331 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -79.39 -45.77 18.87 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 108.634 -0.876 . . . . 2.6899999999999999 108.634 -172.705 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -47.79 -55.18 10.24 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-O 121.144 0.497 . . . . 0.56999999999999995 110.136 167.658 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 27.4 pttt -71.54 -22.27 61.79 Favored 'General case' 0 C--O 1.217 -0.642 0 CA-C-O 118.535 -0.745 . . . . 5.5300000000000002 111.132 -172.281 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 15.6 t -60.6 -49.83 75.96 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 119.965 1.257 . . . . 1.9299999999999999 109.073 169.084 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.7 tt -58.16 -54.4 47.41 Favored 'General case' 0 C--N 1.342 0.256 0 N-CA-C 109.404 -0.591 . . . . 3.0299999999999998 109.404 174.15 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 25.2 ttp -48.21 -52.54 20.54 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 121.046 0.451 . . . . 2.6899999999999999 111.853 178.717 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -55.01 -40.62 70.36 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 126.293 1.837 . . . . 0.56999999999999995 111.749 -169.38 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -92.41 -40.35 10.93 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 122.369 0.267 . . . . 0.58999999999999997 111.701 -178.828 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -58.23 -40.39 81.58 Favored 'General case' 0 C--N 1.339 0.119 0 CA-C-N 118.123 0.42 . . . . 0.40000000000000002 110.533 176.787 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -70.18 120.68 16.22 Favored 'General case' 0 N--CA 1.444 -0.768 0 N-CA-C 108.469 -0.938 . . . . 1.02 108.469 174.772 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 9.2 m-80 -106.53 12.78 29.14 Favored 'General case' 0 C--N 1.331 -0.21 0 C-N-CA 122.794 0.438 . . . . 2.8700000000000001 111.152 -179.602 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 38.1 m-20 -99.1 -39.25 8.59 Favored 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 122.987 0.515 . . . . 1.3799999999999999 109.901 178.09 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 86.09 38.98 8.18 Favored Glycine 0 CA--C 1.529 0.907 0 N-CA-C 108.753 -1.739 . . . . 0.81999999999999995 108.753 -156.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -119.87 -58.77 1.86 Allowed 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 117.795 0.797 . . . . 2.4700000000000002 111.089 -178.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 126.77 -38.93 2.07 Favored Glycine 0 CA--C 1.528 0.889 0 C-N-CA 124.171 0.891 . . . . 0.66000000000000003 111.506 178.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 31.6 mmtp -60.81 117.25 5.17 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 108.141 -1.059 . . . . 3.9900000000000002 108.141 173.798 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 6.8 mt -108.66 113.8 45.02 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.09 0 N-CA-C 109.317 -0.623 . . . . 0.82999999999999996 109.317 -178.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -75.96 170.42 54.71 Favored Glycine 0 CA--C 1.53 1.015 0 N-CA-C 110.879 -0.888 . . . . 0.5 110.879 170.6 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . 0.833 ' HB2' ' CZ ' ' A' ' 48' ' ' PHE . . . -55.34 -42.39 73.77 Favored 'General case' 0 CA--C 1.515 -0.372 0 O-C-N 122.234 -0.568 . . . . 0.68000000000000005 109.672 173.104 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.16 -63.54 1.26 Allowed 'General case' 0 N--CA 1.447 -0.576 0 O-C-N 124.264 0.977 . . . . 2.75 108.822 -177.057 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -42.25 -52.59 4.4 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.787 0.835 . . . . 1.3500000000000001 111.769 173.139 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 42.3 t80 -59.76 -56.37 22.7 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-O 121.267 0.556 . . . . 3.4500000000000002 110.603 -176.625 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -61.57 -37.91 85.6 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 124.764 1.226 . . . . 3.0299999999999998 110.89 -176.264 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -54.61 -62.98 1.3 Allowed 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 119.411 1.005 . . . . 3.77 109.155 172.095 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 1.7 tpt -63.59 -37.59 87.89 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 120.622 -0.431 . . . . 3.6299999999999999 111.417 -171.685 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 49.7 t -62.74 -48.21 89.24 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.22 0 C-N-CA 123.063 0.545 . . . . 1.28 110.886 174.024 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 83.9 t60 -67.83 -30.82 70.31 Favored 'General case' 0 N--CA 1.456 -0.141 0 C-N-CA 123.371 0.668 . . . . 2.0800000000000001 110.55 -173.435 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 5.1 t . . . . . 0 C--O 1.251 1.159 0 C-N-CA 125.962 1.705 . . . . 2.6400000000000001 112.141 177.694 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.642 HG22 HG12 ' A' ' 47' ' ' VAL . 1.5 pp . . . . . 0 CA--C 1.519 -0.224 0 CA-C-O 121.397 0.618 . . . . 1.25 111.139 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 62.8 p -58.12 -56.27 24.26 Favored 'General case' 0 N--CA 1.439 -1.004 0 C-N-CA 123.881 0.872 . . . . 3.0600000000000001 108.81 -178.085 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 38.5 t0 -80.99 45.33 0.82 Allowed 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.929 2.091 . . . . 2.4300000000000002 111.4 -169.73 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 73.9 t -143.46 -57.59 0.16 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.14 0 C-N-CA 126.832 2.053 . . . . 1.5700000000000001 107.77 -178.085 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 4.2 tp -166.25 -56.11 0.03 OUTLIER 'General case' 0 C--N 1.334 -0.093 0 N-CA-C 106.302 -1.74 . . . . 1.0900000000000001 106.302 -176.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -45.9 -23.57 0.3 Allowed 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 127.631 2.372 . . . . 1.1299999999999999 115.496 -165.313 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -49.66 -47.57 49.95 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 119.558 1.072 . . . . 0.93000000000000005 111.525 170.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -63.81 -39.81 95.13 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-O 122.449 1.119 . . . . 1.79 109.725 -179.414 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -72.76 -42.58 63.86 Favored 'General case' 0 N--CA 1.443 -0.792 0 C-N-CA 123.714 0.806 . . . . 2.4399999999999999 109.987 -173.271 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 29.0 pt -61.92 -41.43 90.83 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.769 0 O-C-N 121.224 -0.923 . . . . 0.96999999999999997 110.249 172.707 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.25 -46.53 76.07 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 118.947 0.794 . . . . 0.70999999999999996 111.129 173.062 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -57.04 -59.14 5.5 Favored 'General case' 0 CA--C 1.536 0.41 0 O-C-N 121.617 -0.677 . . . . 0.53000000000000003 110.837 174.046 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -46.11 -43.58 14.92 Favored 'General case' 0 CA--C 1.528 0.132 0 C-N-CA 125.633 1.573 . . . . 0.68000000000000005 111.484 178.717 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 39.5 tp -60.26 -40.56 90.76 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 123.833 0.853 . . . . 2.7799999999999998 110.508 -176.622 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 18.2 tt0 -87.91 -40.1 14.23 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 110.3 -0.259 . . . . 2.7000000000000002 110.3 -173.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.4 pp20? -68.11 -49.19 62.7 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 109.232 -0.655 . . . . 3.3999999999999999 109.232 -179.392 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -86.4 46.88 1.39 Allowed 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 124.543 1.137 . . . . 1.95 108.855 -179.608 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 61.1 ttt180 -87.29 -56.42 3.38 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 108.458 -0.941 . . . . 4.25 108.458 -176.351 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -55.13 131.35 68.62 Favored Pre-proline 0 N--CA 1.449 -0.508 0 CA-C-O 118.657 -0.687 . . . . 2.3199999999999998 109.47 176.381 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -62.78 150.1 89.21 Favored 'Trans proline' 0 N--CA 1.453 -0.895 0 C-N-CA 122.443 2.095 . . . . 1.25 110.304 -173.813 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 66.99 3.78 3.27 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.902 1.681 . . . . 2.9900000000000002 113.367 174.62 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 12.5 m -77.9 -7.74 57.14 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 120.783 -1.198 . . . . 0.81000000000000005 111.981 -176.519 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 41.3 t80 -68.48 113.68 6.23 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 121.429 -0.794 . . . . 4.2599999999999998 111.927 -173.114 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -102.87 155.61 36.35 Favored Pre-proline 0 CA--C 1.542 0.65 0 C-N-CA 125.396 1.478 . . . . 2.7400000000000002 111.035 166.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.36 -71.8 0.02 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.531 0 C-N-CA 124.47 3.446 . . . . 0.78000000000000003 112.575 -175.114 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 35.1 mt-30 -52.94 -46.35 68.08 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 123.734 0.814 . . . . 2.6499999999999999 110.567 -178.428 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -44.56 -67.39 0.29 Allowed 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 124.931 1.292 . . . . 3.7000000000000002 108.349 170.182 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 51.1 t80 -48.95 -52.96 21.83 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-O 118.635 -0.697 . . . . 2.8199999999999998 111.768 178.47 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.465 ' CE1' HD21 ' A' ' 86' ' ' LEU . 16.9 m-85 -52.11 -45.46 64.9 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 119.486 1.039 . . . . 4.7800000000000002 111.698 -176.441 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -72.87 -42.84 63.23 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 119.704 -0.798 . . . . 3.1000000000000001 110.293 179.265 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -61.31 -36.28 79.69 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 123.357 0.663 . . . . 0.81000000000000005 111.716 -178.517 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 57.7 p -83.03 -0.12 47.45 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 124.245 1.018 . . . . 1.99 111.206 178.848 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 82.19 -8.58 60.44 Favored Glycine 0 C--N 1.337 0.636 0 N-CA-C 110.773 -0.931 . . . . 0.82999999999999996 110.773 176.363 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 75.0 mt -59.39 -38.03 79.5 Favored 'General case' 0 N--CA 1.442 -0.855 0 C-N-CA 124.456 1.102 . . . . 1.3100000000000001 111.212 -174.381 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 21.3 m -71.45 -23.14 61.78 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 118.663 0.665 . . . . 2.8500000000000001 112.057 176.352 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 6.8 ttpt -83.87 -36.36 23.47 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 109.124 -0.695 . . . . 4.4199999999999999 109.124 179.008 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 14.2 mmt -59.95 135.72 57.79 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-O 121.631 0.729 . . . . 2.5699999999999998 110.445 173.21 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 69.5 m -63.58 152.45 38.74 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 116.082 -0.508 . . . . 1.8400000000000001 110.382 174.458 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -39.51 -40.76 0.9 Allowed 'General case' 0 C--O 1.224 -0.246 0 C-N-CA 125.674 1.59 . . . . 0.66000000000000003 111.976 172.805 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 67.7 m-20 -52.33 -56.16 16.73 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.632 1.173 . . . . 1.5700000000000001 111.45 176.103 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -72.65 -38.87 67.54 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 108.98 -0.748 . . . . 3.6200000000000001 108.98 -174.922 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.422 ' CG1' ' CZ ' ' A' ' 48' ' ' PHE . 52.7 t -58.52 -47.77 87.39 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 CA-C-O 121.342 0.591 . . . . 0.59999999999999998 109.557 175.565 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -55.58 -48.97 73.95 Favored 'General case' 0 N--CA 1.453 -0.291 0 O-C-N 121.228 -0.92 . . . . 2.8300000000000001 109.952 173.84 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -57.31 -51.13 70.63 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 120.224 -0.59 . . . . 2.9900000000000002 111.294 179.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.642 HG12 HG22 ' A' ' 3' ' ' ILE . 3.7 m -55.19 -42.14 64.17 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 O-C-N 121.785 -0.572 . . . . 0.65000000000000002 110.484 178.186 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.499 ' CZ ' ' HB3' ' A' ' 103' ' ' PHE . 17.3 m-30 -54.34 -34.42 61.03 Favored 'General case' 0 C--N 1.341 0.217 0 N-CA-C 113.027 0.751 . . . . 5.8899999999999997 113.027 174.746 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 81.2 mtp180 -61.58 -40.53 95.09 Favored 'General case' 0 CA--C 1.529 0.154 0 CA-C-N 119.506 1.048 . . . . 4.2400000000000002 109.975 174.882 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -64.5 -43.56 93.72 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 109.36 -0.607 . . . . 4.0700000000000003 109.36 176.23 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.423 HD11 ' CZ ' ' A' ' 71' ' ' PHE . 27.9 mm -58.09 -54.91 25.92 Favored 'Isoleucine or valine' 0 C--O 1.237 0.401 0 CA-C-O 118.799 -0.62 . . . . 1.55 110.874 177.64 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -75.89 64.19 1.81 Allowed 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 124.821 1.248 . . . . 1.9199999999999999 109.326 -173.179 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 31.6 t30 -55.27 -32.83 62.68 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 125.869 1.668 . . . . 1.8700000000000001 111.942 -174.139 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 16.6 p-10 -74.5 -29.05 61.26 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.947 1.699 . . . . 2.3599999999999999 111.977 175.163 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 8.7 mt-30 57.31 60.64 2.83 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 125.285 1.434 . . . . 2.9199999999999999 110.859 -173.152 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 79.1 p -89.34 -46.02 9.06 Favored 'General case' 0 C--N 1.337 0.048 0 C-N-CA 123.858 0.863 . . . . 1.3999999999999999 111.134 174.193 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 113.47 -18.87 20.06 Favored Glycine 0 CA--C 1.531 1.066 0 C-N-CA 123.912 0.768 . . . . 1.29 111.42 -164.871 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 77.9 m-85 -118.48 142.8 47.22 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 124.073 0.949 . . . . 2.5299999999999998 110.076 178.324 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.428 HD13 ' CE2' ' A' ' 103' ' ' PHE . 0.2 OUTLIER -104.01 70.3 0.99 Allowed 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 124.648 1.179 . . . . 3.0899999999999999 108.695 173.352 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -56.29 158.5 4.13 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.584 1.553 . . . . 2.04 111.472 176.931 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 54.9 mt-10 -43.67 -56.29 3.85 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 125.029 1.332 . . . . 3.4100000000000001 113.633 -175.728 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 16.3 tt0 -62.88 -25.64 68.39 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 121.969 -0.457 . . . . 3.0800000000000001 111.789 -178.633 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -71.02 -41.2 71.18 Favored 'General case' 0 N--CA 1.446 -0.652 0 O-C-N 121.109 -0.994 . . . . 2.8100000000000001 109.272 175.205 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -53.78 -40.67 66.46 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 122.85 0.46 . . . . 2.8100000000000001 110.416 172.629 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 21.3 ttpt -53.58 -16.55 1.6 Allowed 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.143 0.977 . . . . 1.97 112.814 174.805 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 59.5 m-85 -132.8 53.76 1.99 Allowed 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 118.923 0.783 . . . . 4.6500000000000004 110.368 167.295 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 48.8 t80 -79.21 -75.84 0.23 Allowed 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.98 0.912 . . . . 2.3100000000000001 109.97 173.787 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 1.7 tp -76.11 -8.91 58.07 Favored 'General case' 0 CA--C 1.542 0.636 0 O-C-N 120.438 -1.414 . . . . 2.4500000000000002 112.341 -176.776 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 61.1 mm-40 -47.5 -49.43 25.91 Favored 'General case' 0 C--N 1.343 0.289 0 C-N-CA 124.264 1.025 . . . . 1.6499999999999999 110.886 175.478 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.4 -11.25 14.62 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 112.919 0.711 . . . . 3.5299999999999998 112.919 -177.958 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.423 ' CZ ' HD11 ' A' ' 51' ' ' ILE . 13.4 m-30 -100.96 -60.13 1.58 Allowed 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 124.025 0.93 . . . . 3.6200000000000001 110.067 178.688 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -101.21 -22.43 14.66 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 112.354 0.502 . . . . 3.5099999999999998 112.354 -170.256 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 3.4 t 74.97 -50.7 0.67 Allowed 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 125.663 1.585 . . . . 2.46 110.654 -174.385 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -99.99 41.02 2.26 Favored Glycine 0 CA--C 1.526 0.777 0 O-C-N 121.239 -0.913 . . . . 1.03 111.065 179.096 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -80.98 -172.03 3.51 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 117.199 0.499 . . . . 1.3899999999999999 111.287 179.805 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -87.84 -7.26 57.49 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 123.427 0.691 . . . . 2.9700000000000002 112.536 -167.187 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -49.28 -35.55 18.2 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.453 1.501 . . . . 3.1800000000000002 113.299 -163.426 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.557 HD22 ' H ' ' A' ' 78' ' ' LEU . 0.1 OUTLIER -52.08 -44.57 64.41 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.389 1.076 . . . . 0.84999999999999998 112.025 173.58 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 32.1 m -65.1 107.71 1.62 Allowed 'General case' 0 C--O 1.236 0.366 0 CA-C-O 122.075 0.94 . . . . 0.81000000000000005 110.294 179.025 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -58.29 -41.58 84.69 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 113.925 -1.489 . . . . 2.7200000000000002 110.347 -178.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -48.1 -59.13 3.62 Favored 'General case' 0 C--O 1.225 -0.215 0 CA-C-N 118.863 0.756 . . . . 1.54 111.341 176.649 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 14.5 mt-10 -71.7 -42.68 67.08 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 123.795 0.838 . . . . 2.6800000000000002 109.382 -168.049 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -49.08 -52.73 24.03 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 116.105 -0.498 . . . . 0.58999999999999997 110.049 168.3 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 15.0 mmmt -69.17 -31.91 70.87 Favored 'General case' 0 C--O 1.22 -0.463 0 C-N-CA 123.402 0.681 . . . . 4.5099999999999998 111.07 -174.323 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 70.9 m -58.26 -42.82 87.27 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 120.084 1.311 . . . . 1.3999999999999999 110.644 170.2 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.465 HD21 ' CE1' ' A' ' 31' ' ' PHE . 0.5 OUTLIER -61.33 -62.56 1.75 Allowed 'General case' 0 C--O 1.234 0.254 0 N-CA-C 108.397 -0.964 . . . . 2.9900000000000002 108.397 172.062 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 9.7 ttm -49.27 -48.51 45.84 Favored 'General case' 0 CA--C 1.536 0.418 0 O-C-N 123.666 0.604 . . . . 4.4000000000000004 112.435 -173.272 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -49.72 -46.04 49.84 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 126.627 1.971 . . . . 0.69999999999999996 111.955 -178.89 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -83.63 -49.86 8.77 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 110.433 -0.21 . . . . 0.82999999999999996 110.433 -177.689 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.479 ' HB3' HD13 ' A' ' 98' ' ' ILE . . . -54.46 -41.83 69.94 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 122.691 0.396 . . . . 0.64000000000000001 111.681 -178.753 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -74.42 81.75 1.92 Allowed 'General case' 0 N--CA 1.446 -0.658 0 CA-C-O 121.352 0.596 . . . . 1.23 110.084 178.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 42.6 p-10 -77.46 49.88 0.76 Allowed 'General case' 0 CA--C 1.536 0.414 0 O-C-N 121.646 -0.659 . . . . 2.6699999999999999 111.315 176.023 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 34.2 m-20 -137.53 -60.44 0.66 Allowed 'General case' 0 C--N 1.341 0.231 0 C-N-CA 126.356 1.862 . . . . 1.22 109.258 178.595 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 102.26 43.27 2.06 Favored Glycine 0 CA--C 1.533 1.199 0 C-N-CA 125.028 1.299 . . . . 1.0600000000000001 110.247 -161.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -121.85 -61.53 1.49 Allowed 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.948 1.699 . . . . 1.9399999999999999 109.552 173.427 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 119.55 -24.13 8.17 Favored Glycine 0 CA--C 1.53 0.975 0 C-N-CA 125.2 1.381 . . . . 0.79000000000000004 111.28 -179.533 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 41.0 mttt -78.86 103.72 9.0 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 107.673 -1.232 . . . . 5.1699999999999999 107.673 171.393 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . 0.479 HD13 ' HB3' ' A' ' 90' ' ' ALA . 67.8 mt -94.43 118.92 41.57 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.577 0 N-CA-C 107.794 -1.188 . . . . 0.91000000000000003 107.794 -176.121 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -72.51 166.87 53.83 Favored Glycine 0 CA--C 1.534 1.244 0 CA-C-O 121.69 0.606 . . . . 0.55000000000000004 111.835 170.577 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -61.18 -37.15 81.92 Favored 'General case' 0 N--CA 1.456 -0.143 0 O-C-N 121.285 -1.127 . . . . 0.58999999999999997 110.087 178.058 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 56.0 mt-10 -62.34 -55.81 24.45 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-O 118.686 -0.673 . . . . 2.75 110.552 176.173 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -43.7 -50.3 7.61 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-O 121.829 0.824 . . . . 1.4399999999999999 110.008 173.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . 0.499 ' HB3' ' CZ ' ' A' ' 48' ' ' PHE . 0.8 OUTLIER -61.3 -54.2 47.0 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 112.868 0.692 . . . . 4.0099999999999998 112.868 177.867 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 18.7 tt0 -53.66 -49.88 66.99 Favored 'General case' 0 C--O 1.223 -0.308 0 C-N-CA 124.55 1.14 . . . . 2.4100000000000001 108.756 -178.714 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 65.4 mt-10 -48.99 -58.23 5.23 Favored 'General case' 0 C--O 1.232 0.165 0 C-N-CA 123.952 0.901 . . . . 3.46 110.064 176.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.3 -47.86 84.02 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 120.776 -0.37 . . . . 3.6099999999999999 111.193 -175.518 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 37.4 t -58.67 -44.95 90.9 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.193 0 C-N-CA 122.974 0.509 . . . . 1.28 111.393 178.444 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 63.4 t60 -62.88 -30.08 71.24 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 125.65 1.58 . . . . 2.52 110.179 -173.268 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 2.9 t . . . . . 0 C--O 1.251 1.154 0 CA-C-O 116.848 -1.549 . . . . 2.77 111.701 -177.195 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.439 HG22 HG12 ' A' ' 47' ' ' VAL . 1.2 pp . . . . . 0 CA--C 1.529 0.157 0 CA-C-O 121.641 0.734 . . . . 1.29 110.035 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 9.9 t -74.12 7.78 2.51 Favored 'General case' 0 N--CA 1.436 -1.173 0 C-N-CA 126.574 1.95 . . . . 1.8999999999999999 111.056 -174.486 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -168.38 45.84 0.04 OUTLIER 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 126.54 1.936 . . . . 3.6200000000000001 105.804 -158.493 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -148.13 -50.83 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.529 0.152 0 CA-C-N 115.38 -0.827 . . . . 1.78 110.879 179.849 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 177.98 -56.1 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 105.945 -1.872 . . . . 1.1899999999999999 105.945 -172.81 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 8.4 m -44.39 -32.92 1.49 Allowed 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 126.243 1.817 . . . . 0.91000000000000003 115.393 -172.344 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -49.53 -43.9 46.02 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 119.489 1.041 . . . . 0.83999999999999997 112.941 175.349 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 42.9 t0 -72.34 -39.24 68.28 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 122.725 1.25 . . . . 2.04 109.751 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 43.9 m-20 -62.16 -44.99 95.38 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 123.581 0.752 . . . . 2.5099999999999998 110.276 -178.213 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 39.0 pt -62.83 -40.94 90.65 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.196 0 CA-C-O 118.231 -0.89 . . . . 0.79000000000000004 110.13 177.479 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -52.36 -47.74 65.96 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 119.291 0.95 . . . . 0.68999999999999995 111.043 174.538 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -54.17 -60.78 2.88 Favored 'General case' 0 CA--C 1.529 0.162 0 O-C-N 122.334 -0.229 . . . . 0.65000000000000002 111.083 173.173 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -50.98 -48.63 61.15 Favored 'General case' 0 C--O 1.233 0.222 0 C-N-CA 123.269 0.628 . . . . 0.66000000000000003 112.09 -177.77 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -48.73 -50.03 35.48 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 125.203 1.401 . . . . 4.1200000000000001 110.053 178.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -79.23 -46.96 16.81 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 120.033 -0.667 . . . . 2.8900000000000001 109.484 -174.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 43.9 tp10 -45.81 -50.4 14.16 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 124.507 1.123 . . . . 4.2699999999999996 110.662 178.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 76.2 m -105.94 46.91 0.9 Allowed 'General case' 0 C--O 1.236 0.361 0 C-N-CA 123.053 0.541 . . . . 1.6000000000000001 110.242 -178.078 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.24 -43.28 82.32 Favored 'General case' 0 C--N 1.343 0.322 0 CA-C-O 121.798 0.809 . . . . 7.1399999999999997 109.078 -179.699 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -67.35 134.92 93.19 Favored Pre-proline 0 N--CA 1.442 -0.846 0 C-N-CA 125.885 1.674 . . . . 2.3199999999999998 109.404 -173.223 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -63.76 148.31 92.09 Favored 'Trans proline' 0 N--CA 1.456 -0.705 0 C-N-CA 122.835 2.356 . . . . 1.29 112.01 -171.35 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 9.5 t70 69.27 -0.15 2.63 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 127.608 2.363 . . . . 3.6800000000000002 113.639 179.172 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 14.9 m -77.55 -21.03 53.21 Favored 'General case' 0 C--N 1.341 0.215 0 N-CA-C 114.099 1.148 . . . . 0.93000000000000005 114.099 -175.45 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -75.27 90.9 2.62 Favored 'General case' 0 CA--C 1.539 0.538 0 O-C-N 121.42 -0.8 . . . . 3.7599999999999998 111.61 -165.063 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -77.48 155.11 81.61 Favored Pre-proline 0 CA--C 1.535 0.396 0 O-C-N 121.717 -0.614 . . . . 2.75 110.453 175.264 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -71.57 -67.23 0.03 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.108 0 C-N-CA 122.987 2.458 . . . . 0.77000000000000002 111.804 -176.271 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 71.5 mt-30 -53.54 -44.6 69.34 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 118.565 0.62 . . . . 2.04 110.487 179.503 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 25.3 tptt -43.84 -62.29 1.16 Allowed 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.429 1.091 . . . . 2.8300000000000001 110.062 169.105 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 16.0 t80 -53.6 -51.54 62.7 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.13 0.572 . . . . 2.8199999999999998 111.406 179.025 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 7.4 m-30 -58.08 -34.69 70.42 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 121.593 -0.692 . . . . 5.0 111.576 -176.8 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 12.9 tt0 -73.58 -57.57 3.9 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 108.616 -0.883 . . . . 3.6099999999999999 108.616 175.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -54.51 -38.03 66.03 Favored 'General case' 0 N--CA 1.444 -0.76 0 C-N-CA 124.829 1.252 . . . . 1.28 110.631 -172.605 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 69.2 m -88.6 1.78 54.34 Favored 'General case' 0 N--CA 1.445 -0.72 0 N-CA-C 112.926 0.713 . . . . 2.2000000000000002 112.926 -177.165 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 76.83 -15.35 6.27 Favored Glycine 0 CA--C 1.532 1.147 0 O-C-N 119.951 -1.718 . . . . 1.23 112.836 172.295 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 94.2 mt -45.01 -35.24 2.82 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 127.445 2.298 . . . . 1.5800000000000001 112.434 170.527 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 9.1 t -60.57 -37.99 83.11 Favored 'General case' 0 CA--C 1.529 0.157 0 O-C-N 121.683 -0.636 . . . . 2.02 110.57 176.281 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 29.1 tttp -89.45 -30.38 18.35 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-O 118.857 -0.592 . . . . 4.7999999999999998 111.235 -174.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -31.73 -67.31 0.1 Allowed 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 125.852 1.661 . . . . 3.3300000000000001 113.303 -174.545 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 26.1 m 135.34 143.97 0.0 OUTLIER 'General case' 0 C--O 1.234 0.242 0 C-N-CA 130.433 3.493 . . . . 1.71 106.719 -177.442 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -42.61 -41.9 3.23 Favored 'General case' 0 C--O 1.226 -0.179 0 C-N-CA 124.668 1.187 . . . . 0.64000000000000001 111.393 175.485 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 50.2 m-20 -58.94 -57.74 11.73 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 123.616 0.766 . . . . 1.8300000000000001 110.006 -176.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 3.4 mm-40 -62.42 -53.88 48.43 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 109.328 -0.619 . . . . 2.98 109.328 -178.353 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 70.0 t -49.62 -46.2 20.88 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.724 0 CA-C-O 121.664 0.745 . . . . 0.79000000000000004 111.192 177.737 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -63.17 -46.22 88.14 Favored 'General case' 0 N--CA 1.452 -0.37 0 O-C-N 120.61 -1.306 . . . . 3.3599999999999999 111.419 177.927 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -55.69 -52.03 65.27 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 118.191 0.451 . . . . 2.9900000000000002 110.878 175.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.439 HG12 HG22 ' A' ' 3' ' ' ILE . 3.4 m -56.21 -42.94 74.98 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 C-N-CA 120.516 -0.474 . . . . 0.76000000000000001 109.885 177.687 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 25.3 m-85 -60.49 -39.37 87.47 Favored 'General case' 0 C--N 1.342 0.253 0 CA-C-N 119.055 0.843 . . . . 6.5999999999999996 112.35 176.547 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 43.5 mtp180 -58.49 -43.02 88.85 Favored 'General case' 0 C--N 1.339 0.111 0 CA-C-N 119.287 0.949 . . . . 3.6699999999999999 110.918 171.843 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 27.3 t80 -58.98 -44.62 91.59 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 118.197 0.453 . . . . 4.0099999999999998 110.249 177.619 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.632 ' CG2' HD11 ' A' ' 59' ' ' LEU . 1.6 mp -58.68 -49.34 82.98 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 CA-C-O 118.088 -0.958 . . . . 1.6100000000000001 112.061 174.461 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 45.1 t0 -69.91 70.02 0.33 Allowed 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.275 1.03 . . . . 1.79 109.567 -175.259 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 20.3 t30 -61.81 -38.43 88.1 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 126.849 2.06 . . . . 1.8 111.958 -165.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -69.74 -25.48 63.85 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 125.471 1.509 . . . . 2.3199999999999998 111.559 171.76 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 4.9 mt-30 65.2 36.08 7.37 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 125.693 1.597 . . . . 2.79 113.036 -179.703 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 70.9 p -57.8 -31.88 67.0 Favored 'General case' 0 CA--C 1.534 0.341 0 O-C-N 121.373 -0.829 . . . . 1.3300000000000001 112.3 169.421 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 88.51 37.43 7.53 Favored Glycine 0 CA--C 1.526 0.772 0 N-CA-C 109.011 -1.636 . . . . 1.4099999999999999 109.011 -164.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 11.8 m-85 -164.74 135.83 4.18 Favored 'General case' 0 CA--C 1.516 -0.356 0 C-N-CA 125.273 1.429 . . . . 2.6400000000000001 108.796 -177.269 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.632 HD11 ' CG2' ' A' ' 51' ' ' ILE . 1.0 OUTLIER -86.19 78.01 9.45 Favored 'General case' 0 N--CA 1.443 -0.786 0 N-CA-C 107.511 -1.292 . . . . 2.1800000000000002 107.511 167.358 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -69.55 157.66 36.74 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 114.336 -1.302 . . . . 1.6499999999999999 110.199 177.093 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -53.14 -51.51 61.71 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.422 1.089 . . . . 4.5599999999999996 112.969 -168.281 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.9 tm-20 -59.92 -47.89 83.92 Favored 'General case' 0 CA--C 1.531 0.228 0 N-CA-C 109.719 -0.474 . . . . 4.04 109.719 -173.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -56.69 -36.26 69.41 Favored 'General case' 0 C--N 1.332 -0.18 0 C-N-CA 123.399 0.679 . . . . 2.04 111.219 177.611 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 7.0 tp -55.74 -34.68 65.4 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 122.496 0.318 . . . . 2.3399999999999999 110.546 176.719 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 31.1 ttpt -62.73 -10.82 14.07 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.881 1.272 . . . . 2.1499999999999999 112.761 174.252 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -124.85 18.99 8.56 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 126.089 1.756 . . . . 5.0199999999999996 110.561 175.21 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 83.3 t80 -52.2 -70.99 0.07 Allowed 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.391 1.077 . . . . 2.1499999999999999 111.689 -172.797 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.56 -19.24 62.18 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.495 0.718 . . . . 3.3500000000000001 109.53 -176.597 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -71.31 1.52 6.06 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 126.608 1.963 . . . . 2.1299999999999999 113.09 178.459 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.75 -32.06 59.83 Favored 'General case' 0 CA--C 1.529 0.156 0 O-C-N 121.308 -0.87 . . . . 3.1099999999999999 110.496 159.817 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.44 ' CZ ' HD11 ' A' ' 51' ' ' ILE . 4.4 m-30 -93.43 -58.74 2.2 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 124.289 1.036 . . . . 3.3100000000000001 108.845 -174.228 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -96.01 -170.95 2.21 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 124.804 1.242 . . . . 2.9199999999999999 107.898 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 23.8 m -136.35 48.68 2.13 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 123.603 0.761 . . . . 2.3799999999999999 110.271 175.516 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 141.61 60.88 0.03 OUTLIER Glycine 0 C--N 1.336 0.554 0 N-CA-C 109.92 -1.272 . . . . 1.4099999999999999 109.92 -178.594 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -89.17 -98.82 0.09 Allowed 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.038 0.535 . . . . 2.0099999999999998 109.994 179.674 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -144.07 24.53 1.63 Allowed 'General case' 0 CA--C 1.528 0.12 0 CA-C-O 121.682 0.753 . . . . 3.2799999999999998 111.51 -179.396 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 5.2 mp0 -72.29 -36.07 68.85 Favored 'General case' 0 N--CA 1.445 -0.717 0 C-N-CA 125.229 1.412 . . . . 4.6900000000000004 108.7 -172.052 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.497 HD22 ' H ' ' A' ' 78' ' ' LEU . 0.2 OUTLIER -51.77 -56.48 13.6 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 126.305 1.842 . . . . 0.96999999999999997 111.434 178.74 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 58.9 m -59.89 114.44 2.81 Favored 'General case' 0 C--N 1.341 0.231 0 N-CA-C 110.021 -0.363 . . . . 0.89000000000000001 110.021 -173.755 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -64.97 -44.68 88.53 Favored 'General case' 0 N--CA 1.447 -0.609 0 N-CA-C 109.825 -0.435 . . . . 3.3900000000000001 109.825 -176.149 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.5 m -50.9 -59.69 3.86 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 123.815 0.846 . . . . 1.54 110.374 177.058 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.93 -49.38 71.47 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 123.8 0.84 . . . . 2.6000000000000001 110.737 178.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -58.83 -39.19 80.51 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 120.125 -0.63 . . . . 0.90000000000000002 109.594 179.757 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 90.3 mttt -69.42 -27.61 65.42 Favored 'General case' 0 C--O 1.219 -0.51 0 C-N-CA 124.054 0.942 . . . . 4.7400000000000002 111.388 177.81 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 14.6 m -58.36 -46.15 86.85 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 120.183 1.356 . . . . 1.3100000000000001 109.907 169.806 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.3 mp -61.01 -59.79 4.82 Favored 'General case' 0 C--O 1.233 0.226 0 N-CA-C 109.829 -0.434 . . . . 3.04 109.829 170.077 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 29.8 ttp -46.09 -53.8 9.67 Favored 'General case' 0 C--O 1.221 -0.431 0 C-N-CA 123.06 0.544 . . . . 2.73 111.592 -175.209 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -47.41 -64.11 0.87 Allowed 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 127.456 2.302 . . . . 1.0 110.741 -174.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -65.07 -53.11 50.71 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 116.348 -0.387 . . . . 0.68000000000000005 110.037 179.879 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -50.41 -39.29 46.78 Favored 'General case' 0 C--O 1.226 -0.143 0 N-CA-C 111.769 0.285 . . . . 0.51000000000000001 111.769 -176.131 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -72.28 -58.33 3.49 Favored 'General case' 0 N--CA 1.445 -0.719 0 C-N-CA 124.124 0.97 . . . . 2.4199999999999999 110.333 178.843 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 46.31 25.61 0.38 Allowed 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.344 1.458 . . . . 3.04 114.837 -175.039 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 69.2 m-20 -112.23 -45.16 3.31 Favored 'General case' 0 N--CA 1.463 0.192 0 C-N-CA 123.752 0.821 . . . . 1.8500000000000001 109.452 177.178 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 97.68 39.81 3.79 Favored Glycine 0 CA--C 1.53 0.971 0 C-N-CA 125.681 1.61 . . . . 1.24 109.48 -161.792 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -127.39 -47.29 1.45 Allowed 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 118.386 1.093 . . . . 1.77 111.856 174.505 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 109.27 -27.89 11.87 Favored Glycine 0 CA--C 1.527 0.841 0 C-N-CA 124.175 0.893 . . . . 0.72999999999999998 112.347 172.089 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 23.7 mttt -78.9 131.43 36.4 Favored 'General case' 0 C--O 1.241 0.642 0 N-CA-C 107.986 -1.116 . . . . 4.1200000000000001 107.986 174.08 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 10.6 mt -123.8 106.14 16.62 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.457 0 C-N-CA 124.659 1.183 . . . . 1.1200000000000001 108.426 -166.416 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -62.68 161.0 32.45 Favored Glycine 0 CA--C 1.53 0.981 0 N-CA-C 110.159 -1.176 . . . . 0.69999999999999996 110.159 168.082 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -58.88 -37.08 75.75 Favored 'General case' 0 N--CA 1.453 -0.284 0 O-C-N 121.604 -0.939 . . . . 0.95999999999999996 109.81 177.068 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 61.5 mt-10 -66.13 -47.89 72.6 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 122.947 0.499 . . . . 3.79 111.431 -179.594 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -47.88 -53.51 15.52 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 121.853 0.835 . . . . 1.95 109.632 170.495 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -66.92 -44.38 80.89 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 116.113 -0.494 . . . . 3.1899999999999999 111.201 -173.285 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 10.1 tt0 -51.96 -54.38 30.28 Favored 'General case' 0 C--O 1.221 -0.439 0 C-N-CA 125.157 1.383 . . . . 2.7200000000000002 109.515 172.356 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -48.36 -52.42 21.8 Favored 'General case' 0 C--O 1.231 0.097 0 CA-C-N 119.071 0.85 . . . . 4.0 110.212 177.231 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -61.88 -46.26 90.18 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 119.921 -0.712 . . . . 3.1099999999999999 110.879 -176.937 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 44.0 t -59.97 -38.03 74.83 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.23 0 CA-C-O 119.196 -0.431 . . . . 1.46 111.828 175.181 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 2.0 t60 -64.66 -19.79 65.92 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 125.512 1.525 . . . . 2.46 109.997 -171.397 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 34.8 t . . . . . 0 C--O 1.254 1.296 0 CA-C-O 115.077 -2.392 . . . . 2.71 113.148 175.742 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.65 HG22 HG12 ' A' ' 47' ' ' VAL . 1.3 pp . . . . . 0 CA--C 1.534 0.336 0 CA-C-O 121.874 0.845 . . . . 1.3999999999999999 110.784 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.54 ' HA ' ' HB2' ' A' ' 9' ' ' ALA . 0.6 OUTLIER -68.21 -10.76 56.77 Favored 'General case' 0 N--CA 1.439 -0.989 0 C-N-CA 126.082 1.753 . . . . 1.8799999999999999 112.014 179.013 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.0 t0 -135.83 32.5 2.97 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.096 1.359 . . . . 2.5600000000000001 109.948 -174.238 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 11.2 m -125.34 -56.33 2.04 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 N-CA-C 112.576 0.584 . . . . 2.5899999999999999 112.576 172.643 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 22.3 tp -171.55 -59.2 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.135 0 N-CA-C 106.131 -1.803 . . . . 1.4299999999999999 106.131 -172.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 28.5 m -42.06 -35.78 0.98 Allowed 'General case' 0 C--O 1.217 -0.656 0 C-N-CA 125.501 1.52 . . . . 1.22 113.698 -175.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.54 ' HB2' ' HA ' ' A' ' 4' ' ' THR . . . -40.68 -45.63 2.42 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 114.094 1.146 . . . . 0.83999999999999997 114.094 172.245 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -70.9 -43.63 67.94 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 122.261 1.029 . . . . 1.78 109.597 179.352 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -62.83 -46.55 87.38 Favored 'General case' 0 N--CA 1.449 -0.518 0 C-N-CA 123.963 0.905 . . . . 2.5499999999999998 109.966 -175.654 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 35.9 pt -58.94 -41.67 83.76 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.767 0 C-N-CA 123.752 0.821 . . . . 0.96999999999999997 110.354 178.362 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.8 -46.76 84.19 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 110.267 -0.272 . . . . 1.0900000000000001 110.267 176.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.49 -52.28 66.27 Favored 'General case' 0 CA--C 1.529 0.15 0 O-C-N 121.781 -0.574 . . . . 0.91000000000000003 110.715 173.458 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.418 ' HB1' ' CE2' ' A' ' 30' ' ' PHE . . . -53.11 -43.82 67.15 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 124.769 1.227 . . . . 1.03 111.537 -176.259 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -55.36 -43.24 74.91 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 124.225 1.01 . . . . 3.7000000000000002 109.017 176.455 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 21.7 mt-30 -77.23 -39.17 49.45 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-O 119.164 -0.446 . . . . 4.1399999999999997 111.663 -176.513 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.34 -44.58 82.9 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 108.99 -0.744 . . . . 3.3799999999999999 108.99 179.25 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 76.4 m -85.49 41.58 0.9 Allowed 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.219 1.008 . . . . 2.2599999999999998 111.195 175.873 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 15.1 mtt180 -77.69 -55.58 5.23 Favored 'General case' 0 CA--C 1.518 -0.285 0 O-C-N 121.142 -0.974 . . . . 4.9900000000000002 108.605 178.813 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -69.46 140.52 90.0 Favored Pre-proline 0 N--CA 1.448 -0.55 0 CA-C-N 115.83 -0.623 . . . . 2.7200000000000002 109.509 -175.036 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -63.63 142.65 84.66 Favored 'Trans proline' 0 N--CA 1.449 -1.108 0 C-N-CA 122.208 1.939 . . . . 1.24 111.207 -175.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 17.8 t70 57.62 36.92 27.24 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 127.009 2.124 . . . . 3.6200000000000001 112.179 178.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 24.4 m -102.31 -29.57 11.59 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.872 1.269 . . . . 0.81999999999999995 111.281 177.085 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -53.87 125.44 18.64 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 125.688 1.595 . . . . 2.3900000000000001 109.155 -177.488 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -119.64 152.06 52.79 Favored Pre-proline 0 C--O 1.232 0.134 0 C-N-CA 124.686 1.194 . . . . 2.1800000000000002 108.294 172.537 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -64.94 -66.47 0.04 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.217 0 C-N-CA 122.707 2.271 . . . . 0.56000000000000005 110.52 178.428 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 35.0 mt-30 -60.61 -36.53 78.82 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 122.978 0.511 . . . . 2.1699999999999999 111.297 -175.103 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -58.5 -64.85 0.78 Allowed 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 109.316 -0.624 . . . . 5.1600000000000001 109.316 173.108 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.418 ' CE2' ' HB1' ' A' ' 15' ' ' ALA . 55.9 t80 -56.6 -45.55 81.37 Favored 'General case' 0 C--O 1.221 -0.42 0 CA-C-O 121.427 0.632 . . . . 2.1899999999999999 110.593 -174.717 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.404 ' CE1' ' HA ' ' A' ' 107' ' ' VAL . 4.4 t80 -41.29 -57.24 2.19 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 126.784 2.034 . . . . 4.71 111.047 176.422 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 12.0 mt-30 -70.96 -45.36 64.26 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 109.933 -0.395 . . . . 2.96 109.933 178.698 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -55.99 -29.06 59.74 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 123.11 0.564 . . . . 0.71999999999999997 112.439 -179.001 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 14.7 t -88.5 -8.74 54.34 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 126.489 1.916 . . . . 1.4399999999999999 110.429 -175.505 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 81.05 -1.99 82.7 Favored Glycine 0 C--N 1.34 0.795 0 O-C-N 121.322 -0.861 . . . . 0.67000000000000004 111.04 174.047 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.413 ' HB3' HG13 ' A' ' 107' ' ' VAL . 85.0 mt -63.36 -28.85 70.27 Favored 'General case' 0 N--CA 1.441 -0.896 0 C-N-CA 124.737 1.215 . . . . 1.3300000000000001 110.217 -176.246 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 60.4 p -63.02 -35.52 80.5 Favored 'General case' 0 C--N 1.338 0.102 0 C-N-CA 123.711 0.805 . . . . 2.3599999999999999 111.62 171.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 7.5 tttt -82.79 -32.08 27.88 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 108.945 -0.761 . . . . 5.0999999999999996 108.945 -176.158 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 21.5 mtt -57.62 124.66 19.84 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-O 121.088 0.471 . . . . 2.8599999999999999 110.342 174.273 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 6.9 m -61.2 157.09 16.89 Favored 'General case' 0 N--CA 1.452 -0.368 0 O-C-N 121.525 -0.734 . . . . 1.9099999999999999 110.15 172.171 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -43.33 -40.26 3.51 Favored 'General case' 0 C--O 1.225 -0.22 0 C-N-CA 124.031 0.932 . . . . 0.67000000000000004 111.414 175.399 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 49.9 m-20 -47.02 -60.07 2.7 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 124.351 1.061 . . . . 1.8700000000000001 110.381 174.559 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 30.6 mm100 -69.32 -43.56 73.47 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 115.778 -0.646 . . . . 3.25 109.547 -175.696 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 95.2 t -56.91 -45.89 83.6 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 CA-C-N 119.166 0.894 . . . . 0.56000000000000005 110.087 -179.937 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 14.2 tttt -63.03 -43.15 99.49 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 109.598 -0.519 . . . . 3.54 109.598 176.206 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 27.0 t0 -61.75 -54.99 34.94 Favored 'General case' 0 CA--C 1.535 0.38 0 O-C-N 121.947 -0.471 . . . . 2.4500000000000002 110.964 -179.098 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.65 HG12 HG22 ' A' ' 3' ' ' ILE . 15.0 m -55.19 -43.65 71.43 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.202 0 C-N-CA 123.045 0.538 . . . . 0.68999999999999995 110.364 176.694 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -44.8 -48.25 10.95 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 118.679 0.672 . . . . 5.25 111.221 171.733 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 83.6 mtm180 -60.27 -30.91 69.75 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 118.807 0.731 . . . . 6.5 112.479 177.857 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 14.0 m-85 -70.46 -34.59 72.59 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 118.963 0.801 . . . . 3.8199999999999998 111.105 172.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.764 HG22 ' H ' ' A' ' 52' ' ' ASP . 18.0 mm -77.83 -171.82 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.84 0 CA-C-N 118.994 0.816 . . . . 2.3900000000000001 109.692 177.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.764 ' H ' HG22 ' A' ' 51' ' ' ILE . 41.8 t0 75.55 -55.8 0.62 Allowed 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 127.331 2.253 . . . . 4.1100000000000003 110.216 -178.472 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 11.3 t30 96.52 -54.41 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.187 0 C-N-CA 127.935 2.494 . . . . 2.1299999999999999 108.437 -179.787 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -56.06 -35.23 66.72 Favored 'General case' 0 CA--C 1.529 0.14 0 C-N-CA 124.371 1.069 . . . . 2.3700000000000001 111.642 170.937 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 75.8 mt-30 55.8 49.96 15.09 Favored 'General case' 0 CA--C 1.539 0.523 0 N-CA-C 109.19 -0.67 . . . . 4.5499999999999998 109.19 -159.768 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 51.0 p -90.47 -44.25 9.73 Favored 'General case' 0 C--N 1.339 0.13 0 C-N-CA 123.422 0.689 . . . . 2.1200000000000001 110.045 174.508 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 117.44 -37.88 3.16 Favored Glycine 0 C--N 1.336 0.573 0 N-CA-C 111.241 -0.743 . . . . 2.27 111.241 -177.411 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 11.2 m-85 -70.73 110.12 5.35 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 106.453 -1.684 . . . . 2.48 106.453 167.744 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -84.71 81.49 8.85 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 106.117 -1.808 . . . . 1.8799999999999999 106.117 166.034 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -69.65 150.62 46.83 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 114.122 -1.399 . . . . 1.46 109.161 -179.628 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -47.76 -46.5 30.24 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.768 1.227 . . . . 3.8999999999999999 112.112 -171.642 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -57.39 -39.99 77.28 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 123.143 0.577 . . . . 3.6800000000000002 111.089 -178.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -71.54 -28.34 63.81 Favored 'General case' 0 CA--C 1.517 -0.289 0 O-C-N 120.959 -1.088 . . . . 2.3399999999999999 110.399 -178.889 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.27 -30.36 59.96 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 119.285 -0.388 . . . . 2.3300000000000001 110.375 170.137 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 31.5 ttpt -60.71 -9.92 4.63 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.093 0.957 . . . . 1.96 113.222 172.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 30.4 m-85 -132.39 23.12 4.41 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.299 1.039 . . . . 4.9699999999999998 111.244 172.217 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 44.2 t80 -55.02 -65.54 0.56 Allowed 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 118.827 0.739 . . . . 2.48 110.742 -178.624 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 14.3 tp -84.35 -13.65 51.73 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.399 0.68 . . . . 2.4100000000000001 111.598 -176.065 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 83.5 mm-40 -52.56 -57.02 11.31 Favored 'General case' 0 C--N 1.344 0.343 0 N-CA-C 109.006 -0.739 . . . . 2.1299999999999999 109.006 173.719 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.78 42.31 0.37 Allowed 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 112.296 0.48 . . . . 2.3500000000000001 112.296 -179.658 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.598 ' CE1' HD11 ' A' ' 51' ' ' ILE . 0.1 OUTLIER -147.04 -56.87 0.26 Allowed 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 127.384 2.273 . . . . 3.3300000000000001 106.404 -179.258 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -104.8 -46.34 4.34 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.516 1.126 . . . . 3.8900000000000001 111.657 -178.295 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 19.9 m 81.4 109.13 0.07 Allowed 'General case' 0 C--N 1.34 0.182 0 C-N-CA 126.687 1.995 . . . . 3.2400000000000002 110.358 -170.684 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 86.64 40.73 7.11 Favored Glycine 0 CA--C 1.525 0.711 0 N-CA-C 110.594 -1.002 . . . . 1.21 110.594 -179.597 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -85.88 -154.77 0.22 Allowed 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.041 0.937 . . . . 1.3400000000000001 110.886 177.739 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 1.6 tpt85 -102.28 -9.26 20.55 Favored 'General case' 0 N--CA 1.463 0.182 0 C-N-CA 123.524 0.729 . . . . 4.0800000000000001 112.684 -161.744 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -43.89 -39.75 4.12 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 129.253 3.021 . . . . 3.3799999999999999 113.038 -167.004 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.571 HD22 ' H ' ' A' ' 78' ' ' LEU . 0.6 OUTLIER -50.55 -41.48 54.07 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 124.669 1.188 . . . . 1.0800000000000001 111.991 176.128 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 63.7 m -65.33 109.47 2.28 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 108.63 -0.878 . . . . 0.84999999999999998 108.63 171.722 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 16.5 pt-20 -54.95 -46.62 75.03 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-N 115.457 -0.792 . . . . 3.1699999999999999 110.525 176.199 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.1 m -50.13 -58.08 6.31 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 119.457 1.026 . . . . 1.28 112.393 176.912 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -64.82 -40.52 95.34 Favored 'General case' 0 N--CA 1.453 -0.325 0 N-CA-C 109.836 -0.431 . . . . 2.7000000000000002 109.836 -173.402 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -61.85 -44.92 95.86 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 122.515 1.15 . . . . 0.93999999999999995 109.563 174.224 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -62.65 -31.62 72.52 Favored 'General case' 0 N--CA 1.444 -0.743 0 C-N-CA 124.898 1.279 . . . . 7.0999999999999996 109.91 -176.406 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 50.6 m -53.82 -43.21 69.21 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 119.529 1.059 . . . . 1.3100000000000001 111.284 171.087 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 8.0 mt -64.92 -56.61 12.27 Favored 'General case' 0 C--O 1.233 0.228 0 N-CA-C 109.184 -0.673 . . . . 2.1699999999999999 109.184 170.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 7.7 ttm -43.59 -47.55 7.48 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 124.077 0.861 . . . . 3.0699999999999998 112.056 -177.592 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -54.5 -46.86 73.55 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 127.661 2.384 . . . . 0.89000000000000001 112.392 -173.47 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -87.08 -41.53 13.75 Favored 'General case' 0 CA--C 1.522 -0.111 0 CA-C-N 117.821 0.282 . . . . 0.75 110.783 179.18 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -54.83 -46.85 74.66 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 116.554 -0.294 . . . . 0.34999999999999998 110.212 -179.252 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -73.7 77.97 1.54 Allowed 'General case' 0 N--CA 1.447 -0.589 0 CA-C-O 121.625 0.726 . . . . 0.97999999999999998 109.7 178.669 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 51.4 p30 -77.07 41.58 0.29 Allowed 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.61 -0.681 . . . . 2.6499999999999999 111.793 177.794 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 26.4 m-20 -128.14 -59.72 1.17 Allowed 'General case' 0 C--N 1.34 0.158 0 C-N-CA 126.614 1.966 . . . . 1.23 108.527 179.3 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 103.78 45.41 1.52 Allowed Glycine 0 CA--C 1.531 1.083 0 C-N-CA 125.19 1.376 . . . . 0.77000000000000002 110.096 -164.129 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -125.1 -63.89 1.13 Allowed 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.58 1.552 . . . . 1.8799999999999999 110.194 173.754 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 128.08 -30.8 3.82 Favored Glycine 0 CA--C 1.531 1.079 0 C-N-CA 124.885 1.231 . . . . 0.79000000000000004 111.794 -179.915 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 37.9 mttp -73.17 108.4 6.03 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 108.153 -1.055 . . . . 4.46 108.153 169.439 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 18.1 mt -97.6 115.25 36.98 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.353 0 C-N-CA 123.952 0.901 . . . . 0.76000000000000001 108.855 -174.393 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -69.93 164.9 51.34 Favored Glycine 0 CA--C 1.537 1.446 0 CA-C-N 118.73 0.696 . . . . 0.83999999999999997 112.527 172.534 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -59.08 -39.56 82.5 Favored 'General case' 0 N--CA 1.456 -0.163 0 O-C-N 121.518 -0.989 . . . . 1.23 108.525 171.613 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -51.22 -57.94 7.48 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 124.344 1.057 . . . . 4.0700000000000003 111.288 170.216 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -51.13 -48.1 61.86 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.133 0.973 . . . . 1.99 110.406 176.637 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -56.54 -60.3 3.74 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 112.349 0.5 . . . . 3.54 112.349 176.267 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -59.82 -35.69 75.23 Favored 'General case' 0 C--O 1.22 -0.467 0 CA-C-O 118.587 -0.721 . . . . 3.1000000000000001 110.19 -178.286 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 17.8 mm-40 -57.5 -59.86 4.52 Favored 'General case' 0 N--CA 1.456 -0.128 0 CA-C-N 119.686 1.13 . . . . 3.21 109.654 174.068 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -56.14 -50.7 70.38 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-O 121.719 0.771 . . . . 3.8599999999999999 109.119 -177.349 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' VAL . . . . . 0.413 HG13 ' HB3' ' A' ' 36' ' ' LEU . 96.6 t -72.49 -30.6 34.96 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.761 0 CA-C-N 115.604 -0.726 . . . . 1.49 112.58 -172.528 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 15.2 t60 -95.16 15.36 19.31 Favored 'General case' 0 CA--C 1.532 0.286 0 O-C-N 120.117 -1.614 . . . . 3.4399999999999999 110.952 178.367 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 5.8 t . . . . . 0 C--O 1.253 1.239 0 CA-C-O 116.868 -1.539 . . . . 3.4500000000000002 109.142 179.661 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.583 HG22 HG12 ' A' ' 47' ' ' VAL 0.311 0.6 OUTLIER . . . . . 0 CA--C 1.548 0.882 0 N-CA-C 112.858 0.688 . . . . 1.5800000000000001 112.858 . . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 5.7 t -38.77 -29.94 0.04 OUTLIER 'General case' 0 N--CA 1.442 -0.83 1 C-N-CA 133.036 4.535 . . . . 1.9299999999999999 115.5 176.59 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 39.5 t0 -145.22 57.25 1.25 Allowed 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 121.822 0.82 . . . . 3.5899999999999999 109.08 170.176 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 97.0 t -116.83 -59.47 3.1 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.17 0 CA-C-N 115.226 -0.897 . . . . 1.75 109.366 173.813 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 13.6 tp -169.67 -60.55 0.02 OUTLIER 'General case' 0 CA--C 1.519 -0.213 0 N-CA-C 106.075 -1.824 . . . . 1.47 106.075 -178.354 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -53.18 -20.42 3.94 Favored 'General case' 0 N--CA 1.446 -0.666 0 C-N-CA 125.507 1.523 . . . . 1.02 113.152 -172.012 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -50.13 -40.97 47.92 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 113.516 0.932 . . . . 0.93999999999999995 113.516 169.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -70.87 -42.45 70.05 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 122.4 1.095 . . . . 1.8500000000000001 109.264 176.013 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -65.29 -44.12 88.97 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 115.489 -0.778 . . . . 2.48 109.659 -172.538 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 36.3 pt -58.67 -39.15 75.37 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.671 0 O-C-N 120.855 -1.153 . . . . 0.77000000000000002 111.066 175.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.63 -43.2 93.92 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 109.689 -0.486 . . . . 0.64000000000000001 109.689 176.394 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.43 -56.66 19.24 Favored 'General case' 0 CA--C 1.535 0.397 0 O-C-N 122.115 -0.366 . . . . 0.51000000000000001 110.419 172.699 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -50.34 -46.79 55.93 Favored 'General case' 0 C--O 1.231 0.116 0 C-N-CA 125.224 1.41 . . . . 0.51000000000000001 111.448 -176.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.1 mt -50.01 -44.88 51.46 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.056 -0.975 . . . . 3.2200000000000002 109.712 178.386 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.38 -46.5 17.48 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 109.763 -0.458 . . . . 4.5099999999999998 109.763 -175.945 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.74 -28.26 66.65 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 121.207 -0.197 . . . . 2.7400000000000002 111.416 -169.867 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 62.5 m -112.78 49.59 0.93 Allowed 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.887 1.275 . . . . 1.3600000000000001 109.054 171.199 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -73.49 -33.65 64.91 Favored 'General case' 0 C--O 1.236 0.351 0 O-C-N 121.25 -0.906 . . . . 5.54 109.716 177.521 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -83.97 141.27 40.57 Favored Pre-proline 0 N--CA 1.449 -0.499 0 C-N-CA 125.456 1.502 . . . . 1.96 109.46 -171.205 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -59.96 148.94 86.85 Favored 'Trans proline' 0 N--CA 1.451 -0.98 0 C-N-CA 122.342 2.028 . . . . 1.21 110.441 -170.879 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 50.81 42.24 27.49 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 126.243 1.817 . . . . 2.6499999999999999 111.333 173.525 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 10.4 m -109.65 -24.49 10.9 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 125.089 1.356 . . . . 1.04 112.869 179.451 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -53.38 112.51 0.91 Allowed 'General case' 0 N--CA 1.445 -0.718 0 C-N-CA 123.417 0.687 . . . . 3.1499999999999999 112.141 -177.04 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -102.78 156.16 35.64 Favored Pre-proline 0 CA--C 1.539 0.531 0 C-N-CA 124.531 1.132 . . . . 2.6299999999999999 109.836 173.663 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_endo -68.4 -78.42 0.01 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.883 0 C-N-CA 123.563 2.842 . . . . 1.0900000000000001 112.187 -176.481 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 46.3 mt-30 -50.1 -43.91 51.78 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.991 0.916 . . . . 2.8799999999999999 110.892 -178.562 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -44.59 -63.55 0.88 Allowed 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 124.266 1.026 . . . . 3.3100000000000001 110.163 169.863 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 5.3 t80 -60.76 -42.47 97.52 Favored 'General case' 0 C--O 1.224 -0.266 0 CA-C-N 118.21 0.459 . . . . 2.1099999999999999 110.915 -179.071 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 8.3 m-30 -56.08 -37.77 69.79 Favored 'General case' 0 CA--C 1.532 0.272 0 O-C-N 121.21 -0.931 . . . . 4.5999999999999996 110.93 -179.242 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 12.6 tt0 -76.31 -53.27 8.44 Favored 'General case' 0 N--CA 1.456 -0.134 0 O-C-N 121.921 -0.487 . . . . 3.0 110.101 174.119 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -66.3 -17.39 64.73 Favored 'General case' 0 N--CA 1.447 -0.608 0 C-N-CA 123.557 0.743 . . . . 0.90000000000000002 112.618 -171.931 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 2.6 t -96.41 -3.82 42.87 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 125.747 1.619 . . . . 1.46 111.154 176.236 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 80.43 -21.78 5.02 Favored Glycine 0 CA--C 1.532 1.144 0 O-C-N 120.662 -1.274 . . . . 0.72999999999999998 112.308 178.673 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -40.75 -48.02 2.94 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 126.968 2.107 . . . . 2.7599999999999998 114.018 178.32 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 43.6 p -68.47 -26.15 65.34 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 118.873 0.761 . . . . 2.02 112.016 -179.731 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 22.2 tttt -78.89 -38.0 38.66 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 107.903 -1.147 . . . . 4.2300000000000004 107.903 178.345 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 9.8 mmt -62.64 139.47 58.64 Favored 'General case' 0 N--CA 1.44 -0.95 0 CA-C-O 121.575 0.703 . . . . 3.7400000000000002 109.541 176.006 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 44.5 p -74.97 162.07 28.92 Favored 'General case' 0 N--CA 1.449 -0.48 0 O-C-N 121.759 -0.588 . . . . 2.02 109.889 -179.164 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -45.7 -35.99 4.61 Favored 'General case' 0 C--O 1.225 -0.223 0 C-N-CA 124.235 1.014 . . . . 0.60999999999999999 112.239 176.738 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -49.9 -60.34 3.01 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 123.331 0.652 . . . . 2.77 110.681 172.334 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 5.8 mm100 -69.38 -42.38 75.23 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-O 119.134 -0.46 . . . . 2.5299999999999998 109.948 -176.776 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 60.7 t -59.55 -38.41 75.22 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-N 119.148 0.885 . . . . 0.60999999999999999 110.051 179.363 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 54.8 tttp -63.62 -48.92 75.35 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 118.719 0.69 . . . . 2.77 110.245 174.079 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -55.65 -57.55 11.51 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 120.626 0.251 . . . . 3.1200000000000001 110.709 -179.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.583 HG12 HG22 ' A' ' 3' ' ' ILE . 5.5 m -57.91 -46.94 87.45 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.214 0 N-CA-C 109.579 -0.526 . . . . 0.53000000000000003 109.579 177.776 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 13.8 t80 -46.15 -48.46 17.39 Favored 'General case' 0 C--O 1.224 -0.285 0 CA-C-O 118.454 -0.784 . . . . 4.0499999999999998 110.663 177.243 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 76.2 mtp180 -54.74 -40.59 69.46 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-N 119.302 0.956 . . . . 3.9100000000000001 111.493 177.169 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -63.78 -41.26 97.98 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 110.242 -0.281 . . . . 3.8399999999999999 110.242 176.487 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.424 HG22 HD11 ' A' ' 59' ' ' LEU . 3.3 mp -65.42 -42.09 92.63 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.687 0 O-C-N 121.623 -0.673 . . . . 1.6599999999999999 110.716 176.396 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 54.3 t0 -75.76 63.09 1.59 Allowed 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 124.933 1.293 . . . . 1.95 110.073 179.311 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -47.11 144.11 2.79 Favored 'General case' 0 C--O 1.232 0.175 0 N-CA-C 107.715 -1.217 . . . . 3.6400000000000001 107.715 168.008 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 75.91 -33.82 0.23 Allowed 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 125.048 1.339 . . . . 3.3999999999999999 112.209 -173.86 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 56.75 41.08 28.71 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 124.7 1.2 . . . . 4.5899999999999999 111.532 -175.275 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 11.8 p -48.22 -32.15 6.75 Favored 'General case' 0 C--N 1.341 0.238 0 C-N-CA 126.36 1.864 . . . . 2.1299999999999999 112.196 176.02 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 113.34 -17.79 21.22 Favored Glycine 0 CA--C 1.525 0.673 0 N-CA-C 109.365 -1.494 . . . . 1.8700000000000001 109.365 -164.229 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 84.7 m-85 -135.39 159.44 41.57 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-O 123.041 1.4 . . . . 2.1400000000000001 112.005 179.727 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.424 HD11 HG22 ' A' ' 51' ' ' ILE . 3.5 mm? -98.21 73.8 2.2 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 105.426 -2.064 . . . . 1.8899999999999999 105.426 164.731 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -55.17 146.22 19.27 Favored 'General case' 0 CA--C 1.545 0.765 0 CA-C-N 113.807 -1.542 . . . . 1.6100000000000001 108.815 172.376 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -50.15 -54.45 20.67 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 113.952 1.093 . . . . 3.3399999999999999 113.952 -160.937 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 64.5 mt-10 -55.34 -31.69 61.92 Favored 'General case' 0 CA--C 1.535 0.368 0 O-C-N 121.589 -0.695 . . . . 3.5899999999999999 111.982 177.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -71.14 -43.09 68.24 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 123.149 0.58 . . . . 2.3199999999999998 109.614 176.767 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -51.6 -36.01 43.87 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.471 1.108 . . . . 2.6099999999999999 110.398 173.225 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 10.8 ttmt -46.82 -60.84 2.16 Favored 'General case' 0 N--CA 1.464 0.272 0 O-C-N 121.879 -0.513 . . . . 2.6699999999999999 110.309 169.752 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -73.38 60.48 0.62 Allowed 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.91 0.884 . . . . 4.6200000000000001 109.981 177.62 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -89.03 -69.38 0.71 Allowed 'General case' 0 C--N 1.331 -0.223 0 O-C-N 120.533 -1.354 . . . . 2.9300000000000002 108.193 175.592 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 5.8 mp -68.18 -26.24 65.64 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 122.718 0.407 . . . . 3.3599999999999999 111.368 -173.424 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -72.95 0.61 10.74 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 123.999 0.92 . . . . 3.5499999999999998 113.132 -176.25 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 7.1 mptt -70.83 -32.2 69.18 Favored 'General case' 0 N--CA 1.455 -0.215 0 O-C-N 121.405 -0.809 . . . . 4.21 109.823 161.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -92.4 -58.17 2.46 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 123.335 0.654 . . . . 3.27 109.322 -172.087 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -98.31 175.97 5.87 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 123.597 0.759 . . . . 3.04 109.095 -178.055 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 15.9 p -109.51 -9.68 14.9 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 124.01 0.924 . . . . 2.5099999999999998 112.29 171.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -137.95 41.27 1.39 Allowed Glycine 0 CA--C 1.527 0.802 0 N-CA-C 111.079 -0.809 . . . . 1.1899999999999999 111.079 179.852 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -83.67 -177.5 6.72 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-O 121.948 0.88 . . . . 1.5900000000000001 111.422 176.544 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 2.2 tpt180 -89.04 24.2 2.18 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.121 1.369 . . . . 3.0800000000000001 113.409 -162.596 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -53.52 -55.58 24.28 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-O 122.54 1.162 . . . . 6.7400000000000002 111.344 -176.006 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.408 HD22 ' H ' ' A' ' 78' ' ' LEU . 0.4 OUTLIER -49.85 -35.53 23.56 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 126.87 2.068 . . . . 1.46 112.678 -177.857 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 19.3 m -70.68 102.4 2.28 Favored 'General case' 0 CA--C 1.514 -0.41 0 C-N-CA 118.558 -1.257 . . . . 0.88 109.172 176.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -62.24 -40.15 95.21 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 113.153 -1.839 . . . . 3.4399999999999999 109.371 -177.559 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 18.4 m -49.73 -51.82 36.06 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 120.391 1.45 . . . . 1.27 112.585 171.671 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -69.93 -46.78 64.62 Favored 'General case' 0 C--O 1.234 0.261 0 N-CA-C 108.903 -0.777 . . . . 2.6499999999999999 108.903 -172.216 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -54.1 -48.88 70.24 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-O 122.059 0.933 . . . . 0.78000000000000003 109.362 174.852 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 8.0 tmtt? -74.3 -29.61 61.71 Favored 'General case' 0 N--CA 1.442 -0.829 0 C-N-CA 124.869 1.268 . . . . 5.4900000000000002 110.245 -170.707 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 23.2 t -57.57 -51.12 70.78 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 119.232 0.924 . . . . 1.6799999999999999 108.642 170.317 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -60.39 -51.66 68.53 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-O 119.296 -0.383 . . . . 3.7599999999999998 110.125 176.25 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 37.1 ttp -50.19 -44.33 52.94 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 117.798 0.272 . . . . 2.4300000000000002 111.675 175.712 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -55.3 -45.49 76.25 Favored 'General case' 0 C--O 1.226 -0.172 0 C-N-CA 125.117 1.367 . . . . 0.53000000000000003 111.226 -171.577 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -88.46 -43.99 11.05 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 116.345 -0.389 . . . . 0.54000000000000004 110.702 -178.331 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -54.95 -41.94 71.71 Favored 'General case' 0 C--N 1.339 0.142 0 CA-C-N 117.809 0.277 . . . . 0.46999999999999997 110.694 178.722 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -74.39 104.34 5.09 Favored 'General case' 0 N--CA 1.442 -0.841 0 N-CA-C 108.264 -1.013 . . . . 1.21 108.264 175.145 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 24.1 p30 -99.1 5.87 46.76 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-O 119.525 -0.274 . . . . 2.8700000000000001 111.599 -177.832 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 45.7 m-20 -79.88 -52.22 8.15 Favored 'General case' 0 C--N 1.341 0.198 0 N-CA-C 108.944 -0.761 . . . . 1.3999999999999999 108.944 167.472 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 91.64 44.75 4.17 Favored Glycine 0 CA--C 1.529 0.929 0 N-CA-C 109.275 -1.53 . . . . 0.82999999999999996 109.275 -157.875 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -126.26 -48.66 1.57 Allowed 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 124.641 1.176 . . . . 2.46 110.533 177.47 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 126.52 -46.1 1.11 Allowed Glycine 0 C--N 1.337 0.585 0 C-N-CA 124.606 1.098 . . . . 0.75 110.372 171.111 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -60.12 114.89 3.1 Favored 'General case' 0 C--O 1.237 0.446 0 N-CA-C 108.915 -0.772 . . . . 3.6200000000000001 108.915 174.099 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 7.2 mt -97.94 153.71 3.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 C-N-CA 124.781 1.233 . . . . 0.77000000000000002 108.693 177.919 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -126.62 178.85 16.6 Favored Glycine 0 CA--C 1.526 0.747 0 N-CA-C 109.062 -1.615 . . . . 1.02 109.062 174.398 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -61.41 -47.25 86.63 Favored 'General case' 0 CA--C 1.516 -0.335 0 O-C-N 122.437 -0.449 . . . . 1.04 109.822 -175.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -55.33 -68.27 0.21 Allowed 'General case' 0 N--CA 1.447 -0.588 0 O-C-N 124.573 1.171 . . . . 3.6800000000000002 109.179 176.043 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -38.28 -49.72 1.41 Allowed 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.82 0.848 . . . . 1.3999999999999999 112.153 176.871 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 63.0 t80 -61.69 -56.76 16.21 Favored 'General case' 0 CA--C 1.537 0.451 0 O-C-N 122.399 -0.188 . . . . 3.5899999999999999 111.111 179.652 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 33.4 tp60 -57.55 -47.55 81.74 Favored 'General case' 0 C--O 1.218 -0.6 0 CA-C-O 117.281 -1.342 . . . . 5.0300000000000002 110.727 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -44.95 -56.59 4.45 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 120.793 1.633 . . . . 3.79 110.528 176.286 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -64.57 -47.55 78.28 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 120.18 -0.608 . . . . 3.6800000000000002 110.465 -177.301 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 42.8 t -56.22 -35.42 42.41 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.462 0 C-N-CA 123.058 0.543 . . . . 1.3600000000000001 112.379 176.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 52.3 t60 -73.38 -22.08 60.35 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 125.958 1.703 . . . . 2.6200000000000001 110.934 -174.395 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 23.2 t . . . . . 0 C--O 1.253 1.285 0 CA-C-O 115.066 -2.397 . . . . 2.6299999999999999 112.866 -176.181 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.574 HG22 HG12 ' A' ' 47' ' ' VAL . 1.2 pp . . . . . 0 CA--C 1.533 0.318 0 CA-C-O 121.306 0.574 . . . . 1.3100000000000001 111.349 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -60.76 -29.4 69.39 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 123.731 0.813 . . . . 1.8600000000000001 111.684 -175.189 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 48.0 t0 -122.18 55.84 1.12 Allowed 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 107.937 -1.134 . . . . 2.5499999999999998 107.937 -176.531 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -135.72 -52.67 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.222 0 CA-C-N 115.739 -0.664 . . . . 1.97 111.498 176.345 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 179.85 -60.8 0.01 OUTLIER 'General case' 0 N--CA 1.456 -0.135 0 N-CA-C 106.368 -1.716 . . . . 1.03 106.368 -173.386 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 25.5 m -49.94 -17.5 0.39 Allowed 'General case' 0 C--O 1.219 -0.53 0 N-CA-C 115.659 1.726 . . . . 2.02 115.659 -169.36 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -49.33 -46.13 46.4 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 121.157 1.799 . . . . 0.71999999999999997 112.151 168.381 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -66.17 -42.47 88.91 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 122.534 1.159 . . . . 2.0800000000000001 109.845 179.0 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -69.1 -41.08 77.93 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 115.341 -0.845 . . . . 2.71 109.247 -172.454 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 29.0 pt -63.52 -39.76 86.51 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.748 0 O-C-N 120.477 -1.39 . . . . 0.78000000000000003 110.78 173.37 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.57 -45.38 77.35 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 118.784 0.72 . . . . 0.68999999999999995 110.19 174.289 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -55.91 -57.34 12.5 Favored 'General case' 0 CA--C 1.531 0.241 0 O-C-N 122.18 -0.325 . . . . 0.63 110.975 171.131 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -48.45 -48.22 37.73 Favored 'General case' 0 C--O 1.231 0.098 0 C-N-CA 124.101 0.96 . . . . 0.59999999999999998 111.394 -177.421 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -52.23 -41.85 63.11 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 125.219 1.408 . . . . 2.8100000000000001 109.741 -177.925 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 38.4 tt0 -87.61 -49.36 7.22 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 117.747 0.248 . . . . 3.6000000000000001 110.835 -176.466 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 24.7 tp10 -47.49 -49.75 24.94 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 125.203 1.401 . . . . 3.7000000000000002 110.301 178.214 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 79.3 m -111.02 55.81 0.65 Allowed 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 108.007 -1.108 . . . . 1.52 108.007 178.169 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 71.2 ttt180 -77.95 -55.0 5.66 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 119.73 1.15 . . . . 4.2199999999999998 108.695 178.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -52.12 140.21 32.89 Favored Pre-proline 0 N--CA 1.446 -0.652 0 C-N-CA 124.795 1.238 . . . . 2.29 110.922 -178.163 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -57.8 151.53 55.68 Favored 'Trans proline' 0 N--CA 1.453 -0.873 0 C-N-CA 123.377 2.718 . . . . 1.21 110.441 -176.075 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 13.2 t70 69.52 -22.66 0.15 Allowed 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 127.472 2.309 . . . . 3.5299999999999998 114.941 -179.801 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 2.0 m -73.88 24.37 0.08 Allowed 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.837 1.655 . . . . 1.0900000000000001 113.439 -164.497 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -105.29 80.59 1.61 Allowed 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 119.374 0.988 . . . . 3.5 111.037 -163.385 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -71.0 145.04 91.04 Favored Pre-proline 0 C--O 1.234 0.26 0 C-N-CA 123.174 0.59 . . . . 2.9900000000000002 110.451 -177.597 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -66.01 -65.69 0.04 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.347 0 C-N-CA 122.193 1.928 . . . . 0.75 111.151 179.768 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.73 -42.14 67.79 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 123.829 0.851 . . . . 3.0699999999999998 110.822 -176.533 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 6.4 ttpt -58.74 -59.87 4.72 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 119.228 -0.415 . . . . 3.6699999999999999 109.955 174.678 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 11.3 t80 -53.76 -49.71 67.6 Favored 'General case' 0 C--O 1.224 -0.241 0 CA-C-N 118.261 0.482 . . . . 2.02 110.289 -176.632 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -41.32 -56.25 2.5 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 126.764 2.026 . . . . 4.7699999999999996 111.889 174.599 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 22.5 tt0 -68.58 -50.54 50.95 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 109.04 -0.726 . . . . 2.8999999999999999 109.04 -179.655 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -64.75 -20.63 66.46 Favored 'General case' 0 N--CA 1.441 -0.898 0 C-N-CA 124.207 1.003 . . . . 0.69999999999999996 112.265 -171.366 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 67.6 p -89.08 -9.19 52.07 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.482 1.513 . . . . 2.21 112.004 177.007 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 83.17 6.19 88.29 Favored Glycine 0 C--N 1.337 0.591 0 N-CA-C 111.558 -0.617 . . . . 0.68999999999999995 111.558 172.803 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 83.0 mt -66.94 -28.96 68.72 Favored 'General case' 0 N--CA 1.443 -0.802 0 O-C-N 122.182 -0.599 . . . . 1.24 109.998 179.173 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 19.5 p -58.5 -38.11 76.96 Favored 'General case' 0 N--CA 1.464 0.243 0 C-N-CA 123.395 0.678 . . . . 2.6499999999999999 111.912 165.85 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -83.66 -26.72 29.62 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 125.321 1.448 . . . . 5.9900000000000002 108.991 -166.93 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 18.2 mtt -54.26 -65.03 0.64 Allowed 'General case' 0 N--CA 1.447 -0.624 0 N-CA-C 113.85 1.056 . . . . 3.52 113.85 -177.306 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 30.8 t 117.27 147.22 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 129.031 2.933 . . . . 1.8500000000000001 108.352 -168.397 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -42.47 -37.79 1.72 Allowed 'General case' 0 C--N 1.34 0.155 0 C-N-CA 123.826 0.85 . . . . 0.57999999999999996 111.644 169.825 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 73.8 m-20 -59.5 -63.12 1.42 Allowed 'General case' 0 CA--C 1.529 0.16 0 CA-C-O 121.683 0.754 . . . . 1.8200000000000001 109.502 -178.796 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 20.8 mm100 -60.7 -40.3 91.72 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 115.755 -0.657 . . . . 3.02 110.479 -179.241 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 97.1 t -62.77 -42.54 96.63 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 CA-C-N 118.548 0.613 . . . . 0.65000000000000002 109.879 -179.762 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 21.7 ttmm -59.74 -41.47 90.99 Favored 'General case' 0 CA--C 1.533 0.299 0 O-C-N 121.426 -0.796 . . . . 3.1000000000000001 110.064 174.063 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -59.49 -58.89 6.61 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 117.729 0.24 . . . . 3.0600000000000001 111.135 174.989 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.574 HG12 HG22 ' A' ' 3' ' ' ILE . 4.1 m -56.6 -40.78 71.09 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 O-C-N 121.631 -0.668 . . . . 0.68000000000000005 110.955 -177.631 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 5.9 t80 -44.11 -44.8 7.83 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.942 0.897 . . . . 5.0899999999999999 111.884 172.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.54 -38.49 77.9 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 118.816 0.735 . . . . 4.5099999999999998 110.868 178.253 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -72.41 -34.54 67.94 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.027 0.531 . . . . 3.5699999999999998 110.173 178.221 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 5.1 mm -65.61 -54.45 27.97 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.166 0 C-N-CA 122.742 0.417 . . . . 1.8 110.325 177.753 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -75.85 67.45 2.25 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 108.478 -0.934 . . . . 2.0 108.478 -178.594 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 5.4 t30 -50.64 -40.36 52.95 Favored 'General case' 0 C--N 1.333 -0.14 0 C-N-CA 126.6 1.96 . . . . 1.9199999999999999 111.99 -172.821 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -78.79 -22.65 46.02 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 126.781 2.032 . . . . 2.3300000000000001 112.348 178.394 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 7.5 mt-30 62.4 31.53 17.19 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 126.183 1.793 . . . . 3.0600000000000001 113.473 -177.783 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 97.0 p -60.29 -35.85 76.51 Favored 'General case' 0 C--N 1.339 0.135 0 O-C-N 120.907 -1.121 . . . . 1.4099999999999999 111.236 167.555 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 88.61 -4.3 85.1 Favored Glycine 0 CA--C 1.531 1.085 0 CA-C-O 119.128 -0.818 . . . . 1.3200000000000001 111.787 -167.6 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 46.1 m-85 -109.77 140.94 43.09 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 124.012 0.925 . . . . 2.71 109.084 168.764 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.3 mt -118.23 76.61 1.09 Allowed 'General case' 0 N--CA 1.44 -0.934 0 C-N-CA 127.649 2.38 . . . . 2.7200000000000002 106.949 177.091 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -66.06 157.35 31.26 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 126.272 1.829 . . . . 2.7000000000000002 111.203 170.549 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -52.15 -44.02 64.35 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 123.524 0.73 . . . . 3.7599999999999998 112.813 -176.297 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -59.59 -37.01 77.4 Favored 'General case' 0 CA--C 1.535 0.386 0 O-C-N 121.537 -0.727 . . . . 3.4700000000000002 111.971 176.753 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 64.6 mt-10 -66.09 -42.87 88.74 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 118.922 0.783 . . . . 2.0 109.901 172.022 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 8.9 mp -57.01 -31.64 65.32 Favored 'General case' 0 CA--C 1.533 0.305 0 O-C-N 121.523 -0.736 . . . . 2.73 111.207 173.816 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 14.4 ttpt -73.62 0.73 11.86 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 113.046 0.758 . . . . 2.8999999999999999 113.046 175.808 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 66.7 t80 -150.91 68.88 0.95 Allowed 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 107.97 -1.122 . . . . 5.2000000000000002 107.97 167.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -117.01 -61.33 1.73 Allowed 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 128.529 2.732 . . . . 2.1600000000000001 108.463 -177.806 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -65.95 -21.4 66.42 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 123.858 0.863 . . . . 3.5 111.488 -178.182 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 77.8 mm-40 -62.58 -10.3 11.68 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 119.615 1.098 . . . . 2.2400000000000002 111.688 177.775 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.6 mptp? -67.98 -46.57 70.97 Favored 'General case' 0 C--N 1.342 0.247 0 O-C-N 120.51 -1.369 . . . . 2.8500000000000001 110.395 165.218 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 8.3 m-30 -74.37 -42.64 58.98 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 123.503 0.721 . . . . 3.0699999999999998 110.535 -169.239 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -142.73 -178.17 5.67 Favored 'General case' 0 C--O 1.226 -0.177 0 C-N-CA 124.561 1.145 . . . . 4.75 108.601 -176.704 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 10.2 m -116.92 22.7 12.42 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 123.079 0.552 . . . . 2.21 111.957 -178.111 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -168.19 45.3 0.23 Allowed Glycine 0 C--N 1.336 0.536 0 N-CA-C 111.157 -0.777 . . . . 1.03 111.157 -177.579 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.426 ' HB3' ' OE2' ' A' ' 77' ' ' GLU . . . -76.67 -150.27 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 121.292 0.568 . . . . 1.3700000000000001 111.073 -179.463 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -115.74 -6.77 12.13 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 123.997 0.919 . . . . 3.1299999999999999 112.801 -174.729 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.426 ' OE2' ' HB3' ' A' ' 75' ' ' ALA . 1.0 OUTLIER -49.18 -33.92 13.4 Favored 'General case' 0 C--O 1.226 -0.181 0 N-CA-C 113.348 0.869 . . . . 4.0599999999999996 113.348 -175.407 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.449 HD22 ' H ' ' A' ' 78' ' ' LEU . 0.2 OUTLIER -39.26 -53.02 1.96 Allowed 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 125.307 1.443 . . . . 0.95999999999999996 111.168 169.503 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 6.0 m -77.95 120.61 23.04 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-O 122.706 1.241 . . . . 1.1299999999999999 110.752 -176.375 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 56.4 mp0 -66.85 -33.42 75.57 Favored 'General case' 0 N--CA 1.441 -0.899 0 CA-C-N 114.025 -1.443 . . . . 3.9199999999999999 111.25 -174.967 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 5.9 t -57.75 -59.08 5.76 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 119.644 1.111 . . . . 1.8400000000000001 110.891 178.761 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 15.5 mp0 -56.28 -45.59 80.1 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 123.621 0.768 . . . . 3.4500000000000002 111.217 177.273 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -55.36 -48.67 73.91 Favored 'General case' 0 N--CA 1.457 -0.096 0 N-CA-C 109.298 -0.63 . . . . 0.58999999999999997 109.298 176.861 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 7.8 tmtt? -67.8 -32.79 73.6 Favored 'General case' 0 N--CA 1.443 -0.803 0 C-N-CA 123.661 0.785 . . . . 5.7300000000000004 110.611 -174.71 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 20.3 m -58.08 -44.83 87.8 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 124.025 0.93 . . . . 1.47 110.183 171.223 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -63.32 -54.99 28.33 Favored 'General case' 0 C--O 1.236 0.374 0 O-C-N 122.065 -0.397 . . . . 3.46 110.646 172.43 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 3.7 ttp -45.62 -45.14 13.66 Favored 'General case' 0 C--O 1.223 -0.332 0 C-N-CA 123.361 0.664 . . . . 3.5 111.486 177.458 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -55.58 -44.77 77.23 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 125.646 1.578 . . . . 0.71999999999999997 112.058 -173.405 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -84.8 -43.03 14.58 Favored 'General case' 0 N--CA 1.461 0.088 0 CA-C-O 120.626 0.25 . . . . 0.80000000000000004 110.822 179.405 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -58.3 -42.33 86.41 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 123.027 0.531 . . . . 0.45000000000000001 111.07 -178.404 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -74.34 87.0 2.0 Allowed 'General case' 0 N--CA 1.445 -0.714 0 N-CA-C 109.131 -0.692 . . . . 0.83999999999999997 109.131 178.497 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 9.3 m-80 -82.2 39.8 0.6 Allowed 'General case' 0 CA--C 1.535 0.379 0 O-C-N 121.18 -0.95 . . . . 3.2200000000000002 109.99 -177.233 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 45.8 m-20 -127.98 -58.23 1.22 Allowed 'General case' 0 C--N 1.339 0.119 0 C-N-CA 124.829 1.252 . . . . 1.3700000000000001 109.039 -178.146 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 100.78 44.98 2.0 Allowed Glycine 0 CA--C 1.53 1.028 0 N-CA-C 109.61 -1.396 . . . . 0.90000000000000002 109.61 -162.197 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -127.54 -51.9 1.37 Allowed 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.669 1.188 . . . . 1.9399999999999999 110.041 174.872 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 124.17 -36.73 2.86 Favored Glycine 0 CA--C 1.525 0.699 0 C-N-CA 124.527 1.06 . . . . 0.68000000000000005 111.543 175.224 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 51.7 mttm -70.29 116.28 10.46 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 107.806 -1.183 . . . . 4.7300000000000004 107.806 175.608 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 4.0 mt -89.18 166.4 1.86 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.334 0 N-CA-C 107.459 -1.312 . . . . 1.3899999999999999 107.459 173.71 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -144.58 178.79 22.24 Favored Glycine 0 N--CA 1.446 -0.663 0 N-CA-C 107.177 -2.369 . . . . 0.87 107.177 172.08 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -55.01 -46.04 75.17 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 109.62 -0.511 . . . . 0.81999999999999995 109.62 -176.575 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 22.9 tt0 -58.86 -63.25 1.37 Allowed 'General case' 0 N--CA 1.444 -0.766 0 O-C-N 124.24 0.962 . . . . 2.4900000000000002 109.538 -176.613 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -46.21 -47.54 17.82 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 123.455 0.702 . . . . 1.27 112.205 174.971 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -61.61 -53.76 51.91 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-O 121.405 0.621 . . . . 2.9100000000000001 109.858 -176.771 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -62.28 -32.64 73.38 Favored 'General case' 0 C--O 1.218 -0.594 0 C-N-CA 124.066 0.947 . . . . 2.5499999999999998 110.717 178.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 30.5 mm-40 -64.22 -54.02 39.97 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-N 120.07 1.304 . . . . 3.48 109.931 175.646 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.05 -52.6 62.68 Favored 'General case' 0 CA--C 1.531 0.237 0 N-CA-C 108.029 -1.101 . . . . 2.9900000000000002 108.029 -179.938 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 71.7 t -70.0 -34.07 58.12 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.607 0 CA-C-N 115.594 -0.73 . . . . 1.1699999999999999 112.821 -174.19 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 6.7 t-80 -86.66 8.12 23.71 Favored 'General case' 0 CA--C 1.534 0.356 0 O-C-N 119.734 -1.853 . . . . 3.3399999999999999 111.269 -178.037 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 32.2 t . . . . . 0 C--O 1.254 1.311 0 CA-C-O 115.518 -2.182 . . . . 2.3900000000000001 111.386 178.55 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.614 HG22 HG12 ' A' ' 47' ' ' VAL . 0.2 OUTLIER . . . . . 0 CA--C 1.536 0.404 0 N-CA-C 112.899 0.704 . . . . 1.51 112.899 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -44.06 -50.27 8.49 Favored 'General case' 0 N--CA 1.442 -0.84 0 C-N-CA 125.697 1.599 . . . . 2.3399999999999999 110.106 170.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -86.02 46.41 1.32 Allowed 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.462 1.105 . . . . 3.3799999999999999 110.418 -173.273 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 25.3 t -142.01 -58.96 0.21 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.1 0 C-N-CA 123.905 0.882 . . . . 1.52 108.936 177.248 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 9.8 tp -171.41 -51.82 0.02 OUTLIER 'General case' 0 C--O 1.232 0.159 0 N-CA-C 106.943 -1.502 . . . . 1.25 106.943 -174.201 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 18.7 m -48.67 -21.14 0.55 Allowed 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 116.052 1.871 . . . . 1.02 116.052 -166.527 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -50.47 -49.09 56.15 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 120.286 1.403 . . . . 0.68999999999999995 111.46 171.461 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -65.45 -42.94 91.81 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-O 122.086 0.946 . . . . 1.8400000000000001 109.596 -177.694 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 27.7 m-20 -62.06 -51.1 69.34 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 115.187 -0.915 . . . . 2.5299999999999998 109.046 -176.889 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 16.9 pt -63.27 -39.58 85.79 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.916 0 O-C-N 121.683 -0.636 . . . . 0.81000000000000005 111.601 178.661 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -54.66 -44.94 73.73 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 118.356 0.525 . . . . 0.56000000000000005 110.774 173.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.41 -56.61 16.57 Favored 'General case' 0 CA--C 1.535 0.378 0 O-C-N 122.014 -0.429 . . . . 0.60999999999999999 110.855 173.485 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.534 ' HB1' ' CE2' ' A' ' 30' ' ' PHE . . . -47.59 -48.35 28.18 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 125.89 1.676 . . . . 0.56000000000000005 111.369 -177.052 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 14.3 tp -50.21 -42.29 51.31 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 126.166 1.786 . . . . 2.3900000000000001 110.532 177.868 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 4.9 tm0? -86.44 -45.52 11.07 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 123.884 0.874 . . . . 3.5899999999999999 109.163 -171.176 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -61.79 -44.44 96.87 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 120.737 0.303 . . . . 3.4500000000000002 110.421 -178.804 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 69.5 m -104.83 67.16 0.79 Allowed 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 107.153 -1.425 . . . . 1.48 107.153 175.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 19.2 ttt-85 -102.89 -2.8 27.19 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 119.473 1.033 . . . . 5.2699999999999996 113.27 178.545 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -103.11 155.18 36.97 Favored Pre-proline 0 CA--C 1.533 0.322 0 C-N-CA 124.277 1.031 . . . . 2.2799999999999998 110.626 -173.577 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -66.07 126.88 16.56 Favored 'Trans proline' 0 N--CA 1.453 -0.876 0 C-N-CA 122.423 2.082 . . . . 1.4099999999999999 111.121 -176.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 42.6 m-20 63.19 53.28 2.29 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 127.907 2.483 . . . . 2.5099999999999998 110.107 175.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.5 m -118.73 -18.44 8.96 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 124.326 1.05 . . . . 0.76000000000000001 112.828 179.738 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 19.4 t80 -60.74 106.05 0.52 Allowed 'General case' 0 N--CA 1.446 -0.655 0 C-N-CA 124.326 1.05 . . . . 3.1600000000000001 109.856 -174.686 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -86.99 142.78 34.22 Favored Pre-proline 0 CA--C 1.534 0.354 0 N-CA-C 108.572 -0.899 . . . . 2.6899999999999999 108.572 165.637 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -65.34 -67.97 0.04 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.107 0 C-N-CA 123.169 2.579 . . . . 0.57999999999999996 110.476 -179.337 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 40.5 mt-30 -55.39 -41.86 73.22 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.302 0.641 . . . . 2.27 110.73 -176.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 12.4 tptp -51.87 -69.71 0.11 Allowed 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 109.629 -0.508 . . . . 3.2999999999999998 109.629 172.716 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.534 ' CE2' ' HB1' ' A' ' 15' ' ' ALA . 40.2 t80 -55.72 -37.09 67.95 Favored 'General case' 0 C--O 1.221 -0.44 0 C-N-CA 123.329 0.652 . . . . 2.8900000000000001 111.043 -173.967 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.49 ' CE1' ' HA ' ' A' ' 107' ' ' VAL . 0.7 OUTLIER -55.82 -59.14 5.3 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 126.138 1.775 . . . . 4.6699999999999999 110.297 177.459 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 42.1 mt-30 -61.1 -44.24 97.65 Favored 'General case' 0 CA--C 1.517 -0.312 0 N-CA-C 108.697 -0.853 . . . . 3.0299999999999998 108.697 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -65.21 -30.56 71.46 Favored 'General case' 0 N--CA 1.434 -1.274 0 N-CA-C 113.094 0.776 . . . . 0.76000000000000001 113.094 -175.228 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 34.9 t -74.54 -0.73 18.61 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 123.712 0.805 . . . . 1.6599999999999999 109.773 174.559 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 75.32 5.45 77.19 Favored Glycine 0 C--N 1.339 0.743 0 N-CA-C 111.039 -0.824 . . . . 0.67000000000000004 111.039 178.381 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.484 HD21 HG21 ' A' ' 47' ' ' VAL . 5.0 mt -70.45 -25.12 63.04 Favored 'General case' 0 N--CA 1.447 -0.618 0 O-C-N 121.387 -1.067 . . . . 2.0299999999999998 110.822 -170.7 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.442 ' HB3' ' CZ ' ' A' ' 31' ' ' PHE . 25.4 p -65.72 -27.96 68.71 Favored 'General case' 0 CA--C 1.529 0.139 0 C-N-CA 123.644 0.778 . . . . 2.3500000000000001 110.775 171.413 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 12.5 tptt -86.86 -33.64 19.73 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 108.428 -0.952 . . . . 3.8399999999999999 108.428 -178.582 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 30.0 mtt -58.54 131.39 50.62 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 118.789 -1.164 . . . . 2.8599999999999999 111.044 172.63 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 82.2 p -70.6 158.15 36.68 Favored 'General case' 0 CA--C 1.533 0.298 0 O-C-N 121.675 -0.64 . . . . 2.6000000000000001 110.11 178.29 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -43.59 -36.84 2.26 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.78 1.232 . . . . 0.78000000000000003 113.082 177.337 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 9.3 m-80 -56.56 -61.8 2.17 Favored 'General case' 0 CA--C 1.527 0.091 0 C-N-CA 124.128 0.971 . . . . 1.5800000000000001 109.21 175.045 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 23.5 mm100 -59.54 -45.61 91.29 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 115.804 -0.634 . . . . 2.8799999999999999 110.076 -179.506 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.519 HG13 HG11 ' A' ' 107' ' ' VAL . 73.1 t -57.13 -46.15 84.51 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 CA-C-N 118.975 0.807 . . . . 0.69999999999999996 110.0 -177.452 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 3.2 ttpm? -72.59 -29.64 63.69 Favored 'General case' 0 N--CA 1.448 -0.554 0 O-C-N 121.798 -0.564 . . . . 3.8399999999999999 111.519 179.896 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -62.74 -58.51 7.22 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 118.939 0.791 . . . . 2.8399999999999999 110.67 170.365 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.614 HG12 HG22 ' A' ' 3' ' ' ILE . 12.0 m -53.02 -44.67 51.13 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.174 0 O-C-N 121.8 -0.563 . . . . 0.56000000000000005 110.224 -179.209 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.46 ' CZ ' ' HB2' ' A' ' 100' ' ' ALA . 13.5 t80 -42.3 -50.83 4.97 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 123.262 0.625 . . . . 4.6699999999999999 111.827 171.111 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 65.4 mtp85 -65.8 -34.39 78.06 Favored 'General case' 0 CA--C 1.529 0.173 0 C-N-CA 122.895 0.478 . . . . 3.1899999999999999 110.926 179.183 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -61.89 -40.55 95.8 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 109.802 -0.444 . . . . 3.75 109.802 175.445 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.504 HG21 ' CD1' ' A' ' 67' ' ' PHE . 25.5 mm -84.06 -47.49 17.65 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 CA-C-O 118.088 -0.958 . . . . 1.45 113.233 -173.648 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -72.46 71.47 0.94 Allowed 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 106.536 -1.653 . . . . 1.9399999999999999 106.536 170.876 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -57.2 -36.74 71.21 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 126.842 2.057 . . . . 2.2000000000000002 111.521 -173.476 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 12.0 p-10 -58.18 -27.24 63.67 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 126.748 2.019 . . . . 3.0299999999999998 112.23 170.224 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 22.7 mt-30 49.95 57.89 6.06 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 126.047 1.739 . . . . 3.2599999999999998 110.145 -172.795 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 78.3 p -80.1 -42.8 22.89 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 114.137 -1.392 . . . . 1.3799999999999999 109.769 171.67 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 117.38 -26.98 7.89 Favored Glycine 0 CA--C 1.53 1.005 0 CA-C-O 119.343 -0.698 . . . . 1.55 111.718 -169.622 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 37.3 m-85 -118.96 138.76 52.57 Favored 'General case' 0 C--N 1.34 0.171 0 C-N-CA 123.898 0.879 . . . . 2.9399999999999999 110.344 -178.24 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -84.7 76.07 10.25 Favored 'General case' 0 N--CA 1.456 -0.146 0 N-CA-C 107.036 -1.468 . . . . 1.75 107.036 167.725 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -54.83 155.77 4.13 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.718 1.207 . . . . 1.53 109.727 171.461 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -44.48 -54.35 6.06 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 123.647 0.779 . . . . 3.2999999999999998 111.874 -177.73 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -56.09 -35.46 67.05 Favored 'General case' 0 CA--C 1.534 0.327 0 N-CA-C 114.132 1.16 . . . . 3.6299999999999999 114.132 176.802 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -65.39 -37.47 87.07 Favored 'General case' 0 N--CA 1.462 0.127 0 CA-C-N 120.543 1.519 . . . . 3.25 109.622 174.608 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 60.1 mt -73.2 14.27 0.33 Allowed 'General case' 0 C--O 1.222 -0.393 0 CA-C-O 118.523 -0.751 . . . . 2.1800000000000002 112.408 170.193 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 27.2 ttpt -97.31 0.04 47.35 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 120.084 1.311 . . . . 2.02 109.716 162.163 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 92.1 m-85 -149.11 32.77 0.74 Allowed 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.567 0.747 . . . . 4.5800000000000001 111.795 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.504 ' CD1' HG21 ' A' ' 51' ' ' ILE . 46.0 t80 -64.77 -72.22 0.16 Allowed 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 119.625 1.102 . . . . 2.3500000000000001 109.82 -179.869 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 15.7 mt -65.98 -16.92 64.31 Favored 'General case' 0 CA--C 1.534 0.33 0 O-C-N 120.494 -1.379 . . . . 2.4100000000000001 113.205 177.48 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 74.1 mm-40 -57.25 -33.18 67.31 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 121.032 -1.042 . . . . 1.8600000000000001 111.347 176.395 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 1.6 mptp? -83.47 -13.56 54.43 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 118.792 0.723 . . . . 3.73 112.227 174.957 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 24.5 m-85 -75.29 -56.48 4.68 Favored 'General case' 0 C--N 1.338 0.104 0 N-CA-C 108.702 -0.851 . . . . 3.2200000000000002 108.702 171.309 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 28.2 tp10 -118.06 -63.76 1.38 Allowed 'General case' 0 CA--C 1.531 0.248 0 O-C-N 124.148 0.905 . . . . 3.8199999999999998 110.416 -169.824 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 8.7 t 104.3 117.68 0.01 OUTLIER 'General case' 0 C--N 1.341 0.236 0 C-N-CA 127.68 2.392 . . . . 2.9300000000000002 107.546 -170.014 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 90.36 24.9 27.54 Favored Glycine 0 CA--C 1.529 0.958 0 C-N-CA 124.59 1.09 . . . . 1.51 111.943 -176.853 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -87.19 173.42 9.24 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.742 0.817 . . . . 1.8799999999999999 110.744 176.673 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.76 -13.84 1.96 Allowed 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 126.913 2.085 . . . . 3.75 115.765 -167.048 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 73.8 mm-40 -37.71 -41.66 0.51 Allowed 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 126.494 1.917 . . . . 3.6099999999999999 114.424 -173.251 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.605 HD22 ' H ' ' A' ' 78' ' ' LEU . 1.1 mm? -48.86 -41.65 33.92 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 123.584 0.753 . . . . 0.94999999999999996 112.522 177.368 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 31.5 m -71.59 110.09 5.94 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 121.836 0.827 . . . . 0.76000000000000001 110.585 178.602 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 24.6 mp0 -59.55 -42.99 93.64 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 114.786 -1.097 . . . . 3.6000000000000001 110.09 -178.84 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 2.6 m -52.32 -55.18 23.2 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.836 0.854 . . . . 1.5800000000000001 112.278 177.168 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -67.39 -41.65 84.63 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 108.505 -0.924 . . . . 2.7799999999999998 108.505 -173.089 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -53.01 -52.16 59.34 Favored 'General case' 0 CA--C 1.517 -0.307 0 C-N-CA 123.496 0.718 . . . . 0.57999999999999996 109.151 171.718 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 12.5 tttt -73.56 -23.14 59.93 Favored 'General case' 0 N--CA 1.438 -1.039 0 CA-C-N 116.05 -0.523 . . . . 4.5899999999999999 110.465 -171.209 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 21.9 m -63.49 -43.64 96.68 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.599 0.76 . . . . 1.6200000000000001 110.22 167.232 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.6 tt -59.33 -61.77 2.38 Favored 'General case' 0 CA--C 1.533 0.3 0 N-CA-C 108.6 -0.889 . . . . 2.3199999999999998 108.6 169.957 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 35.3 ttp -47.18 -49.27 22.99 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 112.412 0.523 . . . . 2.4900000000000002 112.412 -177.616 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -52.42 -40.7 62.49 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 125.851 1.66 . . . . 0.48999999999999999 112.274 -173.604 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -90.83 -36.98 13.9 Favored 'General case' 0 C--O 1.226 -0.155 0 C-N-CA 122.355 0.262 . . . . 0.5 111.351 179.52 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -57.7 -44.44 85.88 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 122.319 0.248 . . . . 0.37 111.044 177.897 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 8.8 t0 -66.45 120.6 13.64 Favored 'General case' 0 N--CA 1.442 -0.845 0 N-CA-C 108.292 -1.003 . . . . 1.75 108.292 174.461 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 49.1 p30 -104.35 11.13 35.05 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 112.63 0.604 . . . . 3.3100000000000001 112.63 176.022 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -95.01 -52.89 4.03 Favored 'General case' 0 C--N 1.342 0.279 0 CA-C-N 118.731 0.696 . . . . 1.3899999999999999 110.414 173.626 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 97.38 47.94 2.1 Favored Glycine 0 CA--C 1.53 1.025 0 N-CA-C 108.676 -1.77 . . . . 0.89000000000000001 108.676 -156.383 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 36.2 p30 -128.29 -64.78 0.93 Allowed 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 126.355 1.862 . . . . 1.9399999999999999 110.055 175.036 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 140.13 -49.39 0.8 Allowed Glycine 0 CA--C 1.522 0.516 0 C-N-CA 125.31 1.433 . . . . 0.85999999999999999 109.52 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 23.2 pttm -53.22 128.39 27.84 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 109.473 -0.565 . . . . 5.2699999999999996 109.473 174.455 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 5.6 mt -118.6 107.94 22.94 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.325 0 C-N-CA 125.518 1.527 . . . . 0.71999999999999997 108.233 -175.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -66.97 163.8 44.3 Favored Glycine 0 CA--C 1.532 1.102 0 N-CA-C 110.993 -0.843 . . . . 0.58999999999999997 110.993 172.477 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . 0.46 ' HB2' ' CZ ' ' A' ' 48' ' ' PHE . . . -51.93 -38.78 57.65 Favored 'General case' 0 C--N 1.339 0.13 0 O-C-N 122.104 -0.645 . . . . 0.71999999999999997 109.631 168.215 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -59.59 -55.63 32.03 Favored 'General case' 0 N--CA 1.444 -0.758 0 CA-C-N 115.142 -0.935 . . . . 2.4500000000000002 109.91 178.788 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -52.66 -46.37 67.16 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.616 0.766 . . . . 2.23 110.679 175.357 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 85.4 t80 -56.51 -57.64 11.46 Favored 'General case' 0 CA--C 1.536 0.406 0 O-C-N 121.816 -0.553 . . . . 4.1699999999999999 111.349 177.548 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 30.8 tt0 -55.97 -37.81 69.56 Favored 'General case' 0 CA--C 1.533 0.299 0 O-C-N 121.748 -0.595 . . . . 2.1800000000000002 110.294 177.183 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -56.8 -60.8 3.04 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 123.42 0.688 . . . . 4.5800000000000001 109.872 178.531 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 12.0 ptm -57.47 -43.41 84.02 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 119.822 -0.751 . . . . 5.7000000000000002 109.65 178.543 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' VAL . . . . . 0.519 HG11 HG13 ' A' ' 44' ' ' VAL . 57.1 t -69.65 -16.88 20.88 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 N-CA-C 112.126 0.417 . . . . 1.3899999999999999 112.126 -175.297 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -76.01 -23.52 55.22 Favored 'General case' 0 CA--C 1.538 0.483 0 O-C-N 120.123 -1.61 . . . . 2.6000000000000001 110.903 175.981 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 15.5 t . . . . . 0 C--O 1.252 1.216 0 CA-C-O 116.36 -1.781 . . . . 2.46 114.017 -164.456 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 2.3 pp . . . . . 0 CA--C 1.535 0.37 0 CA-C-O 121.451 0.643 . . . . 1.2 111.392 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 2.3 t -51.88 -44.03 63.56 Favored 'General case' 0 N--CA 1.436 -1.142 0 C-N-CA 125.401 1.48 . . . . 1.73 111.14 174.319 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 23.3 t0 -98.18 42.25 1.1 Allowed 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 126.538 1.935 . . . . 3.4100000000000001 109.423 -173.132 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 97.4 t -136.73 -59.95 0.44 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.101 0 C-N-CA 124.997 1.319 . . . . 1.72 108.611 177.646 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -170.87 -47.24 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.116 0 N-CA-C 107.395 -1.335 . . . . 1.3600000000000001 107.395 -177.432 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 20.3 m -49.08 -22.84 1.01 Allowed 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 116.639 2.088 . . . . 1.0900000000000001 116.639 -166.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -49.35 -42.16 40.99 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 119.823 1.192 . . . . 0.88 112.291 169.107 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -68.42 -40.05 81.35 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 121.829 0.823 . . . . 2.0699999999999998 110.41 176.593 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -61.28 -47.19 87.15 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 115.797 -0.638 . . . . 4.96 109.834 -177.788 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 34.6 pt -65.57 -38.22 81.87 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.11 0 CA-C-O 119.163 -0.446 . . . . 1.1100000000000001 109.797 -177.711 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.93 -46.46 78.46 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 118.341 0.519 . . . . 0.60999999999999999 111.274 173.378 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.95 -61.04 2.93 Favored 'General case' 0 C--O 1.234 0.262 0 O-C-N 121.961 -0.462 . . . . 0.65000000000000002 111.012 174.273 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -51.27 -44.79 61.89 Favored 'General case' 0 CA--C 1.528 0.099 0 C-N-CA 123.56 0.744 . . . . 0.52000000000000002 111.167 -176.892 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.438 HD23 ' HG2' ' A' ' 17' ' ' GLN . 0.8 OUTLIER -48.72 -44.41 38.23 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 125.54 1.536 . . . . 3.2999999999999998 111.903 177.907 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.438 ' HG2' HD23 ' A' ' 16' ' ' LEU . 2.9 mm100 -86.67 -49.39 7.53 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 119.222 0.919 . . . . 3.2999999999999998 110.946 178.616 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 55.3 tp10 -50.63 -47.45 58.37 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.978 0.911 . . . . 3.8999999999999999 110.803 -177.682 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 74.6 m -112.52 58.86 0.64 Allowed 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 124.757 1.223 . . . . 1.6200000000000001 108.031 177.262 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 56.8 ttt180 -82.82 -54.17 5.31 Favored 'General case' 0 CA--C 1.52 -0.176 0 O-C-N 121.522 -0.736 . . . . 4.04 109.701 178.257 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 36.6 m-20 -58.73 143.41 82.37 Favored Pre-proline 0 N--CA 1.449 -0.476 0 CA-C-N 115.171 -0.922 . . . . 2.1400000000000001 110.285 -173.5 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -64.57 134.89 43.11 Favored 'Trans proline' 0 N--CA 1.449 -1.137 0 C-N-CA 122.406 2.07 . . . . 1.2 110.402 -173.817 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 69.5 m-20 63.15 36.87 11.8 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 127.643 2.377 . . . . 2.6699999999999999 111.699 178.457 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 6.1 m -102.64 0.35 33.08 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 123.907 0.883 . . . . 0.65000000000000002 110.88 173.51 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -70.89 138.12 49.89 Favored 'General case' 0 N--CA 1.449 -0.487 0 O-C-N 121.35 -0.844 . . . . 2.29 110.582 -174.482 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -131.84 148.49 70.11 Favored Pre-proline 0 N--CA 1.452 -0.328 0 C-N-CA 123.965 0.906 . . . . 2.5099999999999998 109.395 170.731 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_endo -65.67 -71.64 0.02 OUTLIER 'Trans proline' 0 N--CA 1.451 -0.973 0 C-N-CA 123.741 2.961 . . . . 0.62 111.007 -178.856 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 53.7 mt-30 -51.8 -46.22 64.15 Favored 'General case' 0 C--O 1.233 0.205 0 C-N-CA 123.879 0.872 . . . . 2.1699999999999999 110.982 -178.725 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 16.9 tptt -47.75 -60.33 2.65 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 123.418 0.687 . . . . 2.7400000000000002 110.007 171.689 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.475 ' CE1' HD21 ' A' ' 68' ' ' LEU . 82.3 t80 -56.34 -47.06 79.57 Favored 'General case' 0 C--O 1.222 -0.362 0 C-N-CA 122.805 0.442 . . . . 2.23 110.846 -179.425 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 9.0 m-30 -54.34 -40.54 68.13 Favored 'General case' 0 CA--C 1.531 0.233 0 O-C-N 121.166 -0.959 . . . . 4.8600000000000003 111.411 -178.956 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 33.4 mt-30 -73.1 -54.75 7.73 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 110.331 -0.248 . . . . 3.1600000000000001 110.331 176.263 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -57.85 -39.07 76.87 Favored 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 123.15 0.58 . . . . 0.70999999999999996 110.332 -172.213 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 10.9 m -86.1 6.72 27.81 Favored 'General case' 0 N--CA 1.444 -0.744 0 C-N-CA 124.815 1.246 . . . . 2.1400000000000001 111.558 -177.748 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 75.23 -16.53 3.58 Favored Glycine 0 CA--C 1.531 1.063 0 O-C-N 119.366 -2.084 . . . . 0.67000000000000004 113.093 169.186 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 12.7 mt -56.15 -29.55 60.92 Favored 'General case' 0 N--CA 1.441 -0.89 0 C-N-CA 126.425 1.89 . . . . 1.6399999999999999 112.995 178.615 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 8.1 t -70.34 -32.96 70.91 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 123.521 0.728 . . . . 1.79 111.41 170.523 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 2.4 tptt -74.79 -36.7 62.5 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 108.397 -0.964 . . . . 5.1100000000000003 108.397 178.76 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 41.2 mtt -66.5 119.86 12.39 Favored 'General case' 0 N--CA 1.443 -0.788 0 N-CA-C 109.223 -0.658 . . . . 2.3100000000000001 109.223 173.512 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 16.4 t -63.46 161.97 13.44 Favored 'General case' 0 N--CA 1.453 -0.293 0 O-C-N 121.804 -0.56 . . . . 3.0899999999999999 109.651 174.454 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -37.7 -44.14 0.69 Allowed 'General case' 0 CA--C 1.527 0.091 0 C-N-CA 126.095 1.758 . . . . 0.83999999999999997 112.055 178.427 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 39.5 m-20 -39.92 -56.87 1.72 Allowed 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 125.937 1.695 . . . . 2.1200000000000001 111.565 174.761 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 9.1 mm100 -75.98 -36.68 59.15 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 122.991 0.516 . . . . 2.52 110.177 -176.589 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 4.2 t -61.17 -35.31 64.91 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.584 0 N-CA-C 108.721 -0.844 . . . . 0.95999999999999996 108.721 179.029 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 80.4 tttt -56.56 -50.03 73.11 Favored 'General case' 0 CA--C 1.531 0.235 0 O-C-N 121.157 -0.964 . . . . 3.3999999999999999 111.589 172.843 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -55.08 -52.51 62.98 Favored 'General case' 0 C--O 1.233 0.206 0 N-CA-C 110.072 -0.344 . . . . 2.6200000000000001 110.072 176.92 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 2.4 m -59.53 -45.3 94.05 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 C-N-CA 119.151 -1.019 . . . . 0.77000000000000002 110.803 179.688 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 10.9 m-85 -47.43 -48.96 26.22 Favored 'General case' 0 C--N 1.34 0.165 0 C-N-CA 124.072 0.949 . . . . 4.5700000000000003 111.912 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 4.4 mtt180 -61.01 -28.41 69.02 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 120.199 -0.601 . . . . 3.2999999999999998 111.877 179.638 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 7.6 t80 -72.18 -40.81 67.64 Favored 'General case' 0 N--CA 1.452 -0.343 0 O-C-N 121.955 -0.465 . . . . 4.1799999999999997 110.067 170.568 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 5.0 mm -66.82 -51.55 54.35 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-O 118.356 -0.831 . . . . 1.6200000000000001 111.654 -176.047 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -66.4 76.36 0.1 Allowed 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 107.361 -1.348 . . . . 2.2599999999999998 107.361 171.312 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -66.95 -30.25 70.33 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 123.665 0.786 . . . . 2.1499999999999999 109.621 178.819 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 38.5 p-10 -65.63 -44.01 87.78 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 123.545 0.738 . . . . 2.5 110.689 169.69 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . 0.297 0.0 OUTLIER 101.54 10.76 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 130.031 3.332 . . . . 4.8799999999999999 112.809 173.74 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 7.7 p -71.7 -39.77 69.97 Favored 'General case' 0 CA--C 1.528 0.133 0 N-CA-C 112.488 0.551 . . . . 1.71 112.488 -170.68 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 113.37 -26.39 10.34 Favored Glycine 0 CA--C 1.527 0.81 0 N-CA-C 111.61 -0.596 . . . . 1.8100000000000001 111.61 -179.444 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 86.5 m-85 -79.58 134.81 36.48 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 107.734 -1.209 . . . . 3.1499999999999999 107.734 166.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -92.62 71.94 5.01 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 105.526 -2.027 . . . . 2.6699999999999999 105.526 172.367 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.42 157.23 11.52 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-N 113.981 -1.463 . . . . 1.6100000000000001 108.979 179.544 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -45.0 -51.18 10.14 Favored 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 123.642 0.777 . . . . 4.2400000000000002 111.578 -172.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 20.2 mp0 -59.06 -30.6 68.18 Favored 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 114.427 1.269 . . . . 4.3200000000000003 114.427 178.708 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -59.35 -41.66 89.72 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 121.354 1.888 . . . . 2.6600000000000001 109.013 169.865 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -74.45 12.12 0.84 Allowed 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 123.632 0.773 . . . . 2.3399999999999999 112.44 174.905 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 32.2 ttpt -104.08 2.7 32.37 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 125.298 1.439 . . . . 2.6400000000000001 109.644 166.344 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 34.4 p90 -151.17 27.78 0.68 Allowed 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 119.126 0.875 . . . . 5.5999999999999996 113.342 171.881 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -56.54 -64.24 0.93 Allowed 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 119.209 0.913 . . . . 2.52 109.962 -179.585 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.475 HD21 ' CE1' ' A' ' 30' ' ' PHE . 7.1 mp -81.3 -17.02 50.74 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 112.873 0.694 . . . . 2.3700000000000001 112.873 -179.657 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 68.3 mm-40 -54.62 -33.17 60.08 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 119.653 1.115 . . . . 1.6100000000000001 110.31 174.856 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.2 mtpt -62.85 -23.43 67.3 Favored 'General case' 0 CA--C 1.535 0.383 0 O-C-N 121.962 -0.461 . . . . 3.3900000000000001 112.239 176.317 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 2.1 m-30 -98.31 -49.31 4.74 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 125.144 1.378 . . . . 3.1600000000000001 110.162 -174.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -137.47 135.71 37.07 Favored 'General case' 0 C--N 1.341 0.202 0 C-N-CA 125.12 1.368 . . . . 4.2300000000000004 108.769 -169.76 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 2.1 p -61.86 -32.95 73.34 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 124.805 1.242 . . . . 3.4100000000000001 113.978 -165.849 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -119.88 27.15 6.9 Favored Glycine 0 CA--C 1.524 0.599 0 C-N-CA 125.114 1.34 . . . . 1.55 110.761 -173.392 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.37 153.53 38.23 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 117.408 0.604 . . . . 2.0 110.77 179.182 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.48 17.14 0.07 Allowed 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 115.823 1.786 . . . . 3.29 115.823 -161.349 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 68.5 mm-40 -55.47 -35.38 65.44 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-O 122.271 1.034 . . . . 3.71 111.623 -176.603 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.414 HD22 ' H ' ' A' ' 78' ' ' LEU . 0.0 OUTLIER -56.75 -37.56 71.21 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 115.11 -0.95 . . . . 0.76000000000000001 111.507 177.242 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 54.2 m -74.57 107.63 6.82 Favored 'General case' 0 C--N 1.344 0.338 0 CA-C-N 118.994 0.815 . . . . 0.76000000000000001 109.295 -178.804 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 15.9 pt-20 -56.68 -41.48 77.37 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 114.513 -1.222 . . . . 2.6800000000000002 110.834 -178.221 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 66.1 m -59.39 -54.36 47.55 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 122.976 0.51 . . . . 1.3899999999999999 112.096 177.404 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 -59.48 -45.51 91.46 Favored 'General case' 0 C--O 1.232 0.171 0 O-C-N 121.423 -0.798 . . . . 3.0299999999999998 110.631 178.509 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -53.94 -47.86 70.84 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 121.696 0.76 . . . . 0.55000000000000004 109.71 174.529 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 14.8 mmtp -65.4 -29.71 70.45 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 123.892 0.877 . . . . 4.8499999999999996 111.357 -177.078 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.2 t -56.47 -46.61 80.32 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 119.285 0.948 . . . . 1.98 110.314 170.449 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 28.3 mt -64.2 -57.41 9.59 Favored 'General case' 0 C--O 1.235 0.319 0 O-C-N 121.761 -0.587 . . . . 2.5800000000000001 109.914 174.798 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 2.0 tpt -40.82 -52.89 2.97 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 123.675 0.79 . . . . 2.98 111.39 176.811 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -53.6 -48.4 69.3 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 126.792 2.037 . . . . 0.51000000000000001 111.875 -170.634 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -80.25 -47.44 14.59 Favored 'General case' 0 N--CA 1.457 -0.108 0 C-N-CA 121.186 -0.206 . . . . 0.60999999999999999 110.752 178.206 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -54.66 -38.38 66.87 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 120.664 0.269 . . . . 0.57999999999999996 110.996 -176.1 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -78.27 103.79 8.44 Favored 'General case' 0 N--CA 1.442 -0.842 0 CA-C-N 116.436 -0.347 . . . . 1.0900000000000001 110.197 178.191 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 9.4 m-80 -95.71 27.66 3.38 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 123.558 0.743 . . . . 2.8700000000000001 110.339 -177.664 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 45.2 m-20 -119.49 -51.07 2.3 Favored 'General case' 0 N--CA 1.46 0.041 0 C-N-CA 124.558 1.143 . . . . 1.4399999999999999 109.332 178.095 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 91.84 42.28 4.78 Favored Glycine 0 CA--C 1.527 0.829 0 N-CA-C 108.771 -1.732 . . . . 0.93999999999999995 108.771 -158.343 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 33.5 p30 -121.36 -63.21 1.35 Allowed 'General case' 0 C--N 1.342 0.253 0 C-N-CA 124.035 0.934 . . . . 2.2599999999999998 110.586 172.88 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 126.79 -31.91 3.8 Favored Glycine 0 CA--C 1.521 0.46 0 N-CA-C 111.261 -0.735 . . . . 1.0 111.261 177.745 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 25.7 pttm -58.29 101.11 0.07 Allowed 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 107.92 -1.141 . . . . 5.1200000000000001 107.92 162.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . 0.413 HG21 ' CD2' ' A' ' 103' ' ' PHE . 26.7 mt -94.57 147.99 5.3 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 N-CA-C 107.106 -1.442 . . . . 1.28 107.106 176.102 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -117.01 170.33 13.38 Favored Glycine 0 CA--C 1.523 0.572 0 N-CA-C 109.683 -1.367 . . . . 0.54000000000000004 109.683 175.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -59.59 -48.93 79.73 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 108.691 -0.855 . . . . 0.68999999999999995 108.691 178.783 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -54.22 -54.73 36.01 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 111.86 0.319 . . . . 3.02 111.86 177.201 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -47.65 -53.99 13.27 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.525 1.13 . . . . 1.6399999999999999 110.439 175.931 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . 0.413 ' CD2' HG21 ' A' ' 98' ' ' ILE . 0.1 OUTLIER -70.67 -38.83 73.82 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 119.37 -0.932 . . . . 3.8599999999999999 111.305 -177.548 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -57.53 -49.79 75.2 Favored 'General case' 0 C--O 1.221 -0.404 0 C-N-CA 124.133 0.973 . . . . 2.79 108.652 -179.154 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -50.53 -54.19 24.36 Favored 'General case' 0 CA--C 1.528 0.129 0 CA-C-N 118.819 0.736 . . . . 3.8900000000000001 110.367 176.887 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.12 -56.89 16.12 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 116.529 -0.305 . . . . 3.6600000000000001 111.013 -178.018 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 42.5 t -50.23 -45.71 24.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 C-N-CA 124.299 1.04 . . . . 1.53 111.359 177.878 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 10.9 t-160 -72.44 -11.12 60.55 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 125.053 1.341 . . . . 3.0499999999999998 111.016 -172.295 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 30.0 t . . . . . 0 C--O 1.252 1.188 0 C-N-CA 122.986 0.514 . . . . 3.3300000000000001 112.035 178.394 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 2.6 pp . . . . . 0 CA--C 1.535 0.384 0 CA-C-O 121.419 0.628 . . . . 2.4500000000000002 111.947 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.434 HG22 ' H ' ' A' ' 4' ' ' THR . 0.6 OUTLIER -81.22 57.69 3.28 Favored 'General case' 0 N--CA 1.439 -1.015 0 C-N-CA 126.322 1.849 . . . . 2.29 107.099 178.227 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 174.42 -48.92 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 126.324 1.85 . . . . 3.8199999999999998 108.952 176.161 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -46.13 -41.89 4.37 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.307 0 C-N-CA 125.766 1.626 . . . . 1.8899999999999999 112.224 -170.642 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -175.71 -60.11 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 105.867 -1.901 . . . . 1.6399999999999999 105.867 -171.556 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 2.6 m -50.83 -29.18 11.07 Favored 'General case' 0 N--CA 1.445 -0.694 0 C-N-CA 124.736 1.214 . . . . 1.1000000000000001 113.617 -170.12 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -49.73 -46.44 50.35 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 119.547 1.067 . . . . 0.85999999999999999 113.14 171.415 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 42.5 t0 -66.18 -43.39 87.0 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-O 122.707 1.241 . . . . 1.8700000000000001 108.911 179.921 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -64.38 -50.21 68.57 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 115.399 -0.819 . . . . 2.2799999999999998 109.581 -175.486 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 9.5 pt -60.18 -41.17 85.79 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.677 0 O-C-N 121.249 -0.907 . . . . 1.21 111.341 176.477 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -54.74 -42.27 71.4 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 118.999 0.818 . . . . 1.1000000000000001 111.014 174.181 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.84 -54.08 44.41 Favored 'General case' 0 CA--C 1.533 0.299 0 O-C-N 121.61 -0.681 . . . . 1.0900000000000001 111.064 171.373 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.403 ' HB2' HG23 ' A' ' 33' ' ' THR . . . -51.9 -44.64 63.86 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 124.89 1.276 . . . . 1.1499999999999999 111.379 -174.855 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.9 tp -48.12 -48.37 34.04 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 125.483 1.513 . . . . 2.5899999999999999 109.958 174.557 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 23.7 mt-30 -82.46 -28.01 31.51 Favored 'General case' 0 CA--C 1.528 0.125 0 N-CA-C 113.381 0.882 . . . . 3.1699999999999999 113.381 -178.921 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . 0.275 0.2 OUTLIER -71.82 -37.65 70.29 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 119.942 1.246 . . . . 3.6899999999999999 109.386 176.865 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 44.4 m -92.36 38.22 1.01 Allowed 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.184 1.394 . . . . 2.5 112.407 174.153 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.93 -37.39 67.2 Favored 'General case' 0 N--CA 1.47 0.534 0 O-C-N 120.444 -1.41 . . . . 8.2599999999999998 109.78 172.41 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -83.92 142.05 41.48 Favored Pre-proline 0 N--CA 1.447 -0.592 0 C-N-CA 124.092 0.957 . . . . 2.0299999999999998 108.889 -176.27 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -69.46 150.73 70.41 Favored 'Trans proline' 0 N--CA 1.46 -0.498 0 C-N-CA 123.489 2.792 . . . . 1.3899999999999999 112.008 -176.747 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 55.68 19.35 3.31 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.923 1.689 . . . . 2.29 112.945 178.57 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 55.5 m -91.82 -25.67 18.88 Favored 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 124.639 1.176 . . . . 0.94999999999999996 111.087 -173.913 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 3.8 t80 -49.29 122.81 6.49 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 123.769 0.828 . . . . 3.46 109.731 178.002 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -114.79 152.52 46.46 Favored Pre-proline 0 CA--C 1.536 0.422 0 C-N-CA 124.354 1.062 . . . . 2.73 108.984 168.692 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_endo -66.42 -70.61 0.02 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.819 0 C-N-CA 123.434 2.756 . . . . 1.03 111.545 -175.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 -54.07 -45.72 71.81 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 123.574 0.75 . . . . 2.5699999999999998 110.492 -179.196 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 22.3 tptt -45.77 -64.46 0.73 Allowed 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 123.666 0.786 . . . . 2.8999999999999999 109.15 172.455 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.432 ' CZ ' HD11 ' A' ' 68' ' ' LEU . 75.4 t80 -59.32 -44.32 92.61 Favored 'General case' 0 N--CA 1.447 -0.616 0 C-N-CA 122.485 0.314 . . . . 2.2599999999999998 111.455 -175.921 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 34.3 m-85 -57.17 -38.81 74.15 Favored 'General case' 0 N--CA 1.453 -0.29 0 O-C-N 121.394 -0.816 . . . . 5.0199999999999996 111.054 -178.741 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 4.3 mt-30 -71.37 -51.55 23.56 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 118.643 0.656 . . . . 2.7000000000000002 110.607 170.64 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.403 HG23 ' HB2' ' A' ' 15' ' ' ALA . 0.4 OUTLIER -58.67 -31.43 68.19 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 123.94 0.896 . . . . 1.3 111.804 -172.069 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.6 t -91.29 1.65 56.95 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 126.485 1.914 . . . . 1.8799999999999999 110.497 -176.876 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 90.37 -36.78 3.48 Favored Glycine 0 C--N 1.335 0.523 0 O-C-N 120.682 -1.262 . . . . 1.3400000000000001 110.192 170.477 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 3.3 mp -33.57 -52.57 0.4 Allowed 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 126.537 1.935 . . . . 3.0499999999999998 114.865 179.158 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 10.3 t -69.39 -27.31 65.19 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 119.523 1.056 . . . . 2.4700000000000002 111.49 -176.3 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 5.6 tmtp? -79.7 -39.27 31.61 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 108.994 -0.743 . . . . 3.25 108.994 176.419 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 9.6 mtt -57.67 143.31 42.02 Favored 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 123.532 0.733 . . . . 2.71 110.629 176.684 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 3.8 m -62.09 149.32 41.56 Favored 'General case' 0 N--CA 1.446 -0.627 0 O-C-N 121.873 -0.517 . . . . 1.96 109.878 172.909 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -37.89 -43.51 0.7 Allowed 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 125.054 1.342 . . . . 0.60999999999999999 111.913 171.076 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -53.29 -60.99 2.59 Favored 'General case' 0 C--O 1.227 -0.087 0 C-N-CA 124.249 1.02 . . . . 2.4199999999999999 110.061 178.038 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 28.7 mm100 -60.81 -39.08 87.63 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 123.092 0.557 . . . . 3.1400000000000001 109.893 -178.313 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 60.1 t -60.85 -44.63 98.09 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.29 0 CA-C-N 118.823 0.738 . . . . 0.53000000000000003 109.855 177.668 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 62.0 tttt -68.84 -39.64 79.85 Favored 'General case' 0 N--CA 1.451 -0.4 0 O-C-N 121.642 -0.661 . . . . 2.9700000000000002 110.692 -178.061 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -59.71 -58.2 9.6 Favored 'General case' 0 C--O 1.232 0.153 0 C-N-CA 122.749 0.419 . . . . 3.2200000000000002 110.2 173.211 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 14.0 m -55.63 -44.92 78.5 Favored 'Isoleucine or valine' 0 C--N 1.34 0.195 0 N-CA-C 109.59 -0.522 . . . . 0.52000000000000002 109.59 -179.189 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.557 ' CZ ' HD23 ' A' ' 59' ' ' LEU . 43.3 t80 -46.43 -64.23 0.81 Allowed 'General case' 0 C--N 1.341 0.229 0 N-CA-C 109.449 -0.574 . . . . 4.1500000000000004 109.449 171.723 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 63.8 mtt180 -54.67 -37.04 65.28 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 114.005 1.113 . . . . 4.5599999999999996 114.005 -178.711 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 27.1 m-85 -64.08 -52.97 56.72 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 119.282 0.946 . . . . 4.9699999999999998 109.981 175.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 35.8 mm -76.2 -20.63 15.29 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.691 0 O-C-N 121.816 -0.552 . . . . 2.7799999999999998 111.773 -171.409 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 43.7 t0 -48.53 -28.64 3.51 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 128.759 2.824 . . . . 2.6000000000000001 113.015 173.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 11.2 t-20 79.14 -56.09 0.43 Allowed 'General case' 0 C--N 1.339 0.144 0 C-N-CA 126.318 1.847 . . . . 3.5499999999999998 112.65 162.624 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 29.4 p30 -69.57 -39.14 77.54 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.966 0.907 . . . . 3.02 110.08 168.086 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . 0.278 1.2 pt20 83.95 24.09 0.12 Allowed 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 129.641 3.176 . . . . 3.6299999999999999 111.021 -171.922 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 89.0 p -77.14 -27.2 53.8 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 113.607 0.966 . . . . 2.3799999999999999 113.607 -174.069 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 98.44 24.47 11.15 Favored Glycine 0 CA--C 1.534 1.247 0 C-N-CA 125.28 1.419 . . . . 1.99 112.397 -173.175 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 44.7 m-85 -143.22 128.05 18.3 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 118.338 1.069 . . . . 3.04 111.112 -177.543 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.557 HD23 ' CZ ' ' A' ' 48' ' ' PHE . 1.6 mm? -109.19 70.19 0.73 Allowed 'General case' 0 C--N 1.339 0.125 0 C-N-CA 127.148 2.179 . . . . 2.0299999999999998 108.588 -179.685 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -54.28 159.05 2.08 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.563 1.545 . . . . 1.6100000000000001 111.076 173.268 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -36.55 -54.53 0.87 Allowed 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 125.852 1.661 . . . . 4.3200000000000003 112.082 176.19 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 -63.81 -45.48 89.47 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 115.957 -0.565 . . . . 3.21 110.337 -173.345 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 81.7 mt-10 -62.89 -40.23 96.9 Favored 'General case' 0 N--CA 1.449 -0.517 0 O-C-N 121.506 -0.746 . . . . 2.5699999999999998 110.513 178.547 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 6.2 mt -57.18 -50.57 72.43 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 120.921 0.391 . . . . 2.2799999999999998 110.294 171.122 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 14.7 ttpt -60.76 -16.06 36.21 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 126.04 1.736 . . . . 4.2599999999999998 112.441 178.694 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 69.6 m-85 -130.97 49.28 2.34 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.009 0.924 . . . . 6.3099999999999996 110.354 170.089 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 68.3 t80 -85.77 -76.88 0.32 Allowed 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 124.419 1.088 . . . . 3.4500000000000002 110.716 -178.214 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.432 HD11 ' CZ ' ' A' ' 30' ' ' PHE . 90.9 mt -61.15 -9.09 4.14 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 113.171 0.804 . . . . 2.52 113.171 -176.643 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 80.8 mm-40 -47.96 -61.97 1.7 Allowed 'General case' 0 N--CA 1.452 -0.353 0 O-C-N 121.492 -0.755 . . . . 1.6499999999999999 110.346 168.617 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -83.79 48.01 1.38 Allowed 'General case' 0 CA--C 1.537 0.448 0 O-C-N 121.22 -0.925 . . . . 3.8300000000000001 110.252 -177.267 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -153.12 -58.21 0.13 Allowed 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.165 0.986 . . . . 3.1099999999999999 108.352 -167.712 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -108.55 -37.24 5.99 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 126.176 1.79 . . . . 3.7599999999999998 109.904 175.291 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 1.4 p 78.81 107.8 0.07 Allowed 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 125.154 1.381 . . . . 3.2400000000000002 108.734 -172.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 72.81 48.83 19.97 Favored Glycine 0 CA--C 1.527 0.8 0 N-CA-C 110.323 -1.111 . . . . 1.3999999999999999 110.323 -176.118 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -79.11 -146.9 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.758 0.823 . . . . 1.45 109.795 173.68 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 7.2 tpt180 -102.7 -30.91 10.61 Favored 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 113.317 0.858 . . . . 3.5299999999999998 113.317 -171.249 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -31.02 -33.19 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 129.717 3.207 . . . . 3.75 115.907 -175.302 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.409 HD22 ' H ' ' A' ' 78' ' ' LEU . 0.3 OUTLIER -39.94 -46.05 1.98 Allowed 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.727 1.211 . . . . 1.3600000000000001 110.856 171.636 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 7.3 m -72.17 125.64 27.81 Favored 'General case' 0 C--N 1.343 0.311 0 C-N-CA 119.541 -0.864 . . . . 0.84999999999999998 110.936 176.136 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -69.33 -38.52 78.23 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-O 118.086 -0.959 . . . . 2.8999999999999999 111.738 177.904 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 19.1 m -48.47 -69.73 0.11 Allowed 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 119.768 1.167 . . . . 1.1499999999999999 111.365 168.458 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -48.84 -45.46 40.69 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 123.757 0.823 . . . . 3.29 110.524 -176.514 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 1.2 m -60.31 -49.88 75.86 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 121.693 0.759 . . . . 1.05 110.276 177.043 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 24.2 ttpp -64.76 -29.8 70.78 Favored 'General case' 0 N--CA 1.439 -0.997 0 CA-C-N 115.966 -0.561 . . . . 4.7300000000000004 110.696 -173.432 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 9.5 m -56.7 -33.75 66.77 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 119.476 1.034 . . . . 1.3400000000000001 112.083 169.615 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.2 tt -71.68 -61.76 1.66 Allowed 'General case' 0 C--O 1.236 0.356 0 N-CA-C 108.25 -1.018 . . . . 2.5800000000000001 108.25 169.832 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 2.1 ttm -46.11 -53.71 9.85 Favored 'General case' 0 C--O 1.221 -0.414 0 C-N-CA 123.335 0.654 . . . . 2.8599999999999999 111.105 -174.003 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -42.96 -37.85 2.02 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 127.579 2.351 . . . . 0.81000000000000005 113.34 179.92 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -97.62 -44.78 6.64 Favored 'General case' 0 C--O 1.227 -0.103 0 CA-C-O 120.897 0.38 . . . . 0.62 110.676 -175.746 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -53.9 -43.09 69.41 Favored 'General case' 0 N--CA 1.456 -0.15 0 C-N-CA 123.863 0.865 . . . . 0.55000000000000004 110.926 176.792 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -73.72 72.84 1.51 Allowed 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 124.772 1.229 . . . . 1.1799999999999999 109.541 -178.749 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 48.8 p-10 -77.17 51.83 0.86 Allowed 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.752 1.221 . . . . 2.7599999999999998 112.313 -172.68 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 31.9 p30 -163.29 -46.26 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 126.281 1.833 . . . . 3.7000000000000002 109.847 -175.017 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 99.98 55.05 1.01 Allowed Glycine 0 CA--C 1.525 0.699 0 N-CA-C 110.183 -1.167 . . . . 0.71999999999999997 110.183 173.739 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -123.84 -46.97 1.95 Allowed 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 126.33 1.852 . . . . 2.3500000000000001 109.918 175.01 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 123.5 -36.64 2.97 Favored Glycine 0 CA--C 1.529 0.953 0 C-N-CA 125.436 1.493 . . . . 0.66000000000000003 111.342 178.042 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 39.9 mmtt -71.8 128.86 37.11 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 108.501 -0.926 . . . . 6.1100000000000003 108.501 177.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 23.0 mt -119.39 116.31 50.4 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.253 0 C-N-CA 124.256 1.022 . . . . 0.72999999999999998 108.644 -173.916 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -81.28 167.45 49.19 Favored Glycine 0 CA--C 1.528 0.878 0 N-CA-C 110.863 -0.895 . . . . 0.47999999999999998 110.863 174.072 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -57.99 -37.81 74.94 Favored 'General case' 0 C--O 1.224 -0.28 0 N-CA-C 109.572 -0.529 . . . . 0.59999999999999998 109.572 172.737 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 60.2 mt-10 -56.65 -67.08 0.34 Allowed 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 124.064 0.946 . . . . 2.9399999999999999 109.49 175.013 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -40.04 -50.07 2.56 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.142 0.977 . . . . 1.3799999999999999 111.393 175.551 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -66.89 -55.45 14.66 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 112.01 0.374 . . . . 2.9100000000000001 112.01 -176.371 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 10.8 tt0 -53.58 -44.43 69.33 Favored 'General case' 0 C--O 1.221 -0.41 0 C-N-CA 124.212 1.005 . . . . 2.0800000000000001 109.28 178.826 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -50.86 -62.46 1.59 Allowed 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 119.266 0.939 . . . . 3.98 110.426 173.721 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.03 -42.6 94.72 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 120.726 -0.389 . . . . 3.1699999999999999 110.9 -173.67 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 57.2 t -58.85 -48.63 85.68 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.327 0 C-N-CA 124.103 0.961 . . . . 1.28 111.3 176.171 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 50.5 t-80 -72.81 -18.19 61.49 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 125.445 1.498 . . . . 2.4399999999999999 110.834 -170.761 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 22.9 t . . . . . 0 C--O 1.254 1.332 0 CA-C-O 114.989 -2.434 . . . . 2.5800000000000001 113.41 -179.856 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.637 HG22 HG12 ' A' ' 47' ' ' VAL . 1.5 pp . . . . . 0 CA--C 1.532 0.278 0 CA-C-O 121.803 0.811 . . . . 1.3999999999999999 111.514 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 10.2 t -69.03 -7.03 31.8 Favored 'General case' 0 N--CA 1.426 -1.653 0 C-N-CA 126.284 1.834 . . . . 1.79 111.662 -175.242 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 52.1 t0 -148.08 60.63 1.11 Allowed 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 108.026 -1.102 . . . . 2.6400000000000001 108.026 -179.474 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 3.1 p -145.38 -48.71 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.192 0 C-N-CA 123.842 0.857 . . . . 1.8 110.477 174.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -178.78 -48.83 0.01 OUTLIER 'General case' 0 CA--C 1.528 0.12 0 C-N-CA 126.121 1.768 . . . . 1.3600000000000001 106.536 -175.267 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 2.3 m -50.94 -24.02 3.31 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 115.67 1.729 . . . . 0.93999999999999995 115.67 -170.858 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -53.98 -41.51 67.96 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 119.543 1.065 . . . . 0.70999999999999996 112.273 172.124 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -74.4 -36.89 63.52 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 121.391 0.615 . . . . 1.97 109.931 178.546 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -56.26 -52.84 63.0 Favored 'General case' 0 C--O 1.234 0.263 0 C-N-CA 124.253 1.021 . . . . 2.8399999999999999 108.277 179.18 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 34.0 pt -63.14 -39.99 87.35 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.401 0 CA-C-N 115.087 -0.96 . . . . 0.90000000000000002 110.153 -177.278 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -52.43 -45.8 66.14 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 118.999 0.818 . . . . 0.90000000000000002 110.971 175.645 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.58 -59.6 5.19 Favored 'General case' 0 CA--C 1.533 0.322 0 O-C-N 122.144 -0.347 . . . . 0.79000000000000004 110.949 174.06 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -47.83 -44.3 28.77 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 124.055 0.942 . . . . 0.67000000000000004 111.933 -179.488 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -55.23 -37.04 66.66 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 125.058 1.343 . . . . 3.3900000000000001 110.831 -179.146 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.55 -42.73 12.54 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 122.478 0.311 . . . . 5.2000000000000002 110.368 -178.869 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -68.36 -36.99 80.03 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 118.073 0.397 . . . . 2.5 110.878 -174.189 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 39.5 m -116.83 69.05 0.75 Allowed 'General case' 0 C--N 1.339 0.119 0 C-N-CA 124.573 1.149 . . . . 1.4399999999999999 108.445 172.634 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 48.8 ttt180 -88.71 -55.19 3.81 Favored 'General case' 0 N--CA 1.456 -0.151 0 N-CA-C 109.352 -0.611 . . . . 5.2999999999999998 109.352 -179.247 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.419 ' O ' ' NH2' ' A' ' 76' ' ' ARG . 0.1 OUTLIER -60.53 138.03 92.59 Favored Pre-proline 0 C--O 1.224 -0.253 0 C-N-CA 124.43 1.092 . . . . 3.25 110.167 175.935 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -71.81 148.44 52.19 Favored 'Trans proline' 0 N--CA 1.458 -0.608 0 C-N-CA 123.462 2.775 . . . . 2.3199999999999998 111.294 -176.683 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.4 t70 82.83 4.14 1.01 Allowed 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 127.396 2.278 . . . . 2.4500000000000002 111.27 179.176 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 18.2 m -87.13 -7.28 58.17 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.621 1.168 . . . . 0.78000000000000003 112.935 -177.89 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -86.09 82.97 7.88 Favored 'General case' 0 CA--C 1.534 0.356 0 O-C-N 120.041 -1.662 . . . . 2.9900000000000002 113.196 -155.594 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -65.31 139.93 97.62 Favored Pre-proline 0 CA--C 1.534 0.364 0 O-C-N 121.64 -0.662 . . . . 2.1899999999999999 110.364 175.0 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -68.06 -63.18 0.05 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.17 0 C-N-CA 122.605 2.204 . . . . 0.82999999999999996 111.53 -176.263 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -53.94 -42.63 69.04 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 124.21 1.004 . . . . 2.7000000000000002 110.88 179.446 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -54.32 -61.56 2.23 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 123.052 0.541 . . . . 4.5099999999999998 109.714 174.858 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 8.4 t80 -53.72 -53.88 45.85 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-O 122.252 1.025 . . . . 2.1600000000000001 110.839 -177.238 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.548 ' CE1' ' HA ' ' A' ' 107' ' ' VAL . 2.7 t80 -40.0 -56.32 1.87 Allowed 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.275 1.43 . . . . 4.7699999999999996 111.81 175.2 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -70.55 -41.51 72.37 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 123.55 0.74 . . . . 2.5899999999999999 110.27 -179.457 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.2 t -63.86 -38.38 90.88 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 118.403 0.547 . . . . 1.46 110.926 -170.512 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 38.5 m -60.33 -57.09 14.26 Favored 'General case' 0 N--CA 1.443 -0.789 0 N-CA-C 107.656 -1.239 . . . . 3.3300000000000001 107.656 170.777 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 116.92 21.13 4.67 Favored Glycine 0 CA--C 1.525 0.708 0 N-CA-C 110.266 -1.134 . . . . 1.5 110.266 -172.896 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 1.8 mt -65.72 -24.6 67.02 Favored 'General case' 0 N--CA 1.451 -0.4 0 O-C-N 121.199 -1.177 . . . . 1.8899999999999999 109.587 176.203 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.406 ' HB2' ' CZ ' ' A' ' 31' ' ' PHE . 21.5 t -63.49 -18.6 63.97 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.196 0.598 . . . . 2.4300000000000002 110.4 173.07 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.24 -27.41 16.17 Favored 'General case' 0 N--CA 1.447 -0.585 0 O-C-N 121.665 -0.647 . . . . 5.5199999999999996 110.0 176.814 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 27.4 mmt -69.11 134.23 49.06 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 121.425 0.631 . . . . 3.5800000000000001 111.231 176.189 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 73.8 m -65.6 151.28 46.84 Favored 'General case' 0 N--CA 1.452 -0.326 0 O-C-N 121.876 -0.515 . . . . 1.6299999999999999 110.715 175.892 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -39.25 -41.2 0.85 Allowed 'General case' 0 C--O 1.224 -0.241 0 C-N-CA 125.595 1.558 . . . . 0.51000000000000001 111.998 172.488 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 65.6 m-20 -50.13 -59.83 3.54 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 124.049 0.94 . . . . 1.4399999999999999 110.744 175.864 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -72.11 -35.03 69.06 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 109.181 -0.674 . . . . 3.5099999999999998 109.181 -173.357 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 79.0 t -59.64 -43.04 90.3 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 O-C-N 121.584 -0.698 . . . . 0.46000000000000002 109.869 174.084 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 60.6 tttt -69.5 -42.02 75.29 Favored 'General case' 0 CA--C 1.536 0.417 0 O-C-N 120.809 -1.182 . . . . 2.5499999999999998 110.573 178.961 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -50.82 -61.41 2.23 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.33 0.652 . . . . 3.2200000000000002 110.349 171.475 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.637 HG12 HG22 ' A' ' 3' ' ' ILE . 18.0 m -54.85 -46.99 75.67 Favored 'Isoleucine or valine' 0 C--N 1.34 0.178 0 CA-C-O 118.214 -0.898 . . . . 0.5 110.821 178.499 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 25.6 t80 -43.99 -52.72 6.81 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 119.127 0.876 . . . . 4.3399999999999999 111.175 174.704 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 78.2 mtp180 -60.55 -37.38 81.04 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 120.499 -0.481 . . . . 3.3999999999999999 111.451 179.569 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 11.5 t80 -64.64 -34.19 77.71 Favored 'General case' 0 CA--C 1.534 0.348 0 O-C-N 122.274 -0.266 . . . . 3.9399999999999999 110.479 175.837 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.445 HG22 HD21 ' A' ' 59' ' ' LEU . 6.4 mm -68.58 -53.4 27.87 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 N-CA-C 109.909 -0.404 . . . . 1.4199999999999999 109.909 175.503 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -78.06 60.6 2.43 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.754 0.822 . . . . 2.1499999999999999 111.507 -172.026 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -52.05 -32.32 33.95 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 126.916 2.086 . . . . 1.97 113.334 -172.466 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 11.3 p-10 -72.25 -33.46 67.51 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.813 1.245 . . . . 2.5699999999999998 111.728 178.278 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . 0.279 0.8 OUTLIER 75.33 22.18 1.73 Allowed 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 127.166 2.187 . . . . 4.7699999999999996 114.698 -179.616 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 99.3 p -50.2 -29.13 8.7 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 120.039 1.291 . . . . 1.74 112.467 173.851 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 107.59 -24.99 22.66 Favored Glycine 0 C--N 1.338 0.681 0 N-CA-C 109.335 -1.506 . . . . 1.47 109.335 -172.595 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 96.8 m-85 -115.35 135.04 54.55 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 124.274 1.03 . . . . 2.5299999999999998 108.813 -179.63 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.445 HD21 HG22 ' A' ' 51' ' ' ILE . 6.6 mt -71.72 75.7 0.84 Allowed 'General case' 0 N--CA 1.448 -0.552 0 N-CA-C 106.896 -1.52 . . . . 2.6899999999999999 106.896 160.318 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -66.02 160.77 23.0 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 108.635 -0.876 . . . . 2.8599999999999999 108.635 172.63 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -52.38 -39.01 60.28 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.91 0.884 . . . . 3.7999999999999998 113.269 -170.199 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -66.2 -49.8 66.06 Favored 'General case' 0 N--CA 1.453 -0.31 0 O-C-N 121.714 -0.616 . . . . 3.4900000000000002 110.293 -175.517 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -61.25 -31.76 71.56 Favored 'General case' 0 C--N 1.329 -0.317 0 O-C-N 121.25 -0.907 . . . . 3.02 110.816 174.08 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -53.78 -36.58 62.57 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 117.867 0.303 . . . . 2.4399999999999999 111.558 168.996 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 33.0 ttpt -61.53 -9.18 5.28 Favored 'General case' 0 CA--C 1.54 0.564 0 O-C-N 121.292 -0.88 . . . . 2.3100000000000001 112.487 173.612 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 76.8 m-85 -128.56 28.63 5.39 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 124.301 1.04 . . . . 4.4299999999999997 111.424 171.43 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -59.08 -62.85 1.58 Allowed 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 118.652 0.66 . . . . 3.46 109.856 -177.031 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 47.1 mt -92.44 -9.42 41.64 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.442 0.697 . . . . 3.0299999999999998 112.14 -178.249 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 43.9 mm-40 -54.19 -33.42 58.12 Favored 'General case' 0 N--CA 1.463 0.193 0 O-C-N 121.514 -0.741 . . . . 1.6399999999999999 110.989 171.423 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.45 -28.69 63.56 Favored 'General case' 0 CA--C 1.533 0.311 0 O-C-N 122.155 -0.341 . . . . 3.2400000000000002 111.294 176.376 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 4.4 m-30 -85.82 -58.59 2.59 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 108.501 -0.925 . . . . 3.1200000000000001 108.501 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -140.73 127.85 20.87 Favored 'General case' 0 C--N 1.34 0.174 0 N-CA-C 109.141 -0.688 . . . . 3.3399999999999999 109.141 -171.302 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 5.9 p -55.33 -27.1 44.84 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 123.973 0.909 . . . . 3.02 112.269 -179.096 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -106.1 22.84 30.47 Favored Glycine 0 CA--C 1.526 0.722 0 CA-C-O 118.54 -1.144 . . . . 1.8400000000000001 112.04 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -54.48 -68.29 0.2 Allowed 'General case' 0 C--N 1.343 0.289 0 CA-C-N 118.805 1.303 . . . . 3.4399999999999999 111.819 -174.12 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . 0.419 ' NH2' ' O ' ' A' ' 21' ' ' ASP . 1.2 tpt180 -173.52 -47.73 0.01 OUTLIER 'General case' 0 C--N 1.339 0.136 0 N-CA-C 112.735 0.643 . . . . 3.2000000000000002 112.735 178.7 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -39.71 -31.31 0.1 Allowed 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 129.191 2.996 . . . . 3.7000000000000002 114.598 -163.135 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.409 HD22 ' H ' ' A' ' 78' ' ' LEU . 0.3 OUTLIER -31.03 -51.95 0.17 Allowed 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 126.353 1.861 . . . . 1.3600000000000001 112.158 165.322 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -82.89 121.78 27.4 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 122.91 0.484 . . . . 2.7000000000000002 110.304 178.576 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -55.62 -31.03 61.93 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 116.215 -0.448 . . . . 3.1699999999999999 111.617 176.414 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 7.9 t -58.58 -60.58 3.59 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 108.711 -0.848 . . . . 1.28 108.711 -176.659 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -65.42 -41.88 93.11 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 122.799 0.44 . . . . 2.9199999999999999 110.216 -174.315 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 1.2 m -49.01 -52.1 27.04 Favored 'General case' 0 C--N 1.344 0.333 0 N-CA-C 109.709 -0.478 . . . . 0.97999999999999998 109.709 169.816 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 51.5 mtmt -70.37 -29.1 65.67 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-O 118.311 -0.852 . . . . 4.6299999999999999 112.729 -178.779 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 10.8 m -57.6 -46.41 84.1 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 120.783 1.628 . . . . 1.98 110.085 168.691 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -60.48 -57.39 12.96 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 109.202 -0.666 . . . . 2.2000000000000002 109.202 175.271 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 17.0 ttp -47.78 -52.51 18.47 Favored 'General case' 0 C--O 1.225 -0.224 0 C-N-CA 124.026 0.93 . . . . 3.0899999999999999 111.477 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -51.89 -44.27 63.67 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 126.407 1.883 . . . . 0.65000000000000002 111.524 -172.01 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -80.58 -52.49 7.54 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-O 119.619 -0.229 . . . . 0.68000000000000005 110.595 175.964 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -48.54 -44.6 36.55 Favored 'General case' 0 C--N 1.339 0.122 0 C-N-CA 123.876 0.87 . . . . 0.46999999999999997 111.858 -175.682 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -72.72 80.39 1.12 Allowed 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 109.286 -0.635 . . . . 0.93000000000000005 109.286 177.624 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 45.3 p-10 -76.97 50.4 0.72 Allowed 'General case' 0 CA--C 1.537 0.457 0 O-C-N 121.399 -0.813 . . . . 2.5800000000000001 110.972 176.095 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 37.5 m-20 -137.01 -61.63 0.66 Allowed 'General case' 0 C--N 1.341 0.214 0 C-N-CA 126.381 1.872 . . . . 1.46 109.412 178.398 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 105.04 45.8 1.33 Allowed Glycine 0 CA--C 1.534 1.247 0 C-N-CA 125.263 1.411 . . . . 1.01 110.339 -161.618 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -127.18 -57.69 1.3 Allowed 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 125.359 1.464 . . . . 2.1600000000000001 110.554 172.696 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 123.5 -25.19 6.32 Favored Glycine 0 CA--C 1.531 1.056 0 C-N-CA 124.83 1.205 . . . . 0.66000000000000003 111.734 176.505 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 19.1 mtpp -78.98 112.83 16.57 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 106.459 -1.682 . . . . 4.0999999999999996 106.459 175.824 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 5.9 mt -100.15 140.76 18.52 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.292 0 N-CA-C 107.95 -1.13 . . . . 0.71999999999999997 107.95 -175.723 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -114.45 177.41 17.56 Favored Glycine 0 C--N 1.334 0.418 0 N-CA-C 110.82 -0.912 . . . . 0.60999999999999999 110.82 176.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -61.17 -39.07 88.76 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 109.511 -0.551 . . . . 0.65000000000000002 109.511 176.564 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -55.91 -63.71 1.09 Allowed 'General case' 0 N--CA 1.449 -0.509 0 O-C-N 123.536 0.523 . . . . 2.2999999999999998 109.987 173.432 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -49.1 -47.77 44.94 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.012 0.925 . . . . 2.2000000000000002 110.837 -179.718 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 58.2 t80 -62.16 -55.86 24.55 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 123.114 0.565 . . . . 4.2800000000000002 111.162 -179.088 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 14.2 tt0 -52.58 -42.42 64.48 Favored 'General case' 0 C--O 1.219 -0.544 0 C-N-CA 123.558 0.743 . . . . 2.5600000000000001 109.379 175.542 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -53.02 -57.32 10.76 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 124.16 0.984 . . . . 3.96 110.093 178.438 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -55.19 -51.59 66.05 Favored 'General case' 0 C--O 1.23 0.071 0 CA-C-O 121.493 0.663 . . . . 3.3599999999999999 109.499 175.564 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' VAL . . . . . 0.548 ' HA ' ' CE1' ' A' ' 31' ' ' PHE . 92.2 t -73.03 -5.97 7.34 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 CA-C-N 115.533 -0.758 . . . . 1.47 112.978 -172.369 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 78.8 t60 -91.41 -8.63 47.35 Favored 'General case' 0 CA--C 1.536 0.436 0 O-C-N 120.721 -1.237 . . . . 3.02 110.421 174.096 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 21.1 t . . . . . 0 C--O 1.252 1.208 0 CA-C-O 114.39 -2.719 . . . . 2.3700000000000001 113.91 -168.89 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.473 HG21 HG12 ' A' ' 47' ' ' VAL . 1.6 pp . . . . . 0 CA--C 1.537 0.459 0 CA-C-O 121.247 0.546 . . . . 1.8200000000000001 110.469 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 1.5 t -86.41 53.43 2.8 Favored 'General case' 0 N--CA 1.44 -0.942 0 C-N-CA 126.202 1.801 . . . . 3.0899999999999999 108.094 -168.77 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -174.65 -56.51 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.144 0 N-CA-C 107.494 -1.298 . . . . 4.5499999999999998 107.494 -170.595 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 13.9 t -46.97 -40.67 5.15 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.236 0 C-N-CA 126.081 1.752 . . . . 1.5900000000000001 110.942 -175.914 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.578 HD23 ' CE ' ' A' ' 39' ' ' MET . 4.5 tp -164.62 -55.1 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 105.823 -1.917 . . . . 1.51 105.823 175.381 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -52.09 -15.96 0.68 Allowed 'General case' 0 N--CA 1.445 -0.69 0 N-CA-C 115.482 1.66 . . . . 0.81000000000000005 115.482 -168.118 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -50.72 -49.39 57.79 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 120.63 1.559 . . . . 0.81000000000000005 111.36 168.179 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -64.55 -40.33 95.39 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-O 122.462 1.125 . . . . 2.2200000000000002 109.753 -178.739 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -67.5 -49.57 62.87 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-N 115.395 -0.82 . . . . 2.6699999999999999 109.247 -175.705 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 19.1 pt -60.1 -40.78 84.33 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.802 0 O-C-N 121.634 -0.666 . . . . 0.76000000000000001 110.764 174.972 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -54.28 -47.8 71.94 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 119.179 0.899 . . . . 0.78000000000000003 111.019 174.302 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.45 -58.49 8.37 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 121.861 -0.524 . . . . 0.73999999999999999 110.739 174.583 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.459 ' HB2' ' CG2' ' A' ' 33' ' ' THR . . . -46.91 -47.06 21.62 Favored 'General case' 0 C--O 1.232 0.165 0 C-N-CA 126.81 2.044 . . . . 0.71999999999999997 111.736 -178.322 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -55.75 -41.7 74.33 Favored 'General case' 0 N--CA 1.445 -0.709 0 C-N-CA 125.751 1.621 . . . . 2.7200000000000002 108.883 -179.121 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 17.1 tt0 -83.06 -50.95 7.98 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 108.991 -0.744 . . . . 2.9100000000000001 108.991 -175.093 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.9 pp20? -61.88 -34.55 76.22 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 115.835 -0.62 . . . . 2.2999999999999998 110.937 -170.849 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 96.6 m -121.39 67.04 0.88 Allowed 'General case' 0 C--O 1.235 0.305 0 C-N-CA 123.802 0.841 . . . . 2.0699999999999998 109.189 168.238 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 16.6 ttp180 -84.23 -3.07 57.95 Favored 'General case' 0 N--CA 1.469 0.491 0 O-C-N 121.102 -0.999 . . . . 4.2800000000000002 112.908 174.809 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -113.28 152.17 44.94 Favored Pre-proline 0 CA--C 1.537 0.464 0 C-N-CA 123.798 0.839 . . . . 2.6899999999999999 112.064 -162.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -63.67 123.83 12.66 Favored 'Trans proline' 0 N--CA 1.453 -0.894 0 C-N-CA 122.891 2.394 . . . . 1.28 111.21 -169.549 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.9 t0 67.78 19.0 9.71 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 125.328 1.451 . . . . 3.2599999999999998 112.336 173.654 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 26.6 m -83.14 -16.62 46.03 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.318 1.047 . . . . 0.93999999999999995 111.784 176.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . 0.416 ' HZ ' ' HB1' ' A' ' 15' ' ' ALA . 0.1 OUTLIER -94.53 98.36 10.78 Favored 'General case' 0 CA--C 1.539 0.538 0 O-C-N 121.922 -0.486 . . . . 4.0599999999999996 111.116 -155.87 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -78.8 155.61 77.94 Favored Pre-proline 0 CA--C 1.535 0.381 0 O-C-N 121.725 -0.61 . . . . 2.8100000000000001 110.667 -179.073 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -71.28 -61.2 0.05 OUTLIER 'Trans proline' 0 N--CA 1.45 -1.072 0 C-N-CA 122.595 2.197 . . . . 0.77000000000000002 111.666 -176.632 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 -59.39 -38.06 79.55 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 118.317 0.508 . . . . 2.46 110.646 -179.212 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 1.1 tptp -55.09 -62.55 1.59 Allowed 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 109.635 -0.506 . . . . 4.1200000000000001 109.635 170.7 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -53.74 -55.25 27.97 Favored 'General case' 0 C--O 1.218 -0.555 0 C-N-CA 124.335 1.054 . . . . 2.4300000000000002 109.947 -174.845 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.466 ' CE1' ' HA ' ' A' ' 107' ' ' VAL . 3.4 t80 -33.03 -66.71 0.13 Allowed 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 128.774 2.83 . . . . 4.7599999999999998 112.4 176.47 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 24.6 mt-30 -61.22 -46.31 90.96 Favored 'General case' 0 C--O 1.226 -0.16 0 N-CA-C 109.574 -0.528 . . . . 3.0600000000000001 109.574 179.668 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.459 ' CG2' ' HB2' ' A' ' 15' ' ' ALA . 0.7 OUTLIER -59.08 -30.5 68.12 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 113.239 0.829 . . . . 0.67000000000000004 113.239 -178.411 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 23.6 t -84.06 -2.67 57.13 Favored 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 125.082 1.353 . . . . 1.46 109.961 179.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 79.68 2.59 88.33 Favored Glycine 0 C--N 1.337 0.633 0 N-CA-C 110.728 -0.949 . . . . 0.68000000000000005 110.728 174.726 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.438 ' HB3' HG13 ' A' ' 107' ' ' VAL . 96.0 mt -68.06 -22.08 64.96 Favored 'General case' 0 N--CA 1.442 -0.833 0 O-C-N 121.507 -0.996 . . . . 1.3899999999999999 110.941 -172.338 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 13.9 t -71.49 -28.03 63.63 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 123.716 0.806 . . . . 2.1499999999999999 109.871 172.697 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 12.9 tttt -84.56 -36.49 22.09 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 124.012 0.925 . . . . 4.3099999999999996 108.899 -179.642 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.578 ' CE ' HD23 ' A' ' 7' ' ' LEU . 0.0 OUTLIER -55.69 128.51 35.13 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 121.228 0.537 . . . . 2.5499999999999998 110.139 176.02 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 28.8 t -64.11 154.69 33.78 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 109.152 -0.684 . . . . 2.3399999999999999 109.152 176.457 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -40.21 -43.45 1.68 Allowed 'General case' 0 C--N 1.34 0.174 0 C-N-CA 124.654 1.182 . . . . 1.0600000000000001 111.368 173.396 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 50.6 m-80 -45.92 -64.11 0.82 Allowed 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.617 1.167 . . . . 2.3500000000000001 110.764 172.874 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.652 ' O ' HG13 ' A' ' 47' ' ' VAL . 46.2 mt-30 -64.71 -39.35 93.5 Favored 'General case' 0 C--O 1.219 -0.504 0 C-N-CA 124.028 0.931 . . . . 3.48 110.555 -176.803 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.434 HG13 HG11 ' A' ' 107' ' ' VAL . 75.6 t -61.73 -46.45 96.5 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 CA-C-N 119.592 1.087 . . . . 0.55000000000000004 110.007 179.613 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 12.3 tttt -63.26 -36.48 83.81 Favored 'General case' 0 CA--C 1.535 0.382 0 O-C-N 121.834 -0.541 . . . . 3.0800000000000001 109.983 177.312 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -62.03 -52.44 63.95 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 122.555 0.342 . . . . 3.1200000000000001 111.081 174.003 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.652 HG13 ' O ' ' A' ' 43' ' ' GLN . 1.5 m -57.41 -47.37 84.91 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.306 0 O-C-N 121.563 -0.711 . . . . 1.3600000000000001 109.275 -179.526 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.541 ' CZ ' ' HB2' ' A' ' 100' ' ' ALA . 40.6 t80 -43.41 -58.86 2.38 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.285 1.034 . . . . 4.54 111.159 171.116 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 67.7 mtp180 -63.99 -36.31 83.57 Favored 'General case' 0 N--CA 1.465 0.312 0 O-C-N 121.558 -0.714 . . . . 3.29 112.867 178.626 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -55.49 -44.8 76.87 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 118.822 0.737 . . . . 3.5899999999999999 109.556 175.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.494 HD11 ' CE1' ' A' ' 71' ' ' PHE . 3.1 mp -70.53 -48.07 61.35 Favored 'Isoleucine or valine' 0 C--O 1.236 0.357 0 CA-C-O 117.914 -1.041 . . . . 1.97 112.01 176.791 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 26.4 t0 -70.29 68.4 0.34 Allowed 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 123.537 0.735 . . . . 1.8999999999999999 110.453 -178.04 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 20.1 t30 -56.53 -41.17 76.33 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 126.794 2.038 . . . . 2.1600000000000001 110.976 -177.341 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -67.61 -14.65 63.13 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.273 1.029 . . . . 2.29 112.116 175.433 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 8.9 mt-30 49.36 57.44 6.48 Favored 'General case' 0 C--N 1.341 0.205 0 C-N-CA 125.223 1.409 . . . . 2.8399999999999999 110.342 -179.195 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 95.9 p -89.86 -18.74 25.62 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 115.434 -0.803 . . . . 1.55 110.314 176.242 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 80.96 19.9 66.46 Favored Glycine 0 CA--C 1.529 0.941 0 N-CA-C 110.652 -0.979 . . . . 1.3500000000000001 110.652 -169.532 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 77.0 m-85 -145.49 131.5 19.26 Favored 'General case' 0 CA--C 1.515 -0.389 0 C-N-CA 123.982 0.913 . . . . 2.1400000000000001 109.336 179.26 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.487 HD23 ' CE1' ' A' ' 48' ' ' PHE . 0.4 OUTLIER -77.89 81.04 4.32 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 104.618 -2.364 . . . . 1.8799999999999999 104.618 160.672 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -67.8 166.86 14.54 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 114.098 -1.41 . . . . 2.6299999999999999 108.176 168.596 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -53.22 -48.1 68.44 Favored 'General case' 0 N--CA 1.452 -0.338 0 O-C-N 121.286 -0.884 . . . . 3.8900000000000001 112.332 -172.394 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.58 -39.34 80.07 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 111.646 0.239 . . . . 4.7699999999999996 111.646 -172.09 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -53.03 -36.96 61.11 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 118.692 0.678 . . . . 2.3799999999999999 112.386 173.333 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 25.4 mt -67.46 -29.23 68.63 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 118.187 0.449 . . . . 2.3399999999999999 110.204 176.816 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 27.5 ttpt -69.31 -2.39 10.63 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 118.515 -0.755 . . . . 2.5 111.306 170.172 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 17.1 p90 -148.26 44.01 1.04 Allowed 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 119.96 1.255 . . . . 5.1500000000000004 113.97 166.59 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 50.8 t80 -71.99 -68.54 0.45 Allowed 'General case' 0 CA--C 1.538 0.499 0 O-C-N 120.894 -1.129 . . . . 2.2799999999999998 110.393 -172.154 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 3.0 mp -73.38 -9.99 59.27 Favored 'General case' 0 C--O 1.234 0.242 0 C-N-CA 124.437 1.095 . . . . 2.0499999999999998 112.33 173.863 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.66 -26.27 61.41 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 119.007 0.821 . . . . 2.6400000000000001 111.326 178.622 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -92.47 -17.03 25.07 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.473 1.109 . . . . 2.6699999999999999 111.061 178.631 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.494 ' CE1' HD11 ' A' ' 51' ' ' ILE . 9.9 m-30 -82.05 -69.43 0.62 Allowed 'General case' 0 C--O 1.224 -0.275 0 N-CA-C 107.496 -1.298 . . . . 3.1299999999999999 107.496 175.256 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 25.9 tp10 -97.79 -49.44 4.82 Favored 'General case' 0 C--O 1.227 -0.094 0 C-N-CA 123.451 0.7 . . . . 3.4199999999999999 109.148 -173.486 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 82.62 109.12 0.06 Allowed 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 124.751 1.22 . . . . 3.1699999999999999 110.161 -172.417 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 93.58 32.53 7.62 Favored Glycine 0 CA--C 1.53 0.984 0 C-N-CA 124.541 1.067 . . . . 1.3 111.123 -174.933 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -85.92 -156.39 0.28 Allowed 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 123.922 0.889 . . . . 1.46 109.34 171.088 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.25 1.07 55.32 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 113.685 0.995 . . . . 3.52 113.685 -164.232 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -42.5 -37.41 1.62 Allowed 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 126.711 2.004 . . . . 2.8599999999999999 113.443 -168.07 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.823 HD22 ' H ' ' A' ' 78' ' ' LEU . 0.2 OUTLIER -57.97 -45.47 86.67 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.24 1.416 . . . . 0.97999999999999998 112.017 177.094 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 88.2 m -64.0 108.32 1.48 Allowed 'General case' 0 C--O 1.235 0.319 0 C-N-CA 124.064 0.946 . . . . 0.81000000000000005 110.679 -179.434 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 8.5 mp0 -69.24 -38.83 78.67 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-N 114.644 -1.162 . . . . 3.4399999999999999 110.572 -173.516 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 16.0 m -51.2 -52.61 42.71 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 119.455 1.025 . . . . 1.3200000000000001 111.172 176.692 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 18.4 tt0 -67.3 -48.81 66.54 Favored 'General case' 0 N--CA 1.446 -0.643 0 C-N-CA 124.084 0.954 . . . . 4.3300000000000001 109.709 -176.064 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -52.87 -46.22 67.78 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 122.164 0.983 . . . . 0.71999999999999997 108.938 178.089 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 17.1 tttt -69.73 -33.6 72.69 Favored 'General case' 0 N--CA 1.444 -0.766 0 C-N-CA 125.55 1.54 . . . . 4.2400000000000002 111.316 -179.545 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.6 t -58.73 -48.11 82.29 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 119.71 1.141 . . . . 1.6399999999999999 109.145 172.464 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -57.16 -55.43 34.9 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 108.905 -0.776 . . . . 2.3799999999999999 108.905 173.984 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 5.9 ttt -47.39 -47.0 26.48 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 112.341 0.497 . . . . 3.8500000000000001 112.341 177.151 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -60.19 -46.12 90.82 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 125.592 1.557 . . . . 0.48999999999999999 111.193 -169.912 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -84.84 -33.56 22.86 Favored 'General case' 0 C--O 1.227 -0.11 0 N-CA-C 111.776 0.287 . . . . 0.70999999999999996 111.776 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -63.63 -39.19 93.72 Favored 'General case' 0 N--CA 1.456 -0.15 0 CA-C-N 117.982 0.356 . . . . 0.38 111.114 176.362 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 24.0 t0 -67.26 117.46 9.29 Favored 'General case' 0 N--CA 1.446 -0.651 0 N-CA-C 108.808 -0.812 . . . . 1.6899999999999999 108.808 176.806 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 9.7 m-20 -100.1 10.76 40.76 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 118.649 -0.691 . . . . 2.7200000000000002 111.369 178.51 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 25.9 m-20 -103.62 -56.25 2.24 Favored 'General case' 0 C--N 1.343 0.301 0 CA-C-N 119.017 0.826 . . . . 1.3799999999999999 111.004 175.089 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 99.57 48.47 1.66 Allowed Glycine 0 CA--C 1.53 1.023 0 N-CA-C 108.751 -1.74 . . . . 0.93999999999999995 108.751 -156.604 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 58.6 p-10 -128.97 -48.65 1.22 Allowed 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 127.119 2.168 . . . . 2.0099999999999998 109.815 177.705 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 127.55 -66.01 0.57 Allowed Glycine 0 CA--C 1.523 0.585 0 C-N-CA 126.862 2.172 . . . . 1.27 108.129 -177.791 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 60.6 pttt -48.35 135.24 14.01 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.368 1.067 . . . . 4.4900000000000002 111.233 -178.863 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 4.1 mt -117.76 108.28 24.19 Favored 'Isoleucine or valine' 0 C--O 1.232 0.176 0 C-N-CA 124.54 1.136 . . . . 0.81999999999999995 109.41 -173.351 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -68.7 168.24 43.68 Favored Glycine 0 CA--C 1.534 1.25 0 N-CA-C 111.572 -0.611 . . . . 0.79000000000000004 111.572 171.025 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . 0.541 ' HB2' ' CZ ' ' A' ' 48' ' ' PHE . . . -62.39 -38.34 89.25 Favored 'General case' 0 C--N 1.34 0.192 0 O-C-N 121.569 -0.959 . . . . 0.88 109.893 175.375 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -53.48 -54.88 30.77 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 123.25 0.62 . . . . 2.4700000000000002 110.208 172.751 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -55.46 -50.92 68.6 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.254 0.621 . . . . 1.3 111.011 178.743 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 77.5 t80 -57.12 -57.13 13.91 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.389 -0.369 . . . . 3.9500000000000002 110.902 -179.704 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -54.78 -44.33 73.62 Favored 'General case' 0 C--O 1.219 -0.504 0 C-N-CA 124.17 0.988 . . . . 2.1899999999999999 110.122 177.765 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -52.44 -59.32 4.58 Favored 'General case' 0 CA--C 1.523 -0.068 0 CA-C-N 119.761 1.164 . . . . 3.1000000000000001 110.464 176.733 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.76 -50.66 69.81 Favored 'General case' 0 CA--C 1.531 0.236 0 N-CA-C 108.39 -0.967 . . . . 2.7799999999999998 108.39 -179.215 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' VAL . . . . . 0.466 ' HA ' ' CE1' ' A' ' 31' ' ' PHE . 85.4 t -69.53 -13.09 16.83 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.794 0 N-CA-C 113.001 0.741 . . . . 1.48 113.001 -175.784 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 41.6 t-80 -88.09 -5.12 58.63 Favored 'General case' 0 CA--C 1.539 0.555 0 O-C-N 120.43 -1.419 . . . . 2.6899999999999999 110.542 175.329 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 23.0 t . . . . . 0 C--O 1.253 1.262 0 CA-C-O 115.307 -2.283 . . . . 2.4500000000000002 113.275 -175.039 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.685 HG22 HG12 ' A' ' 47' ' ' VAL . 1.6 pp . . . . . 0 N--CA 1.453 -0.285 0 CA-C-O 121.649 0.738 . . . . 1.5 111.068 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.476 ' O ' ' HB2' ' A' ' 9' ' ' ALA . 16.6 p -73.67 -2.68 24.14 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 112.53 0.567 . . . . 3.3999999999999999 112.53 -173.51 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -104.23 -35.03 8.15 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 118.668 0.667 . . . . 3.7200000000000002 111.417 177.702 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 17.1 m -71.57 -44.73 70.01 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.246 0 N-CA-C 112.453 0.538 . . . . 2.4399999999999999 112.453 -169.476 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -175.66 -58.14 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.161 0 N-CA-C 106.16 -1.793 . . . . 1.1299999999999999 106.16 -172.94 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 4.9 m -44.63 -22.81 0.09 Allowed 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 127.072 2.149 . . . . 1.0700000000000001 115.84 -168.625 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.476 ' HB2' ' O ' ' A' ' 4' ' ' THR . . . -47.67 -51.15 22.69 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 120.298 1.408 . . . . 0.56999999999999995 112.523 168.047 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -64.6 -39.31 93.49 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-O 122.545 1.164 . . . . 1.95 109.514 -177.961 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -67.97 -45.36 74.4 Favored 'General case' 0 N--CA 1.442 -0.849 0 C-N-CA 124.463 1.105 . . . . 2.2599999999999998 109.196 -174.291 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 37.7 pt -63.37 -38.06 81.17 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.803 0 O-C-N 121.458 -0.776 . . . . 0.73999999999999999 110.591 174.845 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.8 -46.32 81.65 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 118.994 0.816 . . . . 0.68000000000000005 110.487 173.247 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.12 -57.51 12.51 Favored 'General case' 0 CA--C 1.533 0.314 0 O-C-N 122.032 -0.417 . . . . 0.63 110.843 173.785 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -47.48 -49.07 26.53 Favored 'General case' 0 C--O 1.232 0.15 0 C-N-CA 125.577 1.551 . . . . 0.62 110.71 -178.941 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -53.22 -45.09 68.54 Favored 'General case' 0 N--CA 1.444 -0.762 0 C-N-CA 125.185 1.394 . . . . 2.7999999999999998 109.731 179.638 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -79.3 -46.84 16.93 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 109.903 -0.406 . . . . 3.6699999999999999 109.903 -174.187 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -63.56 -38.08 89.76 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 110.435 -0.209 . . . . 3.5600000000000001 110.435 -175.542 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 85.5 m -101.81 46.54 0.93 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.717 0.807 . . . . 1.5 110.331 175.806 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 19.1 mtp85 -69.83 -52.74 22.37 Favored 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 108.499 -0.926 . . . . 4.21 108.499 173.803 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -61.95 138.26 95.62 Favored Pre-proline 0 N--CA 1.441 -0.899 0 CA-C-N 114.174 -1.375 . . . . 2.0800000000000001 110.398 -175.88 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -60.46 150.99 78.14 Favored 'Trans proline' 0 N--CA 1.452 -0.955 0 C-N-CA 122.623 2.215 . . . . 1.25 110.498 -176.672 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 16.9 t70 56.85 15.93 2.5 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.502 1.521 . . . . 3.3700000000000001 114.033 176.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 21.0 m -87.52 -12.52 45.63 Favored 'General case' 0 CA--C 1.534 0.364 0 O-C-N 121.004 -1.06 . . . . 0.98999999999999999 110.789 177.842 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -73.78 117.41 15.53 Favored 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 123.791 0.836 . . . . 2.4500000000000002 110.449 -171.758 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -115.21 147.1 37.77 Favored Pre-proline 0 CA--C 1.538 0.507 0 C-N-CA 125.222 1.409 . . . . 3.3399999999999999 110.943 178.037 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_endo -62.71 -76.97 0.02 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.478 0 C-N-CA 124.669 3.579 . . . . 0.70999999999999996 112.557 -175.645 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.4 tt0 -50.64 -45.2 57.69 Favored 'General case' 0 N--CA 1.445 -0.703 0 C-N-CA 124.886 1.274 . . . . 3.1899999999999999 111.092 -175.505 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 40.4 tptt -47.32 -68.51 0.18 Allowed 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 124.023 0.929 . . . . 2.8500000000000001 108.631 170.381 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -50.41 -41.76 52.78 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.358 1.063 . . . . 2.1899999999999999 112.501 -177.668 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 14.8 m-30 -54.38 -52.29 62.14 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 118.48 0.582 . . . . 4.8700000000000001 110.317 179.718 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -74.27 -37.96 63.56 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 120.338 -0.545 . . . . 3.4300000000000002 110.622 -179.278 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -62.58 -34.63 77.38 Favored 'General case' 0 N--CA 1.442 -0.847 0 C-N-CA 124.052 0.941 . . . . 0.81000000000000005 112.457 -178.686 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 14.9 m -82.65 -0.99 49.8 Favored 'General case' 0 N--CA 1.451 -0.412 0 O-C-N 123.468 0.48 . . . . 1.77 111.382 174.024 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 76.45 -2.5 57.62 Favored Glycine 0 CA--C 1.527 0.831 0 N-CA-C 111.511 -0.636 . . . . 0.72999999999999998 111.511 -177.277 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -65.29 -31.46 72.61 Favored 'General case' 0 N--CA 1.445 -0.68 0 O-C-N 121.306 -1.114 . . . . 2.3100000000000001 111.819 -172.709 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 83.0 p -77.3 -15.19 59.55 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 119.392 0.996 . . . . 1.98 112.368 172.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.93 -35.67 21.94 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 108.804 -0.813 . . . . 5.3200000000000003 108.804 175.194 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 31.8 mmt -55.94 131.51 47.36 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-O 121.834 0.826 . . . . 3.1699999999999999 110.646 171.564 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 2.0 m -70.56 159.84 33.59 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 115.398 -0.819 . . . . 1.8500000000000001 109.676 178.956 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -41.33 -43.82 2.58 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.363 1.065 . . . . 0.57999999999999996 112.138 177.543 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 66.8 m-20 -48.52 -61.57 1.95 Allowed 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 123.959 0.904 . . . . 1.52 110.304 175.906 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 22.5 mm-40 -62.15 -44.52 96.44 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 115.568 -0.742 . . . . 2.6899999999999999 109.382 -179.169 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 57.8 t -59.55 -35.35 58.66 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.63 0 CA-C-N 119.079 0.854 . . . . 0.60999999999999999 110.116 -178.237 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 3.8 tttp -67.42 -44.56 78.46 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.646 0.778 . . . . 2.7599999999999998 111.201 174.196 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 73.5 m-20 -60.61 -54.87 40.17 Favored 'General case' 0 C--O 1.233 0.219 0 O-C-N 121.986 -0.446 . . . . 2.9700000000000002 110.216 177.902 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.685 HG12 HG22 ' A' ' 3' ' ' ILE . 3.9 m -58.15 -46.52 88.39 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.241 0 CA-C-O 118.575 -0.726 . . . . 0.56999999999999995 109.567 179.237 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 4.2 t80 -41.87 -55.15 3.18 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 123.95 0.9 . . . . 4.96 110.99 170.505 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 35.9 mtt85 -59.29 -37.99 79.09 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 118.177 0.444 . . . . 3.77 111.834 177.822 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 14.5 t80 -63.94 -30.2 71.3 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 122.143 -0.348 . . . . 3.77 110.544 177.292 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.3 mm -79.7 -50.01 18.56 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 CA-C-O 118.43 -0.795 . . . . 1.5 111.212 179.519 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -69.26 72.61 0.3 Allowed 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 123.862 0.865 . . . . 2.27 108.853 -176.212 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -61.4 -31.85 71.78 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 125.684 1.594 . . . . 2.0099999999999998 111.407 -168.464 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 13.5 p-10 -69.64 -32.52 71.25 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 125.395 1.478 . . . . 2.4900000000000002 111.815 171.237 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 59.23 80.04 0.21 Allowed 'General case' 0 N--CA 1.445 -0.677 0 CA-C-O 122.228 1.013 . . . . 3.0600000000000001 109.084 -177.577 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 4.9 p -118.08 -70.25 0.8 Allowed 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 107.844 -1.169 . . . . 2.3799999999999999 107.844 175.176 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 147.68 35.04 0.05 OUTLIER Glycine 0 CA--C 1.53 1.004 0 C-N-CA 126.781 2.134 . . . . 1.78 111.589 -179.831 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 33.0 m-85 -159.71 129.38 5.38 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 105.451 -2.055 . . . . 2.1400000000000001 105.451 -178.803 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -86.42 75.58 9.76 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 105.202 -2.148 . . . . 2.0099999999999998 105.202 166.302 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -55.77 133.3 50.91 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 113.874 -1.512 . . . . 1.6200000000000001 107.724 175.797 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -48.51 -46.07 38.0 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 119.073 0.851 . . . . 5.5899999999999999 113.151 -164.411 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -56.12 -31.42 63.3 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 122.705 0.402 . . . . 3.0499999999999998 111.487 -176.923 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 92.4 mt-10 -66.82 -34.34 77.59 Favored 'General case' 0 N--CA 1.453 -0.3 0 O-C-N 120.964 -1.085 . . . . 1.8799999999999999 110.954 176.66 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 86.9 mt -62.78 -29.21 70.53 Favored 'General case' 0 N--CA 1.456 -0.17 0 O-C-N 122.05 -0.406 . . . . 2.7400000000000002 110.459 176.343 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 65.9 tttt -60.9 -7.37 2.35 Favored 'General case' 0 CA--C 1.543 0.675 0 O-C-N 121.75 -0.594 . . . . 4.0999999999999996 112.426 171.438 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 11.8 t80 -137.96 37.42 2.36 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.145 0.978 . . . . 5.7300000000000004 110.596 168.214 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -75.84 -79.12 0.1 Allowed 'General case' 0 N--CA 1.464 0.231 0 O-C-N 121.434 -0.791 . . . . 2.7599999999999998 110.074 178.257 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.448 ' HB3' ' HB1' ' A' ' 75' ' ' ALA . 3.7 tt -62.75 -20.03 64.55 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.258 1.023 . . . . 2.4500000000000002 110.427 -169.349 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 93.7 mm-40 -46.71 -37.62 8.69 Favored 'General case' 0 CA--C 1.541 0.632 0 O-C-N 121.051 -1.03 . . . . 2.1699999999999999 112.013 166.154 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.68 -38.22 69.34 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 118.977 0.808 . . . . 2.7599999999999998 111.204 173.47 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 9.0 m-30 -79.4 -52.25 8.32 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 123.999 0.92 . . . . 3.21 109.698 -177.386 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -150.79 134.79 16.75 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 123.491 0.716 . . . . 3.3300000000000001 109.942 -175.325 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 15.5 t -58.86 -30.33 67.65 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.584 1.154 . . . . 3.6099999999999999 111.607 -179.551 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -87.72 16.29 51.06 Favored Glycine 0 CA--C 1.525 0.678 0 C-N-CA 125.515 1.531 . . . . 2.77 111.446 -174.95 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.448 ' HB1' ' HB3' ' A' ' 68' ' ' LEU . . . -59.17 171.32 0.75 Allowed 'General case' 0 N--CA 1.444 -0.767 0 C-N-CA 123.544 0.738 . . . . 1.5900000000000001 112.178 171.462 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 20.5 mmm180 -89.02 -27.32 20.93 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-O 118.396 -0.811 . . . . 3.8199999999999998 112.795 -176.554 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -28.15 -43.49 0.02 OUTLIER 'General case' 0 N--CA 1.461 0.088 0 C-N-CA 128.694 2.797 . . . . 3.3900000000000001 115.799 -166.822 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.492 HD22 ' H ' ' A' ' 78' ' ' LEU . 0.2 OUTLIER -40.37 -55.75 2.16 Favored 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 126.491 1.916 . . . . 1.2 110.199 174.513 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.68 133.18 42.12 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-O 122.7 1.238 . . . . 1.5600000000000001 109.432 176.058 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 48.5 mp0 -74.14 -32.39 63.12 Favored 'General case' 0 N--CA 1.436 -1.131 0 CA-C-N 113.623 -1.626 . . . . 3.46 110.513 -179.021 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 19.8 m -54.27 -66.12 0.45 Allowed 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 119.751 1.16 . . . . 1.3 111.009 176.36 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -49.53 -53.15 25.09 Favored 'General case' 0 N--CA 1.452 -0.342 0 O-C-N 122.151 -0.343 . . . . 3.4100000000000001 111.375 177.07 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -61.9 -43.5 98.72 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-O 121.813 0.816 . . . . 1.1100000000000001 110.455 -173.743 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 46.9 mmtt -64.59 -28.03 69.35 Favored 'General case' 0 C--O 1.218 -0.599 0 CA-C-O 118.6 -0.714 . . . . 5.1699999999999999 110.076 179.329 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -53.72 -44.86 70.22 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 119.467 1.031 . . . . 1.75 110.151 170.411 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.5 tt -64.29 -60.0 3.71 Favored 'General case' 0 C--N 1.342 0.249 0 O-C-N 121.85 -0.531 . . . . 3.1600000000000001 109.718 172.848 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 8.5 tmm? -48.06 -58.14 4.87 Favored 'General case' 0 CA--C 1.536 0.429 0 O-C-N 123.94 0.775 . . . . 2.7599999999999998 110.734 -173.772 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -38.64 -49.19 1.53 Allowed 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 128.105 2.562 . . . . 0.5 112.45 179.315 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -82.56 -51.79 7.45 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 110.162 -0.31 . . . . 0.53000000000000003 110.162 -178.14 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -48.83 -40.12 28.09 Favored 'General case' 0 CA--C 1.528 0.128 0 C-N-CA 124.267 1.027 . . . . 0.38 112.221 -179.528 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -72.97 83.43 1.24 Allowed 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 109.79 -0.448 . . . . 0.91000000000000003 109.79 179.121 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 46.3 m-80 -74.79 37.39 0.11 Allowed 'General case' 0 CA--C 1.539 0.526 0 O-C-N 121.383 -0.823 . . . . 2.9399999999999999 111.772 177.761 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 20.5 m-20 -121.92 -55.48 1.89 Allowed 'General case' 0 N--CA 1.458 -0.054 0 C-N-CA 124.872 1.269 . . . . 1.24 108.392 174.398 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 93.2 43.53 4.03 Favored Glycine 0 CA--C 1.531 1.071 0 N-CA-C 109.008 -1.637 . . . . 0.76000000000000001 109.008 -159.28 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -122.05 -55.73 1.87 Allowed 'General case' 0 C--N 1.34 0.182 0 C-N-CA 125.069 1.347 . . . . 2.4399999999999999 109.655 174.701 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 135.51 -58.49 0.67 Allowed Glycine 0 CA--C 1.528 0.875 0 N-CA-C 110.901 -0.879 . . . . 0.69999999999999996 110.901 -174.136 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 18.8 mttt -63.78 113.59 3.49 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 109.089 -0.708 . . . . 4.0700000000000003 109.089 -176.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 6.7 mt -90.8 150.78 3.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 N-CA-C 107.427 -1.323 . . . . 1.0 107.427 174.959 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -126.94 -178.35 15.27 Favored Glycine 0 CA--C 1.522 0.495 0 N-CA-C 109.711 -1.355 . . . . 0.54000000000000004 109.711 171.734 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -62.95 -42.67 99.89 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-N 117.288 0.544 . . . . 0.83999999999999997 109.976 -174.146 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -58.39 -63.51 1.25 Allowed 'General case' 0 N--CA 1.449 -0.515 0 CA-C-O 118.237 -0.887 . . . . 2.6200000000000001 110.282 177.37 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -45.48 -50.79 12.43 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 119.126 0.876 . . . . 1.24 111.949 175.399 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 57.6 t80 -60.98 -54.07 49.49 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 109.628 -0.508 . . . . 3.27 109.628 -175.407 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 24.9 tt0 -59.34 -46.13 89.46 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 123.769 0.828 . . . . 2.48 110.68 -179.259 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -49.58 -58.84 4.48 Favored 'General case' 0 C--O 1.23 0.038 0 CA-C-N 119.214 0.916 . . . . 3.7400000000000002 110.416 175.298 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.61 -50.2 68.09 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 120.669 -0.412 . . . . 2.71 110.589 -176.318 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 55.3 t -54.43 -39.29 44.12 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.304 0 C-N-CA 123.02 0.528 . . . . 1.28 111.227 177.912 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 13.1 t60 -66.31 -19.93 65.95 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 124.247 1.019 . . . . 2.1299999999999999 110.536 -178.161 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 4.3 t . . . . . 0 C--O 1.253 1.261 0 CA-C-O 117.506 -1.235 . . . . 3.5800000000000001 110.406 -179.989 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.451 ' CG2' HG12 ' A' ' 47' ' ' VAL . 5.3 pt . . . . . 0 CA--C 1.531 0.223 0 N-CA-C 112.877 0.695 . . . . 2.73 112.877 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 8.2 t -51.02 -27.9 8.89 Favored 'General case' 0 N--CA 1.425 -1.687 0 C-N-CA 129.326 3.05 . . . . 2.48 113.734 178.136 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 24.8 t0 -152.72 52.1 0.76 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.662 0.785 . . . . 3.5600000000000001 110.547 -178.762 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 4.5 t -118.98 -56.46 3.61 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.194 0 C-N-CA 125.139 1.376 . . . . 1.6000000000000001 109.612 175.856 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 2.4 tp -167.67 -55.92 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 105.703 -1.962 . . . . 1.0900000000000001 105.703 -177.004 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 70.1 m -51.53 -29.0 15.27 Favored 'General case' 0 N--CA 1.442 -0.871 0 N-CA-C 114.894 1.442 . . . . 1.03 114.894 -167.148 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -50.29 -42.86 53.14 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 121.151 -0.968 . . . . 0.89000000000000001 112.171 173.132 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -69.09 -38.03 78.75 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-O 121.48 0.657 . . . . 2.0699999999999998 110.462 176.293 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -58.96 -49.35 78.19 Favored 'General case' 0 C--O 1.234 0.257 0 C-N-CA 122.941 0.497 . . . . 4.9400000000000004 109.716 -179.914 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 11.5 pt -65.35 -38.88 83.62 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.41 0 N-CA-C 109.277 -0.638 . . . . 1.1100000000000001 109.277 -176.703 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -53.86 -47.7 70.77 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 118.321 0.509 . . . . 0.63 110.595 175.56 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.66 -59.22 5.73 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-O 120.512 0.196 . . . . 0.63 111.088 175.606 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -50.65 -46.83 58.61 Favored 'General case' 0 CA--C 1.528 0.117 0 C-N-CA 124.111 0.964 . . . . 0.57999999999999996 111.637 -176.827 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 5.1 mp -51.34 -37.6 48.7 Favored 'General case' 0 C--N 1.333 -0.146 0 C-N-CA 124.417 1.087 . . . . 4.0099999999999998 111.477 178.722 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -82.39 -46.62 13.31 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 109.519 -0.549 . . . . 5.2800000000000002 109.519 178.306 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -70.56 -31.16 68.09 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 112.112 0.412 . . . . 2.4199999999999999 112.112 -167.681 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 65.9 m -118.05 47.97 1.48 Allowed 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 125.572 1.549 . . . . 1.6200000000000001 108.571 171.345 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 37.9 ttt85 -68.88 -32.22 71.72 Favored 'General case' 0 CA--C 1.534 0.339 0 O-C-N 121.673 -0.642 . . . . 5.1699999999999999 109.983 173.586 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 91.8 m-20 -80.79 150.12 68.76 Favored Pre-proline 0 CA--C 1.539 0.522 0 C-N-CA 125.591 1.556 . . . . 2.25 110.924 -166.542 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -66.05 141.06 62.38 Favored 'Trans proline' 0 N--CA 1.455 -0.747 0 C-N-CA 123.105 2.537 . . . . 1.3500000000000001 110.21 -174.89 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 63.97 9.18 4.4 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.583 1.553 . . . . 2.3100000000000001 113.417 177.034 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 24.2 m -92.6 -9.52 40.74 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 119.568 1.077 . . . . 0.89000000000000001 113.221 -171.666 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -58.43 115.21 2.84 Favored 'General case' 0 N--CA 1.448 -0.569 0 O-C-N 121.764 -0.585 . . . . 2.8900000000000001 109.672 176.436 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -102.98 148.19 35.23 Favored Pre-proline 0 CA--C 1.532 0.288 0 N-CA-C 108.859 -0.793 . . . . 3.7000000000000002 108.859 164.07 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -67.23 -65.94 0.04 OUTLIER 'Trans proline' 0 N--CA 1.451 -0.998 0 C-N-CA 123.254 2.636 . . . . 1.01 111.02 -177.062 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 35.4 mt-30 -58.8 -32.33 69.24 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 124.15 0.98 . . . . 2.3300000000000001 110.841 -178.478 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 18.6 tptm -61.37 -66.56 0.52 Allowed 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 123.5 0.72 . . . . 2.8399999999999999 109.943 173.093 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 51.3 t80 -54.38 -47.69 72.38 Favored 'General case' 0 C--O 1.221 -0.402 0 C-N-CA 122.975 0.51 . . . . 2.3599999999999999 109.896 -176.93 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 3.8 t80 -39.01 -58.47 1.11 Allowed 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 126.514 1.926 . . . . 5.1900000000000004 112.078 172.566 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 30.8 tt0 -72.09 -47.02 54.44 Favored 'General case' 0 N--CA 1.45 -0.458 0 N-CA-C 109.291 -0.633 . . . . 3.0899999999999999 109.291 -176.803 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -57.63 -34.42 69.29 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 123.197 0.599 . . . . 0.82999999999999996 110.977 -177.043 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 26.1 t -81.4 -5.03 57.46 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 125.942 1.697 . . . . 1.45 109.876 -177.862 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 74.69 4.13 69.65 Favored Glycine 0 CA--C 1.527 0.841 0 O-C-N 119.11 -2.244 . . . . 0.91000000000000003 111.608 171.912 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.419 ' HB3' HG13 ' A' ' 107' ' ' VAL . 89.8 mt -60.78 -33.98 73.8 Favored 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 124.814 1.246 . . . . 1.75 109.16 178.147 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 21.1 t -61.64 -33.97 74.86 Favored 'General case' 0 N--CA 1.462 0.156 0 C-N-CA 123.952 0.901 . . . . 2.3399999999999999 111.229 172.72 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 25.9 tttt -80.6 -36.86 32.18 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 108.403 -0.962 . . . . 4.5800000000000001 108.403 -176.747 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 25.8 mmt -69.36 135.45 50.37 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-O 121.689 0.757 . . . . 3.8999999999999999 111.832 -179.573 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 2.6 m -69.89 154.19 42.29 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 123.356 0.662 . . . . 1.8200000000000001 110.671 179.593 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -42.27 -40.02 2.29 Favored 'General case' 0 C--O 1.222 -0.359 0 C-N-CA 123.853 0.861 . . . . 0.47999999999999998 112.099 175.301 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 62.8 m-20 -47.52 -59.46 3.23 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.232 1.013 . . . . 1.5600000000000001 110.94 175.259 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 2.6 mm100 -69.19 -40.17 78.24 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 109.441 -0.577 . . . . 2.6099999999999999 109.441 -176.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 89.6 t -62.58 -36.6 75.85 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.525 0 CA-C-N 118.748 0.704 . . . . 0.48999999999999999 109.53 -178.386 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 48.2 tttm -66.26 -46.09 78.3 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 123.213 0.605 . . . . 3.0600000000000001 109.824 174.372 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -55.31 -57.83 10.19 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 117.93 0.332 . . . . 3.1000000000000001 110.935 176.141 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.451 HG12 ' CG2' ' A' ' 3' ' ' ILE . 4.7 m -55.77 -46.08 79.67 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.239 0 CA-C-O 118.858 -0.592 . . . . 0.48999999999999999 109.929 179.218 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -45.24 -53.69 7.97 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 118.603 0.638 . . . . 4.8399999999999999 110.677 172.017 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 68.3 mtp180 -61.39 -43.42 98.89 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 119.057 0.844 . . . . 3.2200000000000002 111.721 -179.868 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 13.6 m-85 -62.52 -38.63 90.69 Favored 'General case' 0 C--O 1.235 0.313 0 O-C-N 121.835 -0.541 . . . . 4.7599999999999998 110.751 179.678 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.405 HG21 ' CD1' ' A' ' 67' ' ' PHE . 38.6 mm -82.65 -39.93 16.3 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 CA-C-O 118.053 -0.975 . . . . 2.1400000000000001 112.005 -174.988 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 60.8 t0 -64.12 74.62 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 125.313 1.445 . . . . 1.98 108.141 169.097 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -54.49 155.38 4.02 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 106.612 -1.625 . . . . 3.21 106.612 164.647 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 76.22 -47.15 0.55 Allowed 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 118.757 0.708 . . . . 3.1099999999999999 111.97 -173.686 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 8.3 mt-30 61.12 45.83 8.73 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.578 0.751 . . . . 3.6299999999999999 110.351 -174.087 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 34.3 p -53.6 -33.02 53.51 Favored 'General case' 0 C--N 1.34 0.156 0 C-N-CA 124.703 1.201 . . . . 1.6499999999999999 111.24 173.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 121.34 -23.78 7.5 Favored Glycine 0 CA--C 1.528 0.872 0 N-CA-C 109.633 -1.387 . . . . 1.4299999999999999 109.633 -167.152 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 65.9 m-85 -126.38 151.89 47.03 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 123.785 0.834 . . . . 2.3700000000000001 110.107 -176.165 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 18.6 mt -80.56 82.33 6.6 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 105.316 -2.105 . . . . 2.6099999999999999 105.316 152.516 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -65.17 146.89 54.39 Favored 'General case' 0 CA--C 1.549 0.909 0 CA-C-N 113.268 -1.787 . . . . 2.3799999999999999 108.416 173.122 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -45.22 -55.87 5.39 Favored 'General case' 0 C--O 1.234 0.287 0 O-C-N 120.668 -1.27 . . . . 3.8900000000000001 114.324 -171.34 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -51.35 -30.69 19.52 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.781 0.832 . . . . 3.6200000000000001 111.547 179.041 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -68.34 -45.82 71.85 Favored 'General case' 0 N--CA 1.444 -0.754 0 O-C-N 121.749 -0.595 . . . . 2.8999999999999999 110.465 178.532 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.74 -30.21 71.34 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 119.556 -0.858 . . . . 2.8999999999999999 110.156 178.236 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 12.1 ttpp -57.5 -5.96 0.41 Allowed 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.772 1.229 . . . . 2.0499999999999998 113.465 171.111 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 36.7 p90 -137.67 27.72 2.73 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 119.864 1.211 . . . . 5.0199999999999996 112.395 165.476 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.405 ' CD1' HG21 ' A' ' 51' ' ' ILE . 63.8 t80 -53.99 -73.38 0.05 OUTLIER 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 124.543 1.137 . . . . 2.8100000000000001 112.263 -176.136 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.81 -26.0 65.86 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 108.909 -0.774 . . . . 3.8700000000000001 108.909 -171.636 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -52.22 -38.43 57.98 Favored 'General case' 0 C--O 1.226 -0.151 0 C-N-CA 126.861 2.065 . . . . 2.8199999999999998 111.231 174.313 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 20.8 mtpt -63.34 -29.29 70.62 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 117.997 0.362 . . . . 3.1800000000000002 111.744 176.383 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -79.59 -56.18 4.49 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 124.126 0.97 . . . . 5.3700000000000001 108.875 -178.5 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -104.24 -123.52 0.21 Allowed 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 108.023 -1.102 . . . . 4.1600000000000001 108.023 -173.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 21.8 p -157.29 -5.64 0.1 Allowed 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 116.577 2.066 . . . . 2.73 116.577 175.608 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -169.33 66.25 0.17 Allowed Glycine 0 C--N 1.334 0.465 0 N-CA-C 108.222 -1.951 . . . . 1.8700000000000001 108.222 175.528 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -89.02 -106.46 0.08 Allowed 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 117.385 0.593 . . . . 1.74 109.557 -171.16 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 9.4 tpt180 -151.11 50.49 0.84 Allowed 'General case' 0 N--CA 1.457 -0.109 0 CA-C-O 122.194 0.997 . . . . 4.6799999999999997 110.474 -174.421 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -95.85 -18.05 20.66 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 126.008 1.723 . . . . 4.7699999999999996 108.946 178.636 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -71.54 -42.86 67.37 Favored 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 124.375 1.07 . . . . 1.1499999999999999 110.632 -179.204 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.91 126.5 28.73 Favored 'General case' 0 C--N 1.343 0.308 0 C-N-CA 118.401 -1.32 . . . . 1.1100000000000001 109.47 179.485 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -61.91 -37.41 84.56 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 114.098 -1.41 . . . . 3.6200000000000001 109.412 174.514 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -66.75 -60.16 2.93 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 117.994 0.361 . . . . 1.98 111.09 -179.083 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -52.94 -41.57 64.62 Favored 'General case' 0 N--CA 1.454 -0.246 0 O-C-N 121.135 -0.978 . . . . 3.1099999999999999 110.797 177.071 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 4.4 m -59.44 -60.32 4.03 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 119.355 -0.938 . . . . 0.81999999999999995 110.911 173.144 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 35.4 pttt -61.37 -27.52 68.58 Favored 'General case' 0 C--O 1.213 -0.848 0 C-N-CA 123.511 0.724 . . . . 6.2699999999999996 110.603 -168.732 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 34.8 m -48.26 -47.3 36.2 Favored 'General case' 0 C--N 1.326 -0.426 0 O-C-N 121.251 -0.906 . . . . 1.48 110.832 170.822 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 11.6 mt -75.09 -54.42 7.18 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 109.183 -0.673 . . . . 2.3100000000000001 109.183 171.349 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 1.6 tpt -54.67 -20.09 7.49 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 115.178 1.547 . . . . 5.6200000000000001 115.178 -175.808 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -83.12 -61.17 1.93 Allowed 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 127.057 2.143 . . . . 0.83999999999999997 109.457 -179.128 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -80.89 -34.14 33.76 Favored 'General case' 0 N--CA 1.455 -0.213 0 O-C-N 121.903 -0.498 . . . . 0.90000000000000002 111.917 -171.654 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -60.2 -38.94 84.82 Favored 'General case' 0 C--O 1.227 -0.086 0 CA-C-N 118.418 0.554 . . . . 0.51000000000000001 109.69 172.256 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -66.18 -62.67 1.36 Allowed 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 109.549 -0.538 . . . . 1.8999999999999999 109.549 176.842 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 10.1 p30 43.59 23.13 0.04 OUTLIER 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 126.553 1.941 . . . . 3.5499999999999998 115.038 -173.668 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 52.4 m-20 -95.78 -45.44 6.99 Favored 'General case' 0 C--N 1.338 0.091 0 C-N-CA 124.373 1.069 . . . . 1.9299999999999999 108.339 171.947 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 97.75 41.49 3.34 Favored Glycine 0 CA--C 1.53 0.97 0 N-CA-C 109.463 -1.455 . . . . 1.26 109.463 -158.604 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . 0.252 1.7 p30 -127.74 -54.81 1.32 Allowed 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 118.416 1.108 . . . . 2.0800000000000001 111.917 171.604 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 114.49 -34.37 4.94 Favored Glycine 0 CA--C 1.53 1.009 0 C-N-CA 124.611 1.101 . . . . 0.87 112.46 176.868 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 52.8 pttt -70.1 127.85 34.26 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-N 118.858 1.329 . . . . 3.98 108.058 173.105 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 8.7 mt -117.46 107.45 22.24 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.156 0 N-CA-C 108.307 -0.998 . . . . 1.0800000000000001 108.307 -173.185 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -61.88 163.59 24.22 Favored Glycine 0 CA--C 1.526 0.752 0 N-CA-C 111.04 -0.824 . . . . 0.47999999999999998 111.04 172.967 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -51.01 -42.86 60.68 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 109.039 -0.726 . . . . 0.62 109.039 168.359 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 8.8 tt0 -57.64 -56.74 18.01 Favored 'General case' 0 N--CA 1.445 -0.68 0 C-N-CA 124.121 0.968 . . . . 2.73 110.044 179.003 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -50.87 -48.07 60.29 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.68 0.792 . . . . 1.5 110.98 176.22 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 79.5 t80 -58.31 -54.56 45.67 Favored 'General case' 0 CA--C 1.538 0.492 0 O-C-N 121.745 -0.597 . . . . 4.04 110.896 179.052 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 13.0 mt-30 -61.96 -29.0 69.94 Favored 'General case' 0 C--O 1.221 -0.422 0 CA-C-O 118.001 -0.999 . . . . 4.0499999999999998 112.534 177.519 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 23.5 mm-40 -63.01 -59.37 4.91 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 120.288 1.404 . . . . 3.29 107.778 172.374 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 5.6 tpt -54.99 -41.6 71.42 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 110.231 -0.285 . . . . 3.21 110.231 -176.378 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' VAL . . . . . 0.419 HG13 ' HB3' ' A' ' 36' ' ' LEU . 52.8 t -78.4 -54.86 11.35 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.51 0 N-CA-C 113.153 0.797 . . . . 1.3 113.153 -177.142 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 4.5 t-80 -72.05 -8.77 56.47 Favored 'General case' 0 C--N 1.326 -0.425 0 O-C-N 119.508 -1.995 . . . . 3.6499999999999999 111.057 -175.702 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 33.2 t . . . . . 0 C--O 1.254 1.319 0 CA-C-O 115.084 -2.389 . . . . 2.79 113.643 167.14 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.521 HG22 HG12 ' A' ' 47' ' ' VAL . 1.3 pp . . . . . 0 CA--C 1.536 0.413 0 N-CA-C 112.393 0.516 . . . . 1.24 112.393 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 9.1 t -64.87 -8.96 17.49 Favored 'General case' 0 N--CA 1.432 -1.361 0 C-N-CA 127.542 2.337 . . . . 1.6399999999999999 111.541 -176.087 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 29.8 t0 -132.83 7.35 4.05 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 126.681 1.992 . . . . 2.3999999999999999 109.477 -175.838 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 77.7 t -90.6 -61.31 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.344 0.347 0 O-C-N 121.574 -0.704 . . . . 1.51 109.827 174.361 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -166.26 -60.32 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.196 0 N-CA-C 107.517 -1.29 . . . . 1.1000000000000001 107.517 -174.116 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 27.5 m -41.45 -25.89 0.05 Allowed 'General case' 0 C--O 1.221 -0.437 0 C-N-CA 126.959 2.103 . . . . 1.1799999999999999 115.969 -169.846 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -48.09 -47.33 34.26 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 119.81 1.186 . . . . 0.88 112.387 171.416 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -64.71 -41.32 96.08 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-O 122.477 1.132 . . . . 1.75 109.716 179.838 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -68.88 -45.49 70.82 Favored 'General case' 0 N--CA 1.445 -0.683 0 C-N-CA 124.285 1.034 . . . . 2.3900000000000001 109.384 -172.674 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 32.4 pt -60.93 -37.46 77.02 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.807 0 O-C-N 121.256 -0.902 . . . . 1.0 111.076 175.564 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.85 -43.95 77.58 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 118.68 0.673 . . . . 0.88 110.626 173.52 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.02 -57.12 14.22 Favored 'General case' 0 CA--C 1.534 0.363 0 O-C-N 121.946 -0.471 . . . . 0.78000000000000003 110.524 172.803 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -47.31 -43.57 22.75 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.845 1.258 . . . . 0.77000000000000002 111.222 -179.596 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.62 -36.99 77.43 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 126.16 1.784 . . . . 3.2999999999999998 110.9 -177.614 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -91.38 -42.98 10.02 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 122.818 0.447 . . . . 2.79 110.005 -175.047 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -69.58 -32.9 71.94 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-O 119.792 -0.146 . . . . 3.54 110.973 -176.531 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 62.1 m -109.15 55.83 0.63 Allowed 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.927 0.891 . . . . 1.6000000000000001 108.615 175.312 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.88 -53.67 12.48 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 121.608 0.718 . . . . 5.2300000000000004 109.977 -168.156 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -69.66 140.28 89.32 Favored Pre-proline 0 N--CA 1.445 -0.709 0 CA-C-N 114.266 -1.334 . . . . 3.1800000000000002 107.592 176.934 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -51.16 -70.92 0.05 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.659 0 C-N-CA 124.386 3.391 . . . . 4.1200000000000001 112.089 -164.225 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 12.3 p-10 -77.08 49.35 0.66 Allowed 'General case' 0 CA--C 1.543 0.675 0 O-C-N 121.493 -0.754 . . . . 3.3199999999999998 112.582 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 2.8 m -122.13 27.76 7.85 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 124.367 1.067 . . . . 1.4199999999999999 110.151 174.851 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 12.0 t80 -109.1 135.91 49.46 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 124.695 1.198 . . . . 4.2999999999999998 108.704 -179.869 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 -122.13 142.86 37.61 Favored Pre-proline 0 N--CA 1.451 -0.422 0 N-CA-C 107.696 -1.224 . . . . 3.8199999999999998 107.696 169.639 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -64.86 -59.03 0.18 Allowed 'Trans proline' 0 N--CA 1.452 -0.963 0 C-N-CA 123.601 2.868 . . . . 0.77000000000000002 111.296 -177.054 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -52.44 -50.66 62.18 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.307 0.643 . . . . 2.54 110.818 -179.179 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 12.6 tptp -45.53 -65.14 0.58 Allowed 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.433 1.093 . . . . 2.8599999999999999 108.852 170.105 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -50.49 -44.36 55.86 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 124.879 1.272 . . . . 2.9100000000000001 112.873 -176.957 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 13.5 m-85 -56.35 -46.54 79.92 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-N 120.036 1.289 . . . . 4.6100000000000003 111.006 -178.189 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 -70.32 -46.53 64.03 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 109.454 -0.573 . . . . 2.8900000000000001 109.454 178.019 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -63.8 -33.39 75.56 Favored 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 124.764 1.226 . . . . 0.89000000000000001 113.137 -174.073 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.4 t -85.67 -1.32 57.04 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 125.319 1.448 . . . . 1.4399999999999999 109.669 178.843 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 76.95 -11.83 13.61 Favored Glycine 0 CA--C 1.531 1.054 0 O-C-N 121.396 -0.815 . . . . 0.71999999999999997 112.238 179.309 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 32.6 mt -55.93 -33.84 65.07 Favored 'General case' 0 N--CA 1.444 -0.728 0 C-N-CA 126.518 1.927 . . . . 1.3799999999999999 112.525 -177.654 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 46.9 t -69.23 -32.95 72.52 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 118.803 0.729 . . . . 2.0299999999999998 111.301 173.292 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 10.6 tttt -75.43 -34.79 61.02 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 108.563 -0.903 . . . . 4.2400000000000002 108.563 -179.078 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 36.3 mtt -57.34 124.69 19.75 Favored 'General case' 0 N--CA 1.442 -0.848 0 N-CA-C 109.601 -0.518 . . . . 2.7799999999999998 109.601 171.946 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 6.0 m -63.34 160.48 15.89 Favored 'General case' 0 N--CA 1.452 -0.337 0 O-C-N 121.537 -0.727 . . . . 1.8600000000000001 110.73 176.46 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -41.6 -41.99 2.34 Favored 'General case' 0 C--O 1.224 -0.253 0 C-N-CA 125.005 1.322 . . . . 0.48999999999999999 112.332 176.22 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 75.8 m-20 -48.69 -61.13 2.19 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.223 0.609 . . . . 1.54 109.886 175.514 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 9.0 mm-40 -62.84 -46.43 87.95 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 115.83 -0.623 . . . . 2.6600000000000001 109.682 -178.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 62.6 t -58.82 -39.07 76.19 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 CA-C-N 119.789 1.177 . . . . 0.45000000000000001 110.77 -176.836 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 6.7 ttmt -64.27 -48.43 75.77 Favored 'General case' 0 CA--C 1.536 0.432 0 O-C-N 121.366 -0.834 . . . . 4.5499999999999998 110.707 172.861 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 78.1 m-20 -61.19 -51.1 70.45 Favored 'General case' 0 CA--C 1.535 0.387 0 O-C-N 121.807 -0.558 . . . . 3.4100000000000001 110.06 -176.178 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.521 HG12 HG22 ' A' ' 3' ' ' ILE . 9.0 m -58.8 -46.65 90.8 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.27 0 CA-C-O 118.412 -0.804 . . . . 0.58999999999999997 110.105 174.485 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 11.8 t80 -45.65 -48.71 14.82 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 119.291 0.951 . . . . 4.3600000000000003 111.233 173.257 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 86.3 mtt-85 -61.19 -36.28 79.44 Favored 'General case' 0 CA--C 1.532 0.277 0 O-C-N 121.608 -0.682 . . . . 4.2599999999999998 112.169 176.377 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 25.1 t80 -64.89 -33.76 76.78 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 118.805 0.729 . . . . 3.71 110.071 173.158 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 14.1 mm -67.25 -58.0 7.83 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.284 0 CA-C-O 117.895 -1.05 . . . . 1.55 111.721 176.583 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -73.18 70.97 1.15 Allowed 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 119.21 0.914 . . . . 2.3700000000000001 109.457 -173.663 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 15.5 t30 -59.9 -32.63 70.93 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 125.967 1.707 . . . . 2.0099999999999998 111.887 -170.791 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 17.2 p-10 -74.3 -21.05 59.91 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.473 1.109 . . . . 2.3399999999999999 111.607 174.494 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 8.1 mt-30 49.92 63.07 2.33 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 126.496 1.919 . . . . 3.1499999999999999 111.389 -178.103 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.2 p -93.71 -38.82 11.11 Favored 'General case' 0 CA--C 1.521 -0.149 0 CA-C-N 115.698 -0.683 . . . . 1.3799999999999999 109.978 167.572 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 99.72 18.49 22.82 Favored Glycine 0 CA--C 1.53 0.971 0 CA-C-O 119.71 -0.494 . . . . 1.6000000000000001 111.925 -169.329 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 36.7 m-85 -135.14 137.64 42.96 Favored 'General case' 0 C--O 1.238 0.454 0 N-CA-C 108.717 -0.846 . . . . 2.6099999999999999 108.717 163.991 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -90.91 70.79 6.48 Favored 'General case' 0 C--O 1.231 0.099 0 C-N-CA 126.067 1.747 . . . . 1.73 107.87 168.89 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -63.56 165.64 7.78 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 123.314 0.646 . . . . 1.77 110.59 177.411 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -48.93 -47.38 43.64 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.147 0.979 . . . . 4.3200000000000003 111.601 -176.837 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -73.74 -18.8 60.94 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 115.679 -0.691 . . . . 3.0899999999999999 112.56 -177.03 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -70.51 -48.79 53.88 Favored 'General case' 0 CA--C 1.522 -0.105 0 N-CA-C 108.58 -0.896 . . . . 2.6699999999999999 108.58 165.445 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.622 HD11 HD23 ' A' ' 86' ' ' LEU . 0.2 OUTLIER -49.37 -41.96 40.65 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 115.642 -0.708 . . . . 2.6000000000000001 110.208 176.861 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 30.3 ttpt -55.02 -8.15 0.25 Allowed 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 114.5 1.296 . . . . 2.1600000000000001 114.5 176.636 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 32.2 p90 -136.46 18.94 3.12 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 120.584 1.538 . . . . 5.5999999999999996 113.564 168.37 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 2.7 t80 -42.48 -75.92 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.042 1.337 . . . . 2.52 114.107 -172.562 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.504 HD23 ' CD2' ' A' ' 71' ' ' PHE . 1.5 mt -73.89 -0.2 15.3 Favored 'General case' 0 CA--C 1.532 0.267 0 O-C-N 121.251 -0.905 . . . . 2.23 111.529 178.223 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -72.34 -19.17 61.69 Favored 'General case' 0 CA--C 1.532 0.257 0 O-C-N 120.599 -1.313 . . . . 2.7000000000000002 110.714 -176.552 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.0 -29.6 68.58 Favored 'General case' 0 CA--C 1.534 0.332 0 O-C-N 122.006 -0.434 . . . . 2.8900000000000001 111.321 163.654 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.504 ' CD2' HD23 ' A' ' 68' ' ' LEU . 2.5 m-30 -90.56 -65.02 1.05 Allowed 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 108.576 -0.898 . . . . 3.25 108.576 -176.479 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -117.33 119.47 35.25 Favored 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 107.922 -1.14 . . . . 3.0800000000000001 107.922 -172.79 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 4.2 p -49.22 -34.45 14.91 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 123.73 0.812 . . . . 2.2799999999999998 112.324 179.536 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -111.81 36.69 4.04 Favored Glycine 0 CA--C 1.524 0.643 0 C-N-CA 124.903 1.239 . . . . 1.1000000000000001 110.925 -178.92 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.77 175.68 1.08 Allowed 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 117.617 0.708 . . . . 1.6899999999999999 110.602 169.397 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.63 3.63 28.1 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 114.523 1.305 . . . . 5.1900000000000004 114.523 -164.989 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -55.26 -26.51 40.42 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.092 0.957 . . . . 3.0499999999999998 112.639 -162.702 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.44 HD22 ' H ' ' A' ' 78' ' ' LEU . 0.2 OUTLIER -62.73 -41.81 99.36 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.324 1.45 . . . . 0.88 112.155 173.86 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 53.9 m -64.06 106.29 1.03 Allowed 'General case' 0 C--O 1.236 0.36 0 N-CA-C 108.862 -0.792 . . . . 1.5 108.862 175.059 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -56.54 -37.33 70.35 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-N 115.611 -0.722 . . . . 3.0600000000000001 110.478 174.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -49.85 -69.72 0.11 Allowed 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 119.394 0.997 . . . . 2.1600000000000001 112.153 176.129 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 21.6 mt-10 -53.95 -48.18 70.56 Favored 'General case' 0 C--N 1.343 0.285 0 CA-C-N 119.357 0.981 . . . . 4.6600000000000001 110.611 178.557 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -54.76 -51.82 64.49 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-O 121.658 0.742 . . . . 0.66000000000000003 109.392 -175.036 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.93 -34.64 73.72 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 124.624 1.17 . . . . 5.0199999999999996 110.29 -176.268 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 73.4 m -61.07 -48.73 80.34 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 120.14 1.336 . . . . 1.23 110.82 174.039 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.622 HD23 HD11 ' A' ' 64' ' ' LEU . 6.3 tp -54.02 -59.26 4.88 Favored 'General case' 0 C--N 1.342 0.271 0 N-CA-C 108.254 -1.017 . . . . 3.27 108.254 172.981 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 1.7 ttt -47.99 -50.47 27.39 Favored 'General case' 0 CA--C 1.538 0.501 0 O-C-N 123.771 0.669 . . . . 3.6099999999999999 111.818 -179.014 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -54.92 -51.79 64.98 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 126.141 1.777 . . . . 0.68000000000000005 111.275 -173.031 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -73.58 -49.08 28.1 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 120.112 -0.635 . . . . 0.51000000000000001 110.29 177.43 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -48.99 -33.97 12.11 Favored 'General case' 0 C--N 1.339 0.14 0 C-N-CA 123.537 0.735 . . . . 0.56000000000000005 111.598 -178.781 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 17.3 t0 -79.75 112.13 16.73 Favored 'General case' 0 N--CA 1.439 -0.995 0 C-N-CA 124.41 1.084 . . . . 1.1799999999999999 112.483 -179.574 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 10.0 m120 -80.41 35.4 0.34 Allowed 'General case' 0 CA--C 1.539 0.534 0 O-C-N 120.958 -1.089 . . . . 2.54 112.312 176.85 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -142.92 -55.04 0.41 Allowed 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 119.727 1.148 . . . . 1.9399999999999999 111.783 -174.465 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 88.25 40.4 6.52 Favored Glycine 0 CA--C 1.533 1.206 0 N-CA-C 109.283 -1.527 . . . . 1.4399999999999999 109.283 -152.066 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 20.5 p30 -113.63 -65.03 1.23 Allowed 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 126.087 1.755 . . . . 1.8999999999999999 109.227 169.254 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 129.45 -32.61 3.18 Favored Glycine 0 CA--C 1.524 0.598 0 C-N-CA 124.751 1.167 . . . . 0.83999999999999997 111.001 -177.575 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 19.2 pttm -63.03 121.71 14.25 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 107.549 -1.278 . . . . 5.6500000000000004 107.549 173.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 14.4 mt -123.57 118.56 54.73 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 C-N-CA 124.996 1.318 . . . . 0.70999999999999996 107.726 -172.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -86.31 174.0 46.69 Favored Glycine 0 CA--C 1.531 1.041 0 N-CA-C 110.9 -0.88 . . . . 0.63 110.9 172.607 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -60.51 -42.22 95.94 Favored 'General case' 0 C--O 1.224 -0.271 0 O-C-N 122.222 -0.575 . . . . 0.87 109.643 175.915 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 -57.08 -57.46 12.48 Favored 'General case' 0 N--CA 1.447 -0.575 0 C-N-CA 123.39 0.676 . . . . 2.1899999999999999 109.726 177.031 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 -48.36 -51.25 27.24 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 121.669 0.747 . . . . 1.3100000000000001 110.213 177.017 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 12.5 t80 -61.24 -54.31 45.77 Favored 'General case' 0 CA--C 1.534 0.334 0 O-C-N 121.944 -0.473 . . . . 2.8399999999999999 111.632 -176.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 23.9 tt0 -58.59 -45.27 89.45 Favored 'General case' 0 C--O 1.225 -0.185 0 C-N-CA 125.487 1.515 . . . . 2.6400000000000001 110.885 -178.085 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 55.1 mt-10 -49.2 -54.21 17.64 Favored 'General case' 0 C--N 1.34 0.168 0 CA-C-N 119.219 0.918 . . . . 3.1600000000000001 110.154 175.042 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 2.5 tpp -64.61 -52.84 55.39 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 116.088 -0.506 . . . . 4.5800000000000001 110.117 -177.649 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 50.1 t -53.62 -37.72 32.07 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.225 0 C-N-CA 123.493 0.717 . . . . 1.3700000000000001 111.647 -179.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 10.4 t-80 -63.9 -21.35 66.42 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 124.967 1.307 . . . . 3.3900000000000001 110.487 -178.904 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 18.4 t . . . . . 0 C--O 1.252 1.193 0 N-CA-C 112.564 0.579 . . . . 3.7000000000000002 112.564 -177.96 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.483 HG22 HG12 ' A' ' 47' ' ' VAL . 0.2 OUTLIER . . . . . 0 CA--C 1.535 0.366 0 N-CA-C 112.932 0.716 . . . . 1.9199999999999999 112.932 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -56.04 -40.16 73.08 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-O 122.04 0.924 . . . . 2.1299999999999999 108.985 178.49 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 41.9 t0 -89.7 42.46 1.09 Allowed 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 128.04 2.536 . . . . 3.3399999999999999 109.248 -172.793 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 40.3 t -144.94 -63.96 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.341 0.21 0 C-N-CA 125.075 1.35 . . . . 1.53 109.319 -176.926 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 10.8 tp -166.52 -57.16 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.131 0 N-CA-C 107.074 -1.454 . . . . 1.1899999999999999 107.074 -174.858 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 1.6 m -42.01 -29.27 0.21 Allowed 'General case' 0 N--CA 1.446 -0.638 0 C-N-CA 128.553 2.741 . . . . 0.98999999999999999 115.465 -165.3 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -45.89 -49.08 15.94 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.925 0.89 . . . . 0.60999999999999999 112.139 173.798 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -61.52 -45.16 95.38 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 122.419 1.104 . . . . 1.79 109.283 -179.076 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -67.04 -47.28 71.85 Favored 'General case' 0 N--CA 1.445 -0.708 0 C-N-CA 124.608 1.163 . . . . 2.2999999999999998 109.044 -171.768 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 19.2 pt -63.62 -39.59 85.92 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.801 0 O-C-N 121.774 -0.578 . . . . 0.96999999999999997 111.175 176.221 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.44 -46.54 83.48 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 118.733 0.697 . . . . 0.67000000000000004 110.779 173.852 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.59 -53.16 61.5 Favored 'General case' 0 CA--C 1.531 0.232 0 O-C-N 121.752 -0.593 . . . . 0.60999999999999999 110.642 173.744 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.477 ' HB1' ' CZ ' ' A' ' 30' ' ' PHE . . . -51.81 -43.92 63.28 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 124.683 1.193 . . . . 0.56999999999999995 111.172 -178.818 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -54.6 -35.74 63.7 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 124.539 1.136 . . . . 2.8799999999999999 111.079 176.972 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 4.7 mt-30 -86.43 -43.89 12.45 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 118.238 0.472 . . . . 3.0299999999999998 111.383 179.326 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.12 -45.5 92.79 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-O 121.689 0.757 . . . . 3.48 109.608 179.94 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 4.2 t -99.01 36.91 1.61 Allowed 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 126.216 1.806 . . . . 2.5299999999999998 110.035 -175.229 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 57.7 ttp180 -74.14 -45.98 45.39 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 108.895 -0.78 . . . . 5.8200000000000003 108.895 -178.719 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -81.56 147.88 60.68 Favored Pre-proline 0 N--CA 1.446 -0.665 0 N-CA-C 108.008 -1.108 . . . . 2.2799999999999998 108.008 -163.111 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -65.1 146.7 87.63 Favored 'Trans proline' 0 N--CA 1.452 -0.951 0 C-N-CA 121.803 1.669 . . . . 1.27 110.923 -168.053 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 53.02 46.08 27.49 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 126.102 1.761 . . . . 2.6000000000000001 112.203 177.043 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 3.0 m -118.01 6.5 12.14 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.147 1.379 . . . . 0.78000000000000003 112.79 -179.172 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 2.8 t80 -81.7 83.98 6.95 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 119.86 -1.775 . . . . 2.6099999999999999 110.358 -172.748 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -69.77 138.31 88.07 Favored Pre-proline 0 CA--C 1.539 0.522 0 N-CA-C 109.051 -0.722 . . . . 2.71 109.051 166.798 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -64.54 -60.97 0.12 Allowed 'Trans proline' 0 N--CA 1.45 -1.042 0 C-N-CA 122.674 2.249 . . . . 0.59999999999999998 111.21 -179.393 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -59.6 -45.74 91.03 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 122.914 0.486 . . . . 2.1200000000000001 110.456 -177.425 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -49.36 -60.44 2.82 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 109.769 -0.456 . . . . 4.3700000000000001 109.769 174.389 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.477 ' CZ ' ' HB1' ' A' ' 15' ' ' ALA . 7.6 t80 -63.25 -41.53 99.08 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-O 120.783 0.325 . . . . 3.8199999999999998 111.176 -173.068 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -46.0 -54.81 7.75 Favored 'General case' 0 C--O 1.235 0.297 0 C-N-CA 125.243 1.417 . . . . 5.2800000000000002 110.257 173.388 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -72.2 -49.29 36.57 Favored 'General case' 0 N--CA 1.443 -0.811 0 N-CA-C 108.426 -0.953 . . . . 2.4900000000000002 108.426 -173.348 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -54.99 -36.23 65.19 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 124.193 0.997 . . . . 0.67000000000000004 111.164 -179.5 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 22.3 t -85.17 -2.33 57.91 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 123.577 0.751 . . . . 1.5 111.932 -176.143 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 82.79 0.8 90.41 Favored Glycine 0 C--N 1.339 0.736 0 CA-C-N 119.216 0.916 . . . . 0.75 112.253 168.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -59.33 -30.33 68.29 Favored 'General case' 0 CA--C 1.536 0.43 0 O-C-N 121.65 -0.912 . . . . 2.4399999999999999 109.609 175.13 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 28.9 p -52.58 -42.31 64.39 Favored 'General case' 0 CA--C 1.523 -0.085 0 C-N-CA 124.73 1.212 . . . . 3.1800000000000002 112.153 168.217 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 9.5 tttt -91.71 -28.45 17.42 Favored 'General case' 0 N--CA 1.444 -0.736 0 N-CA-C 109.52 -0.548 . . . . 5.8799999999999999 109.52 -168.25 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 8.2 mmt -52.9 -46.5 68.04 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 113.599 0.963 . . . . 3.3700000000000001 113.599 -175.484 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 19.4 m 93.19 147.79 0.03 OUTLIER 'General case' 0 C--N 1.34 0.164 0 C-N-CA 128.323 2.649 . . . . 2.1899999999999999 109.675 -176.958 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -41.21 -36.72 0.8 Allowed 'General case' 0 N--CA 1.463 0.189 0 C-N-CA 125.682 1.593 . . . . 0.79000000000000004 113.233 -174.665 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -67.76 -60.96 2.12 Favored 'General case' 0 N--CA 1.456 -0.136 0 N-CA-C 108.406 -0.961 . . . . 2.0600000000000001 108.406 -174.594 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 23.3 mm100 -53.45 -49.98 66.25 Favored 'General case' 0 C--O 1.22 -0.49 0 CA-C-N 115.349 -0.841 . . . . 2.71 108.85 175.677 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 74.2 t -54.15 -46.93 67.61 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.503 0 CA-C-N 118.404 0.547 . . . . 0.65000000000000002 111.222 -178.066 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 10.2 tmtt? -62.71 -43.14 99.58 Favored 'General case' 0 CA--C 1.535 0.402 0 O-C-N 121.034 -1.041 . . . . 4.1699999999999999 110.801 176.881 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 80.5 m-20 -65.24 -48.13 74.37 Favored 'General case' 0 CA--C 1.537 0.449 0 O-C-N 121.483 -0.761 . . . . 3.7799999999999998 110.297 -179.012 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.483 HG12 HG22 ' A' ' 3' ' ' ILE . 3.4 m -57.01 -43.87 81.76 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.213 0 O-C-N 121.241 -0.912 . . . . 0.67000000000000004 110.31 174.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.414 ' CE2' ' HA ' ' A' ' 100' ' ' ALA . 6.9 t80 -47.87 -52.95 17.23 Favored 'General case' 0 C--N 1.344 0.327 0 N-CA-C 109.358 -0.608 . . . . 4.3099999999999996 109.358 172.652 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 11.8 mtt180 -66.53 -32.72 74.25 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 113.733 1.012 . . . . 5.5 113.733 179.526 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 20.0 m-85 -56.21 -40.0 73.36 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 119.937 1.244 . . . . 4.3700000000000001 110.715 170.451 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.9 mp -78.65 -44.56 25.77 Favored 'Isoleucine or valine' 0 C--O 1.241 0.607 0 O-C-N 121.82 -0.55 . . . . 1.97 111.923 -178.325 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 20.6 t0 -65.61 79.31 0.07 Allowed 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 125.131 1.372 . . . . 1.76 109.106 178.749 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 13.5 t30 -44.78 -56.86 4.12 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 126.516 1.926 . . . . 2.1200000000000001 112.433 -173.474 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -60.94 -15.68 34.01 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.984 1.714 . . . . 2.52 113.421 177.188 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 13.9 mt-30 57.04 29.79 17.09 Favored 'General case' 0 C--O 1.235 0.3 0 C-N-CA 125.092 1.357 . . . . 3.1099999999999999 111.331 -175.374 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.4 p -64.05 -20.77 66.17 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.541 0.737 . . . . 1.5700000000000001 111.636 178.55 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 86.64 15.66 63.24 Favored Glycine 0 CA--C 1.53 0.979 0 N-CA-C 110.38 -1.088 . . . . 1.5800000000000001 110.38 -172.459 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 76.6 m-85 -136.99 124.77 22.5 Favored 'General case' 0 CA--C 1.515 -0.375 0 C-N-CA 124.803 1.241 . . . . 2.8300000000000001 108.612 -175.916 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -73.38 83.63 1.44 Allowed 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 104.064 -2.569 . . . . 2.6200000000000001 104.064 151.972 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -66.75 164.85 16.22 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 107.206 -1.405 . . . . 3.0699999999999998 107.206 166.204 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -42.07 -51.49 4.53 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 124.545 1.138 . . . . 5.9400000000000004 112.347 -176.051 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -68.17 -24.31 64.95 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 113.012 0.745 . . . . 3.3300000000000001 113.012 -173.226 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -57.67 -40.87 80.35 Favored 'General case' 0 C--N 1.341 0.224 0 CA-C-N 120.314 1.415 . . . . 2.3500000000000001 110.218 172.152 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.2 mp -65.64 -17.95 64.97 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 120.191 -0.603 . . . . 2.6400000000000001 111.514 179.858 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 29.5 ttpt -79.1 -14.3 59.21 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 118.956 0.798 . . . . 2.2400000000000002 111.353 172.844 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 68.5 m-85 -145.17 61.34 1.3 Allowed 'General case' 0 C--O 1.241 0.612 0 C-N-CA 124.267 1.027 . . . . 4.8700000000000001 109.996 175.054 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 18.4 t80 -91.84 -80.42 0.36 Allowed 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.974 1.31 . . . . 2.6899999999999999 108.84 -175.3 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 8.2 mp -65.25 -4.79 5.68 Favored 'General case' 0 N--CA 1.465 0.301 0 O-C-N 120.683 -1.26 . . . . 2.1200000000000001 113.379 170.871 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.13 -23.18 66.41 Favored 'General case' 0 N--CA 1.45 -0.466 0 O-C-N 121.262 -0.898 . . . . 2.8300000000000001 111.4 171.213 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 6.8 mptt -91.52 -42.73 10.09 Favored 'General case' 0 C--N 1.342 0.277 0 CA-C-N 119.298 0.954 . . . . 3.6200000000000001 110.886 167.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 45.0 m-85 -55.4 -50.23 70.3 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 118.447 0.567 . . . . 3.8300000000000001 111.462 -177.377 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 25.2 tp10 -110.97 -66.78 1.05 Allowed 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 124.927 1.291 . . . . 3.4700000000000002 108.904 -177.087 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 48.6 m 107.63 113.52 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 128.377 2.671 . . . . 3.1600000000000001 109.026 -165.564 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 74.25 44.74 27.52 Favored Glycine 0 CA--C 1.527 0.842 0 N-CA-C 111.384 -0.686 . . . . 1.3999999999999999 111.384 176.618 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -85.47 -118.59 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.537 0.735 . . . . 1.54 110.13 177.166 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.24 -7.08 12.41 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.242 1.017 . . . . 3.27 113.006 -169.239 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -54.38 -32.86 57.97 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 126.252 1.821 . . . . 2.9300000000000002 112.871 -158.893 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.479 HD22 ' H ' ' A' ' 78' ' ' LEU . 0.5 OUTLIER -57.63 -41.72 81.94 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 124.26 1.024 . . . . 0.95999999999999996 111.596 176.136 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 49.5 m -67.55 104.6 1.62 Allowed 'General case' 0 C--O 1.235 0.295 0 CA-C-N 118.957 0.799 . . . . 0.81000000000000005 110.04 -178.846 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 13.9 mp0 -61.8 -36.5 81.29 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 115.66 -0.7 . . . . 3.4100000000000001 110.508 -177.461 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 22.1 t -54.72 -55.68 27.32 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 118.828 0.74 . . . . 1.8 110.687 177.86 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -63.45 -47.89 79.97 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 123.991 0.917 . . . . 3.1499999999999999 109.124 -178.193 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -52.96 -45.66 67.84 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 115.897 -0.592 . . . . 0.75 110.432 176.534 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 5.1 mmpt? -68.69 -37.74 79.79 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 124.249 1.02 . . . . 4.7199999999999998 110.883 -178.971 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 22.7 t -51.89 -51.43 56.87 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 119.343 0.974 . . . . 1.79 109.129 171.373 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.436 HD22 ' HA ' ' A' ' 86' ' ' LEU . 1.4 tm? -62.85 -54.27 41.38 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 118.98 -0.533 . . . . 2.4700000000000002 110.207 179.19 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 51.4 ttm -46.68 -50.95 17.03 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 118.254 0.479 . . . . 3.2200000000000002 111.408 176.11 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -54.91 -46.66 74.9 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 125.735 1.614 . . . . 0.69999999999999996 111.624 -171.009 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -82.16 -38.26 24.95 Favored 'General case' 0 CA--C 1.529 0.14 0 N-CA-C 111.779 0.289 . . . . 0.60999999999999999 111.779 -179.79 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -63.98 -44.06 93.83 Favored 'General case' 0 N--CA 1.457 -0.115 0 N-CA-C 111.646 0.239 . . . . 0.40999999999999998 111.646 -179.085 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -65.4 119.27 10.68 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 108.875 -0.787 . . . . 1.04 108.875 178.934 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -103.2 12.01 36.21 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 122.501 0.32 . . . . 3.1400000000000001 111.508 -174.473 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 34.2 m-20 -103.45 -43.74 5.32 Favored 'General case' 0 C--N 1.34 0.159 0 C-N-CA 124.035 0.934 . . . . 1.5900000000000001 109.803 179.811 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 90.33 40.17 5.82 Favored Glycine 0 CA--C 1.529 0.968 0 N-CA-C 108.95 -1.66 . . . . 0.84999999999999998 108.95 -156.354 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -118.45 -59.7 1.85 Allowed 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 117.811 0.805 . . . . 2.46 110.322 177.688 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 131.11 -43.2 1.31 Allowed Glycine 0 CA--C 1.528 0.861 0 C-N-CA 123.827 0.727 . . . . 0.56999999999999995 111.432 179.559 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 18.5 mtpt -69.36 123.91 22.47 Favored 'General case' 0 N--CA 1.451 -0.405 0 N-CA-C 108.771 -0.826 . . . . 5.54 108.771 176.892 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 9.7 mt -108.5 110.37 31.76 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.204 0 N-CA-C 109.854 -0.424 . . . . 0.79000000000000004 109.854 -168.412 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -63.62 157.51 41.43 Favored Glycine 0 CA--C 1.532 1.113 0 N-CA-C 111.106 -0.798 . . . . 0.5 111.106 170.655 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . 0.414 ' HA ' ' CE2' ' A' ' 48' ' ' PHE . . . -55.24 -37.75 67.59 Favored 'General case' 0 C--N 1.339 0.137 0 O-C-N 121.936 -0.744 . . . . 0.66000000000000003 109.745 169.798 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -55.48 -60.88 2.81 Favored 'General case' 0 N--CA 1.448 -0.53 0 C-N-CA 124.308 1.043 . . . . 2.8500000000000001 109.672 176.582 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -47.87 -49.21 30.24 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.203 1.001 . . . . 1.3 111.279 176.225 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -61.34 -51.79 67.34 Favored 'General case' 0 N--CA 1.457 -0.117 0 CA-C-O 121.401 0.62 . . . . 3.0800000000000001 110.99 -178.033 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 10.7 tm0? -58.61 -36.5 74.13 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-O 117.74 -1.124 . . . . 2.8199999999999998 110.438 178.573 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -60.11 -61.46 2.59 Favored 'General case' 0 N--CA 1.457 -0.099 0 CA-C-N 120.012 1.278 . . . . 3.3700000000000001 110.761 170.44 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 3.7 ttp -54.31 -38.73 66.28 Favored 'General case' 0 C--N 1.34 0.161 0 CA-C-O 120.881 0.372 . . . . 4.8700000000000001 110.508 -173.569 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 54.6 t -70.56 -76.02 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.446 -0.673 0 C-N-CA 123.388 0.675 . . . . 1.6299999999999999 110.085 174.363 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 52.8 t-80 -50.82 -44.32 59.13 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 123.668 0.787 . . . . 2.8100000000000001 111.211 -167.964 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.251 1.151 0 O-C-N 124.622 1.202 . . . . 5.6399999999999997 109.557 -174.425 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 51.4 mtt . . . . . 0 N--CA 1.476 0.831 0 N-CA-C 110.418 -0.215 . . . . 7.1900000000000004 110.418 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.0 m -161.95 -66.92 0.05 Allowed 'General case' 0 C--O 1.225 -0.195 0 N-CA-C 108.616 -0.883 . . . . 2.5 108.616 176.356 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.512 HG22 HG12 ' A' ' 47' ' ' VAL . 1.6 pp -91.65 -30.06 4.72 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.206 0 C-N-CA 123.77 0.828 . . . . 1.24 110.567 -169.416 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 12.5 t -66.0 -9.85 34.12 Favored 'General case' 0 N--CA 1.426 -1.667 0 C-N-CA 127.673 2.389 . . . . 1.6899999999999999 112.078 -174.386 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 26.4 t0 -138.59 28.46 2.44 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.14 0.976 . . . . 2.8100000000000001 109.822 178.206 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 1.1 p -100.55 -46.74 11.77 Favored 'Isoleucine or valine' 0 C--N 1.344 0.327 0 O-C-N 121.682 -0.636 . . . . 1.9299999999999999 109.907 173.554 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 173.24 -58.8 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 106.956 -1.498 . . . . 1.1000000000000001 106.956 -165.742 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -43.48 -31.62 0.74 Allowed 'General case' 0 C--O 1.218 -0.556 0 C-N-CA 126.291 1.836 . . . . 1.3100000000000001 114.478 -169.386 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -45.5 -47.9 14.08 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 119.235 0.925 . . . . 0.62 112.874 173.775 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -67.21 -42.31 84.31 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-O 122.239 1.019 . . . . 1.78 109.789 -179.86 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -64.86 -43.52 92.72 Favored 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 123.734 0.814 . . . . 2.4100000000000001 109.425 -175.059 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 26.6 pt -67.1 -39.38 83.1 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.858 0 O-C-N 121.426 -0.796 . . . . 0.73999999999999999 111.02 176.522 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.63 -40.56 72.31 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 118.649 0.659 . . . . 0.65000000000000002 110.787 171.907 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.85 -57.09 10.91 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 121.914 -0.491 . . . . 0.56999999999999995 111.057 171.557 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -46.81 -47.59 21.0 Favored 'General case' 0 N--CA 1.462 0.158 0 C-N-CA 125.895 1.678 . . . . 0.56999999999999995 111.138 -177.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 16.0 tp -48.45 -48.54 37.42 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 125.941 1.696 . . . . 2.6000000000000001 109.595 178.243 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 -82.94 -43.3 16.63 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 110.517 -0.179 . . . . 3.2400000000000002 110.517 -174.297 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -66.87 -38.85 87.12 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 110.527 -0.175 . . . . 2.29 110.527 -173.561 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 56.6 m -106.92 62.55 0.63 Allowed 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 124.537 1.135 . . . . 1.52 108.084 166.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -74.95 -41.93 58.66 Favored 'General case' 0 N--CA 1.464 0.265 0 O-C-N 121.799 -0.563 . . . . 5.3099999999999996 109.514 170.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -78.81 148.39 72.4 Favored Pre-proline 0 N--CA 1.45 -0.459 0 C-N-CA 123.741 0.816 . . . . 1.98 111.126 -160.238 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -66.3 130.11 23.18 Favored 'Trans proline' 0 N--CA 1.449 -1.114 0 C-N-CA 123.006 2.471 . . . . 1.3 110.915 -175.146 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 74.4 37.62 0.56 Allowed 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 127.689 2.396 . . . . 2.9700000000000002 110.343 173.317 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 16.1 m -115.71 -6.56 12.14 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.214 1.006 . . . . 0.66000000000000003 112.759 -173.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -80.62 83.42 6.4 Favored 'General case' 0 CA--C 1.535 0.393 0 O-C-N 120.694 -1.254 . . . . 2.2999999999999998 111.248 -160.836 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -68.17 143.54 96.02 Favored Pre-proline 0 CA--C 1.534 0.332 0 O-C-N 121.596 -0.69 . . . . 2.5699999999999998 110.183 178.143 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -71.6 -62.52 0.04 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.24 0 C-N-CA 122.562 2.175 . . . . 0.65000000000000002 111.883 -175.095 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 37.1 mt-30 -55.07 -46.05 75.38 Favored 'General case' 0 C--O 1.233 0.193 0 C-N-CA 123.254 0.621 . . . . 2.3999999999999999 109.801 179.336 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 42.8 tptt -49.96 -56.64 9.82 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 116.009 -0.541 . . . . 3.2599999999999998 109.786 173.218 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 54.9 t80 -56.26 -50.97 69.84 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 111.534 0.198 . . . . 2.2599999999999998 111.534 179.841 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 31.0 m-85 -56.67 -34.6 67.53 Favored 'General case' 0 CA--C 1.532 0.272 0 O-C-N 121.319 -0.863 . . . . 5.25 112.008 -178.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 5.5 mm-40 -71.93 -58.6 3.32 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 108.568 -0.901 . . . . 3.1699999999999999 108.568 174.567 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -63.99 -25.28 68.06 Favored 'General case' 0 N--CA 1.439 -1.005 0 C-N-CA 123.945 0.898 . . . . 0.65000000000000002 111.839 -169.401 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 18.5 t -85.02 -7.83 58.97 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 126.02 1.728 . . . . 1.48 111.44 179.318 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 86.24 -11.78 62.21 Favored Glycine 0 C--N 1.338 0.674 0 N-CA-C 111.376 -0.69 . . . . 0.69999999999999996 111.376 174.512 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 93.5 mt -54.78 -42.83 72.23 Favored 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 125.516 1.526 . . . . 1.29 111.029 -179.654 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 5.3 t -72.02 -13.5 61.62 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.102 0.561 . . . . 1.8700000000000001 111.977 177.159 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -89.45 -35.94 15.71 Favored 'General case' 0 N--CA 1.452 -0.345 0 O-C-N 121.337 -0.852 . . . . 3.4900000000000002 109.863 174.469 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 59.9 mtt -57.13 152.39 13.57 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 121.603 0.716 . . . . 2.8900000000000001 111.361 174.295 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 23.8 t -78.69 154.76 29.86 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 116.213 -0.449 . . . . 1.99 109.905 174.579 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -41.0 -44.57 2.4 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 125.602 1.561 . . . . 0.56000000000000005 112.129 176.018 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 68.3 m-80 -54.33 -58.22 8.24 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.304 0.642 . . . . 1.5900000000000001 110.339 178.85 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 3.6 mm-40 -59.82 -44.61 93.93 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 123.077 0.551 . . . . 2.6699999999999999 109.849 -179.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.416 ' CG1' ' CZ ' ' A' ' 48' ' ' PHE . 53.1 t -57.91 -43.95 85.59 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 CA-C-O 121.293 0.568 . . . . 0.59999999999999998 109.523 -179.264 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 21.6 tttt -63.27 -48.92 76.14 Favored 'General case' 0 N--CA 1.452 -0.37 0 O-C-N 121.289 -0.882 . . . . 2.98 110.922 176.288 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -51.54 -54.09 31.02 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 118.18 0.446 . . . . 3.0699999999999998 110.671 176.363 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.512 HG12 HG22 ' A' ' 3' ' ' ILE 0.27 17.4 m -54.7 -44.34 70.04 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.206 0 CA-C-O 118.826 -0.607 . . . . 0.57999999999999996 110.984 178.802 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.559 ' CZ ' ' HB3' ' A' ' 103' ' ' PHE . 15.1 m-30 -54.21 -40.39 67.6 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 119.153 0.888 . . . . 5.9400000000000004 112.783 174.343 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 69.7 mtp85 -57.25 -42.02 80.72 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 118.613 0.642 . . . . 2.96 109.947 174.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 -68.64 -33.24 73.67 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 118.67 -0.681 . . . . 5.5599999999999996 110.949 176.77 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 14.0 mm -63.65 -59.81 3.72 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 CA-C-O 118.433 -0.794 . . . . 1.5 110.89 175.718 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 55.6 t0 -74.13 71.18 1.63 Allowed 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 119.194 0.906 . . . . 1.8700000000000001 110.554 -175.791 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 27.7 t30 -46.32 -47.24 18.49 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 125.888 1.675 . . . . 1.9199999999999999 111.0 176.617 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -64.39 -19.26 65.38 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 126.639 1.976 . . . . 3.96 112.12 -177.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 59.64 12.64 2.97 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 127.08 2.152 . . . . 4.6100000000000003 113.58 178.677 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 3.9 p -70.12 -10.32 58.39 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 113.83 1.048 . . . . 2.21 113.83 -170.138 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 85.71 34.89 12.4 Favored Glycine 0 CA--C 1.529 0.937 0 CA-C-N 118.933 0.788 . . . . 2.4300000000000002 111.968 172.067 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -171.05 143.71 2.01 Favored 'General case' 0 CA--C 1.519 -0.233 0 C-N-CA 127.289 2.235 . . . . 2.75 105.001 175.625 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -102.93 68.54 1.0 Allowed 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 107.309 -1.367 . . . . 2.27 107.309 176.272 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -56.81 146.45 26.16 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.744 1.618 . . . . 1.6699999999999999 110.761 179.362 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -44.89 -51.26 9.84 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 123.512 0.725 . . . . 3.54 112.953 -175.395 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -69.67 -19.62 63.59 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 121.968 -0.457 . . . . 3.2799999999999998 111.917 -173.39 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 91.4 mt-10 -77.64 -44.57 27.77 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-O 121.293 0.568 . . . . 2.3900000000000001 109.598 167.413 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 6.4 tp -53.23 -28.24 26.2 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.644 0.777 . . . . 2.6299999999999999 110.978 174.191 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 30.2 ttpt -50.67 -16.71 0.42 Allowed 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 113.904 1.076 . . . . 2.4700000000000002 113.904 169.326 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 27.5 p90 -127.48 33.93 4.76 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 120.097 1.317 . . . . 5.25 112.634 170.138 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 46.4 t80 -57.76 -67.36 0.34 Allowed 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.649 0.78 . . . . 2.4500000000000002 110.794 178.431 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 2.9 tp -85.38 -9.27 57.79 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.473 -0.767 . . . . 2.3900000000000001 112.066 -175.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 49.5 mm-40 -56.0 -18.72 10.11 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.098 0.959 . . . . 1.6100000000000001 111.399 171.405 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -83.04 -16.39 47.22 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 121.196 -0.94 . . . . 3.5499999999999998 111.476 177.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 6.3 m-30 -101.16 -53.87 2.92 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 124.674 1.189 . . . . 3.25 108.916 -179.1 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -112.83 161.2 17.21 Favored 'General case' 0 C--O 1.222 -0.371 0 N-CA-C 106.606 -1.627 . . . . 3.3500000000000001 106.606 175.8 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 24.1 m -85.66 -34.62 21.27 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 118.896 0.771 . . . . 2.0800000000000001 110.524 172.629 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -114.48 42.61 1.88 Allowed Glycine 0 CA--C 1.519 0.324 0 N-CA-C 109.568 -1.413 . . . . 1.04 109.568 -170.444 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.08 -171.57 0.92 Allowed 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 120.953 0.406 . . . . 1.28 111.01 177.552 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.7 -13.59 39.31 Favored 'General case' 0 N--CA 1.453 -0.287 0 O-C-N 121.696 -0.628 . . . . 3.0 112.545 -166.112 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -46.47 -40.59 12.64 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 126.842 2.057 . . . . 3.1099999999999999 112.802 -163.445 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.401 HD22 ' H ' ' A' ' 78' ' ' LEU . 0.2 OUTLIER -49.04 -43.1 40.37 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.607 1.163 . . . . 0.81000000000000005 112.144 175.584 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 91.8 m -69.26 104.77 2.31 Favored 'General case' 0 C--O 1.235 0.304 0 O-C-N 121.523 -0.736 . . . . 0.77000000000000002 109.98 175.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -54.77 -41.98 71.14 Favored 'General case' 0 C--O 1.219 -0.542 0 CA-C-N 115.609 -0.723 . . . . 3.0699999999999998 111.671 178.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 34.7 t -54.28 -53.91 47.37 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-O 121.463 0.649 . . . . 1.79 111.081 -178.463 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -63.36 -47.67 81.12 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 124.074 0.949 . . . . 2.8900000000000001 108.577 -178.765 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -52.22 -44.91 65.03 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 116.177 -0.465 . . . . 0.55000000000000004 111.229 174.232 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -76.42 -27.3 56.2 Favored 'General case' 0 C--O 1.221 -0.422 0 C-N-CA 124.219 1.007 . . . . 5.0899999999999999 110.718 -175.793 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 24.6 m -61.6 -45.96 91.87 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 119.089 0.859 . . . . 1.5 109.798 168.667 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -59.3 -57.91 10.96 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 110.039 -0.356 . . . . 2.7799999999999998 110.039 172.194 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 22.2 ttp -47.16 -52.64 15.05 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.22 0.608 . . . . 3.0699999999999998 111.366 178.214 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -49.65 -51.37 38.41 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 126.117 1.767 . . . . 0.5 111.537 -172.028 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -78.02 -41.73 34.81 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-O 119.853 -0.118 . . . . 0.48999999999999999 111.294 179.835 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -54.81 -41.36 70.54 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-O 120.682 0.277 . . . . 0.34999999999999998 111.036 179.263 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -77.76 80.96 4.21 Favored 'General case' 0 N--CA 1.445 -0.688 0 C-N-CA 123.245 0.618 . . . . 0.93000000000000005 111.083 -176.574 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 52.8 p-10 -76.26 41.31 0.23 Allowed 'General case' 0 CA--C 1.541 0.633 0 O-C-N 121.405 -0.809 . . . . 2.79 112.16 176.374 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 29.2 m-20 -126.11 -58.98 1.35 Allowed 'General case' 0 C--N 1.342 0.251 0 C-N-CA 126.193 1.797 . . . . 1.25 108.299 172.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 93.94 44.33 3.62 Favored Glycine 0 CA--C 1.53 0.971 0 N-CA-C 109.147 -1.581 . . . . 0.81999999999999995 109.147 -157.304 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 41.0 p-10 -124.87 -47.43 1.8 Allowed 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 124.621 1.168 . . . . 2.0499999999999998 110.318 172.395 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 115.7 -31.24 6.22 Favored Glycine 0 CA--C 1.524 0.638 0 C-N-CA 124.618 1.104 . . . . 0.64000000000000001 111.227 170.655 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 21.5 pttp -69.34 114.22 7.39 Favored 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 107.692 -1.225 . . . . 5.1600000000000001 107.692 168.715 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 19.7 mt -103.83 115.57 46.02 Favored 'Isoleucine or valine' 0 C--O 1.231 0.13 0 C-N-CA 123.551 0.74 . . . . 0.66000000000000003 109.36 -171.842 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -72.28 162.15 54.48 Favored Glycine 0 CA--C 1.534 1.267 0 CA-C-O 121.831 0.684 . . . . 0.55000000000000004 112.143 172.463 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -57.11 -40.09 76.38 Favored 'General case' 0 C--O 1.226 -0.184 0 O-C-N 121.78 -0.835 . . . . 0.59999999999999998 109.673 172.106 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -56.19 -54.18 48.23 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.978 0.911 . . . . 2.5699999999999998 110.274 177.262 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -51.66 -50.53 60.19 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.079 0.952 . . . . 1.27 110.422 176.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . 0.559 ' HB3' ' CZ ' ' A' ' 48' ' ' PHE . 3.4 m-85 -61.12 -44.22 97.68 Favored 'General case' 0 CA--C 1.534 0.364 0 O-C-N 121.87 -0.519 . . . . 3.7799999999999998 111.709 177.847 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 30.9 tt0 -57.42 -49.83 74.95 Favored 'General case' 0 C--O 1.222 -0.384 0 N-CA-C 108.796 -0.816 . . . . 2.0699999999999998 108.796 178.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -47.01 -60.39 2.48 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 123.521 0.729 . . . . 3.2400000000000002 110.548 172.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.22 -43.42 98.87 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 120.378 -0.529 . . . . 2.8500000000000001 110.976 -172.257 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 66.2 t -64.23 -38.93 83.78 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.428 0 CA-C-O 119.306 -0.378 . . . . 1.01 111.227 176.596 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 79.5 t60 -66.42 -22.48 66.23 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 124.376 1.07 . . . . 2.6000000000000001 110.055 -173.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 22.7 t . . . . . 0 C--O 1.253 1.273 0 CA-C-O 115.343 -2.265 . . . . 2.5800000000000001 112.986 176.886 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 51.4 mtt . . . . . 0 N--CA 1.476 0.831 0 N-CA-C 110.418 -0.215 . . . . 7.1900000000000004 110.418 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.0 m -161.95 -66.92 0.05 Allowed 'General case' 0 C--O 1.225 -0.195 0 N-CA-C 108.616 -0.883 . . . . 2.5 108.616 176.356 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.512 HG22 HG12 ' A' ' 47' ' ' VAL . 1.6 pp -91.65 -30.06 4.72 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.206 0 C-N-CA 123.77 0.828 . . . . 1.24 110.567 -169.416 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 12.5 t -66.0 -9.85 34.12 Favored 'General case' 0 N--CA 1.426 -1.667 0 C-N-CA 127.673 2.389 . . . . 1.6899999999999999 112.078 -174.386 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 26.4 t0 -138.59 28.46 2.44 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.14 0.976 . . . . 2.8100000000000001 109.822 178.206 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 1.1 p -100.55 -46.74 11.77 Favored 'Isoleucine or valine' 0 C--N 1.344 0.327 0 O-C-N 121.682 -0.636 . . . . 1.9299999999999999 109.907 173.554 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 173.24 -58.8 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 106.956 -1.498 . . . . 1.1000000000000001 106.956 -165.742 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -43.48 -31.62 0.74 Allowed 'General case' 0 C--O 1.218 -0.556 0 C-N-CA 126.291 1.836 . . . . 1.3100000000000001 114.478 -169.386 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -45.5 -47.9 14.08 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 119.235 0.925 . . . . 0.62 112.874 173.775 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -67.21 -42.31 84.31 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-O 122.239 1.019 . . . . 1.78 109.789 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -64.86 -43.52 92.72 Favored 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 123.734 0.814 . . . . 2.4100000000000001 109.425 -175.059 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 26.6 pt -67.1 -39.38 83.1 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.858 0 O-C-N 121.426 -0.796 . . . . 0.73999999999999999 111.02 176.522 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.63 -40.56 72.31 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 118.649 0.659 . . . . 0.65000000000000002 110.787 171.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.85 -57.09 10.91 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 121.914 -0.491 . . . . 0.56999999999999995 111.057 171.557 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -46.81 -47.59 21.0 Favored 'General case' 0 N--CA 1.462 0.158 0 C-N-CA 125.895 1.678 . . . . 0.56999999999999995 111.138 -177.862 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 16.0 tp -48.45 -48.54 37.42 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 125.941 1.696 . . . . 2.6000000000000001 109.595 178.243 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 -82.94 -43.3 16.63 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 110.517 -0.179 . . . . 3.2400000000000002 110.517 -174.297 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -66.87 -38.85 87.12 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 110.527 -0.175 . . . . 2.29 110.527 -173.561 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 56.6 m -106.92 62.55 0.63 Allowed 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 124.537 1.135 . . . . 1.52 108.084 166.905 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -74.95 -41.93 58.66 Favored 'General case' 0 N--CA 1.464 0.265 0 O-C-N 121.799 -0.563 . . . . 5.3099999999999996 109.514 170.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -78.81 148.39 72.4 Favored Pre-proline 0 N--CA 1.45 -0.459 0 C-N-CA 123.741 0.816 . . . . 1.98 111.126 -160.238 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -66.3 130.11 23.18 Favored 'Trans proline' 0 N--CA 1.449 -1.114 0 C-N-CA 123.006 2.471 . . . . 1.3 110.915 -175.146 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 74.4 37.62 0.56 Allowed 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 127.689 2.396 . . . . 2.9700000000000002 110.343 173.317 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 16.1 m -115.71 -6.56 12.14 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.214 1.006 . . . . 0.66000000000000003 112.759 -173.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -80.62 83.42 6.4 Favored 'General case' 0 CA--C 1.535 0.393 0 O-C-N 120.694 -1.254 . . . . 2.2999999999999998 111.248 -160.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -68.17 143.54 96.02 Favored Pre-proline 0 CA--C 1.534 0.332 0 O-C-N 121.596 -0.69 . . . . 2.5699999999999998 110.183 178.143 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -71.6 -62.52 0.04 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.24 0 C-N-CA 122.562 2.175 . . . . 0.65000000000000002 111.883 -175.095 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 37.1 mt-30 -55.07 -46.05 75.38 Favored 'General case' 0 C--O 1.233 0.193 0 C-N-CA 123.254 0.621 . . . . 2.3999999999999999 109.801 179.336 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 42.8 tptt -49.96 -56.64 9.82 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 116.009 -0.541 . . . . 3.2599999999999998 109.786 173.218 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 54.9 t80 -56.26 -50.97 69.84 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 111.534 0.198 . . . . 2.2599999999999998 111.534 179.841 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 31.0 m-85 -56.67 -34.6 67.53 Favored 'General case' 0 CA--C 1.532 0.272 0 O-C-N 121.319 -0.863 . . . . 5.25 112.008 -178.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 5.5 mm-40 -71.93 -58.6 3.32 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 108.568 -0.901 . . . . 3.1699999999999999 108.568 174.567 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -63.99 -25.28 68.06 Favored 'General case' 0 N--CA 1.439 -1.005 0 C-N-CA 123.945 0.898 . . . . 0.65000000000000002 111.839 -169.401 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 18.5 t -85.02 -7.83 58.97 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 126.02 1.728 . . . . 1.48 111.44 179.318 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 86.24 -11.78 62.21 Favored Glycine 0 C--N 1.338 0.674 0 N-CA-C 111.376 -0.69 . . . . 0.69999999999999996 111.376 174.512 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 93.5 mt -54.78 -42.83 72.23 Favored 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 125.516 1.526 . . . . 1.29 111.029 -179.654 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 5.3 t -72.02 -13.5 61.62 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.102 0.561 . . . . 1.8700000000000001 111.977 177.159 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -89.45 -35.94 15.71 Favored 'General case' 0 N--CA 1.452 -0.345 0 O-C-N 121.337 -0.852 . . . . 3.4900000000000002 109.863 174.469 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 59.9 mtt -57.13 152.39 13.57 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 121.603 0.716 . . . . 2.8900000000000001 111.361 174.295 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 23.8 t -78.69 154.76 29.86 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 116.213 -0.449 . . . . 1.99 109.905 174.579 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -41.0 -44.57 2.4 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 125.602 1.561 . . . . 0.56000000000000005 112.129 176.018 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 68.3 m-80 -54.33 -58.22 8.24 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.304 0.642 . . . . 1.5900000000000001 110.339 178.85 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 3.6 mm-40 -59.82 -44.61 93.93 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 123.077 0.551 . . . . 2.6699999999999999 109.849 -179.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.416 ' CG1' ' CZ ' ' A' ' 48' ' ' PHE . 53.1 t -57.91 -43.95 85.59 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 CA-C-O 121.293 0.568 . . . . 0.59999999999999998 109.523 -179.264 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 21.6 tttt -63.27 -48.92 76.14 Favored 'General case' 0 N--CA 1.452 -0.37 0 O-C-N 121.289 -0.882 . . . . 2.98 110.922 176.288 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -51.54 -54.09 31.02 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 118.18 0.446 . . . . 3.0699999999999998 110.671 176.363 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.512 HG12 HG22 ' A' ' 3' ' ' ILE 0.27 17.4 m -54.7 -44.34 70.04 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.206 0 CA-C-O 118.826 -0.607 . . . . 0.57999999999999996 110.984 178.802 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.559 ' CZ ' ' HB3' ' A' ' 103' ' ' PHE . 15.1 m-30 -54.21 -40.39 67.6 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 119.153 0.888 . . . . 5.9400000000000004 112.783 174.343 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 69.7 mtp85 -57.25 -42.02 80.72 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 118.613 0.642 . . . . 2.96 109.947 174.906 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 -68.64 -33.24 73.67 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 118.67 -0.681 . . . . 5.5599999999999996 110.949 176.77 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 14.0 mm -63.65 -59.81 3.72 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 CA-C-O 118.433 -0.794 . . . . 1.5 110.89 175.718 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 55.6 t0 -74.13 71.18 1.63 Allowed 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 119.194 0.906 . . . . 1.8700000000000001 110.554 -175.791 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 27.7 t30 -46.32 -47.24 18.49 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 125.888 1.675 . . . . 1.9199999999999999 111.0 176.617 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -64.39 -19.26 65.38 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 126.639 1.976 . . . . 3.96 112.12 -177.905 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 59.64 12.64 2.97 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 127.08 2.152 . . . . 4.6100000000000003 113.58 178.677 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 3.9 p -70.12 -10.32 58.39 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 113.83 1.048 . . . . 2.21 113.83 -170.138 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 85.71 34.89 12.4 Favored Glycine 0 CA--C 1.529 0.937 0 CA-C-N 118.933 0.788 . . . . 2.4300000000000002 111.968 172.067 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -171.05 143.71 2.01 Favored 'General case' 0 CA--C 1.519 -0.233 0 C-N-CA 127.289 2.235 . . . . 2.75 105.001 175.625 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -102.93 68.54 1.0 Allowed 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 107.309 -1.367 . . . . 2.27 107.309 176.272 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -56.81 146.45 26.16 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.744 1.618 . . . . 1.6699999999999999 110.761 179.362 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -44.89 -51.26 9.84 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 123.512 0.725 . . . . 3.54 112.953 -175.395 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -69.67 -19.62 63.59 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 121.968 -0.457 . . . . 3.2799999999999998 111.917 -173.39 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 91.4 mt-10 -77.64 -44.57 27.77 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-O 121.293 0.568 . . . . 2.3900000000000001 109.598 167.413 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 6.4 tp -53.23 -28.24 26.2 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.644 0.777 . . . . 2.6299999999999999 110.978 174.191 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 30.2 ttpt -50.67 -16.71 0.42 Allowed 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 113.904 1.076 . . . . 2.4700000000000002 113.904 169.326 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 27.5 p90 -127.48 33.93 4.76 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 120.097 1.317 . . . . 5.25 112.634 170.138 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 46.4 t80 -57.76 -67.36 0.34 Allowed 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.649 0.78 . . . . 2.4500000000000002 110.794 178.431 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 2.9 tp -85.38 -9.27 57.79 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.473 -0.767 . . . . 2.3900000000000001 112.066 -175.79 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 49.5 mm-40 -56.0 -18.72 10.11 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.098 0.959 . . . . 1.6100000000000001 111.399 171.405 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -83.04 -16.39 47.22 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 121.196 -0.94 . . . . 3.5499999999999998 111.476 177.969 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 6.3 m-30 -101.16 -53.87 2.92 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 124.674 1.189 . . . . 3.25 108.916 -179.1 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -112.83 161.2 17.21 Favored 'General case' 0 C--O 1.222 -0.371 0 N-CA-C 106.606 -1.627 . . . . 3.3500000000000001 106.606 175.8 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 24.1 m -85.66 -34.62 21.27 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 118.896 0.771 . . . . 2.0800000000000001 110.524 172.629 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -114.48 42.61 1.88 Allowed Glycine 0 CA--C 1.519 0.324 0 N-CA-C 109.568 -1.413 . . . . 1.04 109.568 -170.444 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.08 -171.57 0.92 Allowed 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 120.953 0.406 . . . . 1.28 111.01 177.552 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.7 -13.59 39.31 Favored 'General case' 0 N--CA 1.453 -0.287 0 O-C-N 121.696 -0.628 . . . . 3.0 112.545 -166.112 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -46.47 -40.59 12.64 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 126.842 2.057 . . . . 3.1099999999999999 112.802 -163.445 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.401 HD22 ' H ' ' A' ' 78' ' ' LEU . 0.2 OUTLIER -49.04 -43.1 40.37 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.607 1.163 . . . . 0.81000000000000005 112.144 175.584 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 91.8 m -69.26 104.77 2.31 Favored 'General case' 0 C--O 1.235 0.304 0 O-C-N 121.523 -0.736 . . . . 0.77000000000000002 109.98 175.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -54.77 -41.98 71.14 Favored 'General case' 0 C--O 1.219 -0.542 0 CA-C-N 115.609 -0.723 . . . . 3.0699999999999998 111.671 178.807 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 34.7 t -54.28 -53.91 47.37 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-O 121.463 0.649 . . . . 1.79 111.081 -178.463 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -63.36 -47.67 81.12 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 124.074 0.949 . . . . 2.8900000000000001 108.577 -178.765 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -52.22 -44.91 65.03 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 116.177 -0.465 . . . . 0.55000000000000004 111.229 174.232 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -76.42 -27.3 56.2 Favored 'General case' 0 C--O 1.221 -0.422 0 C-N-CA 124.219 1.007 . . . . 5.0899999999999999 110.718 -175.793 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 24.6 m -61.6 -45.96 91.87 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 119.089 0.859 . . . . 1.5 109.798 168.667 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -59.3 -57.91 10.96 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 110.039 -0.356 . . . . 2.7799999999999998 110.039 172.194 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 22.2 ttp -47.16 -52.64 15.05 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.22 0.608 . . . . 3.0699999999999998 111.366 178.214 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -49.65 -51.37 38.41 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 126.117 1.767 . . . . 0.5 111.537 -172.028 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -78.02 -41.73 34.81 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-O 119.853 -0.118 . . . . 0.48999999999999999 111.294 179.835 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -54.81 -41.36 70.54 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-O 120.682 0.277 . . . . 0.34999999999999998 111.036 179.263 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -77.76 80.96 4.21 Favored 'General case' 0 N--CA 1.445 -0.688 0 C-N-CA 123.245 0.618 . . . . 0.93000000000000005 111.083 -176.574 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 52.8 p-10 -76.26 41.31 0.23 Allowed 'General case' 0 CA--C 1.541 0.633 0 O-C-N 121.405 -0.809 . . . . 2.79 112.16 176.374 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 29.2 m-20 -126.11 -58.98 1.35 Allowed 'General case' 0 C--N 1.342 0.251 0 C-N-CA 126.193 1.797 . . . . 1.25 108.299 172.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 93.94 44.33 3.62 Favored Glycine 0 CA--C 1.53 0.971 0 N-CA-C 109.147 -1.581 . . . . 0.81999999999999995 109.147 -157.304 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 41.0 p-10 -124.87 -47.43 1.8 Allowed 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 124.621 1.168 . . . . 2.0499999999999998 110.318 172.395 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 115.7 -31.24 6.22 Favored Glycine 0 CA--C 1.524 0.638 0 C-N-CA 124.618 1.104 . . . . 0.64000000000000001 111.227 170.655 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 21.5 pttp -69.34 114.22 7.39 Favored 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 107.692 -1.225 . . . . 5.1600000000000001 107.692 168.715 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 19.7 mt -103.83 115.57 46.02 Favored 'Isoleucine or valine' 0 C--O 1.231 0.13 0 C-N-CA 123.551 0.74 . . . . 0.66000000000000003 109.36 -171.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -72.28 162.15 54.48 Favored Glycine 0 CA--C 1.534 1.267 0 CA-C-O 121.831 0.684 . . . . 0.55000000000000004 112.143 172.463 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -57.11 -40.09 76.38 Favored 'General case' 0 C--O 1.226 -0.184 0 O-C-N 121.78 -0.835 . . . . 0.59999999999999998 109.673 172.106 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -56.19 -54.18 48.23 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.978 0.911 . . . . 2.5699999999999998 110.274 177.262 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -51.66 -50.53 60.19 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.079 0.952 . . . . 1.27 110.422 176.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . 0.559 ' HB3' ' CZ ' ' A' ' 48' ' ' PHE . 3.4 m-85 -61.12 -44.22 97.68 Favored 'General case' 0 CA--C 1.534 0.364 0 O-C-N 121.87 -0.519 . . . . 3.7799999999999998 111.709 177.847 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 30.9 tt0 -57.42 -49.83 74.95 Favored 'General case' 0 C--O 1.222 -0.384 0 N-CA-C 108.796 -0.816 . . . . 2.0699999999999998 108.796 178.877 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -47.01 -60.39 2.48 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 123.521 0.729 . . . . 3.2400000000000002 110.548 172.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.22 -43.42 98.87 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 120.378 -0.529 . . . . 2.8500000000000001 110.976 -172.257 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 66.2 t -64.23 -38.93 83.78 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.428 0 CA-C-O 119.306 -0.378 . . . . 1.01 111.227 176.596 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 79.5 t60 -66.42 -22.48 66.23 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 124.376 1.07 . . . . 2.6000000000000001 110.055 -173.899 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 22.7 t . . . . . 0 C--O 1.253 1.273 0 CA-C-O 115.343 -2.265 . . . . 2.5800000000000001 112.986 176.886 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 17.1 mmt . . . . . 0 N--CA 1.47 0.565 0 N-CA-C 108.514 -0.921 . . . . 8.9100000000000001 108.514 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 75.7 m -161.38 170.49 19.98 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 104.771 -2.307 . . . . 2.6000000000000001 104.771 176.562 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.689 HG22 HG12 ' A' ' 47' ' ' VAL . 1.3 pp -47.27 -37.79 4.71 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.679 0 C-N-CA 123.806 0.842 . . . . 1.22 112.662 -173.062 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 14.8 t -68.89 -7.06 31.22 Favored 'General case' 0 N--CA 1.429 -1.491 0 C-N-CA 127.866 2.466 . . . . 1.8200000000000001 112.812 -177.241 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 47.1 t0 -153.11 44.34 0.64 Allowed 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.438 1.495 . . . . 2.54 108.891 -177.766 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 13.2 t -128.29 -59.14 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.339 0.133 0 C-N-CA 126.171 1.788 . . . . 1.55 108.936 174.49 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -172.54 -47.55 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.14 0 N-CA-C 106.986 -1.487 . . . . 1.29 106.986 -175.194 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 2.4 m -48.15 -32.66 7.24 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 114.46 1.282 . . . . 0.93999999999999995 114.46 -175.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -51.19 -40.72 59.3 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 119.363 0.983 . . . . 0.84999999999999998 113.218 174.818 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -76.04 -37.15 58.67 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 121.54 0.686 . . . . 2.1699999999999999 109.791 177.854 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 23.2 m-20 -57.47 -52.31 65.9 Favored 'General case' 0 C--O 1.234 0.278 0 C-N-CA 124.083 0.953 . . . . 2.5899999999999999 108.569 -179.43 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 28.3 pt -61.8 -39.3 82.9 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.278 0 CA-C-N 115.352 -0.84 . . . . 0.72999999999999998 109.929 -178.131 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -54.23 -44.68 71.91 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 118.267 0.485 . . . . 0.66000000000000003 111.045 174.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.96 -59.14 5.24 Favored 'General case' 0 CA--C 1.53 0.185 0 O-C-N 121.908 -0.495 . . . . 0.64000000000000001 110.84 174.495 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -48.79 -46.06 41.05 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 124.132 0.973 . . . . 0.63 112.015 -177.56 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -50.11 -44.07 52.02 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 125.369 1.468 . . . . 2.7799999999999998 109.346 177.52 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 13.7 mt-30 -85.09 -30.19 24.26 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-O 118.285 -0.864 . . . . 2.8199999999999998 112.623 -178.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -74.33 -25.56 59.62 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 119.956 1.253 . . . . 2.4300000000000002 111.207 -179.66 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 91.6 m -128.16 46.51 2.56 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.037 1.335 . . . . 1.4199999999999999 110.009 177.419 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.67 -40.43 63.7 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 119.048 0.84 . . . . 6.5599999999999996 109.309 171.769 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -62.18 133.96 94.42 Favored Pre-proline 0 N--CA 1.445 -0.702 0 C-N-CA 124.756 1.222 . . . . 3.0600000000000001 108.151 -171.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 55.1 Cg_endo -60.17 142.83 99.16 Favored 'Trans proline' 0 N--CA 1.448 -1.189 0 C-N-CA 121.957 1.771 . . . . 1.3300000000000001 109.751 -174.128 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 69.45 21.73 6.74 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.905 0.882 . . . . 3.3199999999999998 111.615 170.049 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.1 m -113.81 11.02 17.89 Favored 'General case' 0 C--N 1.347 0.458 0 C-N-CA 125.142 1.377 . . . . 0.94999999999999996 112.148 -179.531 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -84.98 114.16 21.95 Favored 'General case' 0 C--O 1.232 0.143 0 N-CA-C 107.863 -1.162 . . . . 2.2799999999999998 107.863 179.76 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -110.78 149.05 39.79 Favored Pre-proline 0 CA--C 1.534 0.331 0 C-N-CA 124.264 1.026 . . . . 2.7599999999999998 109.473 174.319 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_endo -65.7 -73.34 0.02 OUTLIER 'Trans proline' 0 N--CA 1.452 -0.917 0 C-N-CA 123.353 2.702 . . . . 0.68999999999999995 111.614 -173.578 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -49.73 -43.79 48.0 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 124.964 1.306 . . . . 2.54 110.772 -179.858 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.53 -64.57 0.77 Allowed 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 125.834 1.654 . . . . 2.7999999999999998 110.454 175.81 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 65.8 t80 -58.14 -43.51 87.35 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-O 122.85 1.31 . . . . 2.0099999999999998 110.981 -179.795 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.518 ' CE1' ' HA ' ' A' ' 107' ' ' VAL . 3.8 t80 -52.16 -51.57 57.18 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.117 0.967 . . . . 4.6500000000000004 112.1 178.485 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 30.1 mt-30 -72.56 -36.81 68.31 Favored 'General case' 0 N--CA 1.45 -0.43 0 O-C-N 121.431 -0.793 . . . . 3.8100000000000001 110.724 176.901 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -64.14 -41.18 97.3 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-N 119.139 0.881 . . . . 1.3700000000000001 110.983 -176.559 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 11.5 p -62.3 -50.3 72.19 Favored 'General case' 0 N--CA 1.441 -0.895 0 N-CA-C 106.777 -1.564 . . . . 2.8999999999999999 106.777 173.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 102.39 20.58 11.9 Favored Glycine 0 CA--C 1.521 0.464 0 N-CA-C 109.619 -1.392 . . . . 1.72 109.619 -176.829 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 32.5 mt -60.08 -24.81 64.91 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 121.866 -0.785 . . . . 1.46 109.772 168.809 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 22.8 t -62.05 -24.78 67.29 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 123.459 0.704 . . . . 2.4100000000000001 110.52 173.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -92.83 -24.74 18.4 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 123.006 0.522 . . . . 4.29 109.831 178.457 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 21.1 mmt -66.85 144.88 56.02 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 121.674 0.749 . . . . 3.8300000000000001 111.141 176.387 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 8.5 t -75.01 156.26 36.44 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.983 -0.553 . . . . 2.02 109.512 179.336 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -45.53 -43.35 11.76 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 124.335 1.054 . . . . 0.59999999999999998 111.435 176.447 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -49.96 -62.85 1.33 Allowed 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.66 0.784 . . . . 2.8700000000000001 110.587 175.339 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 1.7 mm-40 -56.25 -46.45 79.63 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 122.983 0.513 . . . . 3.1899999999999999 109.924 -179.315 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 78.4 t -58.4 -38.67 71.07 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.646 0 O-C-N 122.07 -0.394 . . . . 0.54000000000000004 110.419 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 14.7 tptt -68.68 -44.26 74.39 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 121.182 -0.948 . . . . 4.21 111.091 176.898 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 73.6 m-20 -59.09 -53.43 58.47 Favored 'General case' 0 C--O 1.232 0.163 0 N-CA-C 109.767 -0.457 . . . . 2.8999999999999999 109.767 178.85 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.689 HG12 HG22 ' A' ' 3' ' ' ILE . 7.8 m -58.2 -43.75 86.36 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 N-CA-C 109.505 -0.554 . . . . 0.65000000000000002 109.505 176.907 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.439 ' CE1' ' HB2' ' A' ' 100' ' ' ALA . 7.7 t80 -49.19 -48.69 45.01 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 118.482 0.583 . . . . 4.1600000000000001 111.019 175.274 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 73.2 mtp180 -58.73 -37.68 76.71 Favored 'General case' 0 CA--C 1.532 0.266 0 O-C-N 121.684 -0.635 . . . . 4.0199999999999996 112.432 177.583 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 9.8 m-85 -62.7 -33.71 75.66 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 118.497 0.589 . . . . 3.5699999999999998 110.18 174.122 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.3 mm -73.59 -47.14 45.97 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 CA-C-O 118.707 -0.663 . . . . 1.54 110.407 -179.303 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 20.1 t0 -73.32 65.29 0.85 Allowed 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 118.898 0.772 . . . . 1.8999999999999999 108.969 176.445 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 10.8 t30 -58.29 -36.17 72.91 Favored 'General case' 0 C--N 1.332 -0.179 0 C-N-CA 125.104 1.361 . . . . 2.29 111.863 -170.598 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -73.38 -20.06 60.85 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.438 1.095 . . . . 2.5499999999999998 111.955 175.782 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 14.0 mt-30 53.87 72.09 0.47 Allowed 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.831 1.652 . . . . 3.1099999999999999 110.954 -175.016 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 89.4 p -105.72 -28.97 10.37 Favored 'General case' 0 C--N 1.34 0.171 0 C-N-CA 123.824 0.849 . . . . 1.4099999999999999 111.909 174.609 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 87.74 7.41 74.97 Favored Glycine 0 CA--C 1.532 1.096 0 CA-C-O 119.398 -0.668 . . . . 1.53 112.063 -167.513 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 16.2 m-85 -134.11 133.57 41.23 Favored 'General case' 0 C--O 1.233 0.218 0 N-CA-C 108.214 -1.032 . . . . 2.5 108.214 164.526 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -93.33 80.58 4.42 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 126.689 1.995 . . . . 1.9399999999999999 105.809 163.716 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -63.65 153.73 35.13 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 114.393 -1.276 . . . . 1.9299999999999999 109.431 169.568 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -50.41 -46.1 56.08 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 124.345 1.058 . . . . 3.79 112.252 -173.15 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.5 tm-20 -59.56 -46.1 89.88 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 123.293 0.637 . . . . 3.6099999999999999 110.355 -177.059 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 90.3 mt-10 -59.17 -43.79 92.13 Favored 'General case' 0 N--CA 1.451 -0.425 0 O-C-N 121.763 -0.585 . . . . 2.1499999999999999 110.129 175.886 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -58.25 -37.63 75.31 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 122.289 -0.257 . . . . 2.2000000000000002 110.607 175.559 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 21.0 ttmt -58.77 -12.32 4.18 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.966 0.906 . . . . 3.0 112.968 172.287 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 9.0 t80 -123.08 28.21 7.27 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.573 1.149 . . . . 5.0599999999999996 110.47 173.176 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -66.06 -74.63 0.1 Allowed 'General case' 0 CA--C 1.53 0.181 0 O-C-N 121.247 -0.908 . . . . 2.6499999999999999 110.604 -179.764 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.484 HD22 ' HB2' ' A' ' 75' ' ' ALA . 0.4 OUTLIER -68.01 -17.2 64.35 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 121.619 -0.675 . . . . 2.9199999999999999 110.999 -164.592 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 78.0 mm-40 -51.03 -21.63 1.91 Allowed 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.911 1.684 . . . . 1.8799999999999999 112.354 166.125 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 1.9 mmpt? -80.07 -25.35 40.09 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 121.07 -1.019 . . . . 3.1499999999999999 111.385 176.077 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 16.6 m-30 -94.07 -62.7 1.3 Allowed 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 125.435 1.494 . . . . 3.1000000000000001 109.551 -179.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -105.65 -178.91 3.79 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 125.983 1.713 . . . . 2.9900000000000002 107.864 -179.276 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 20.0 m -124.04 47.45 2.06 Favored 'General case' 0 N--CA 1.461 0.101 0 C-N-CA 123.123 0.569 . . . . 2.5 111.088 177.535 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 154.18 59.39 0.01 OUTLIER Glycine 0 CA--C 1.519 0.343 0 N-CA-C 110.019 -1.232 . . . . 1.1599999999999999 110.019 179.147 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.573 ' HB3' ' OE2' ' A' ' 77' ' ' GLU . . . -91.1 -142.41 0.18 Allowed 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 108.558 -0.904 . . . . 1.6399999999999999 108.558 175.104 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -123.26 41.69 3.4 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 123.91 0.884 . . . . 5.0199999999999996 110.659 -175.831 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.573 ' OE2' ' HB3' ' A' ' 75' ' ' ALA . 4.2 mp0 -77.06 -36.84 55.64 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 125.296 1.439 . . . . 4.7800000000000002 109.028 177.557 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.487 HD22 ' H ' ' A' ' 78' ' ' LEU . 0.2 OUTLIER -52.99 -44.85 67.53 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 114.75 -1.114 . . . . 0.98999999999999999 110.54 178.026 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 23.8 m -67.87 113.47 5.63 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 121.7 0.762 . . . . 1.02 110.43 179.55 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -58.75 -41.95 87.71 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-N 114.737 -1.12 . . . . 2.8399999999999999 111.002 177.591 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 15.8 m -47.66 -60.21 2.72 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 119.066 0.848 . . . . 1.3799999999999999 111.318 173.634 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.74 -40.39 79.86 Favored 'General case' 0 N--CA 1.454 -0.229 0 O-C-N 121.896 -0.503 . . . . 3.4100000000000001 109.932 -171.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 1.1 m -53.28 -47.74 68.92 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-O 122.06 0.933 . . . . 0.66000000000000003 108.89 171.303 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 33.5 tttp -70.14 -27.77 64.82 Favored 'General case' 0 N--CA 1.44 -0.973 0 C-N-CA 124.236 1.014 . . . . 4.9000000000000004 111.473 -174.761 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 52.5 m -55.94 -47.91 76.7 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 120.195 1.362 . . . . 1.3100000000000001 109.998 168.189 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 9.0 mt -60.76 -58.21 9.43 Favored 'General case' 0 C--O 1.233 0.226 0 N-CA-C 109.47 -0.567 . . . . 2.2599999999999998 109.47 172.612 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 2.6 ttp -46.96 -43.6 19.33 Favored 'General case' 0 CA--C 1.535 0.366 0 O-C-N 123.528 0.517 . . . . 3.48 112.39 -178.092 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -56.45 -45.92 80.58 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 125.886 1.675 . . . . 0.62 111.668 -173.34 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -84.91 -44.6 13.02 Favored 'General case' 0 CA--C 1.521 -0.137 0 N-CA-C 110.575 -0.157 . . . . 0.68000000000000005 110.575 178.51 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -55.99 -45.4 79.02 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 122.706 0.403 . . . . 0.35999999999999999 110.483 -176.644 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -73.75 77.8 1.56 Allowed 'General case' 0 N--CA 1.448 -0.566 0 CA-C-O 121.274 0.559 . . . . 0.93000000000000005 109.571 177.325 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -76.19 45.48 0.37 Allowed 'General case' 0 CA--C 1.538 0.496 0 O-C-N 121.477 -0.764 . . . . 2.7000000000000002 111.827 178.286 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 62.5 m-20 -135.37 -58.93 0.78 Allowed 'General case' 0 C--N 1.338 0.07 0 C-N-CA 125.463 1.505 . . . . 1.5700000000000001 109.278 -177.517 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 103.26 45.67 1.54 Allowed Glycine 0 CA--C 1.532 1.106 0 N-CA-C 110.025 -1.23 . . . . 0.87 110.025 -163.329 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -124.6 -61.89 1.29 Allowed 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 125.078 1.351 . . . . 1.97 109.687 171.085 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 127.43 -24.28 5.3 Favored Glycine 0 CA--C 1.529 0.948 0 C-N-CA 124.678 1.133 . . . . 0.69999999999999996 111.563 177.733 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 40.0 mtpt -80.71 114.08 19.34 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 106.823 -1.547 . . . . 4.21 106.823 175.544 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 5.5 mt -95.16 153.6 3.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 N-CA-C 107.232 -1.395 . . . . 0.87 107.232 -178.09 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -132.03 -179.35 16.14 Favored Glycine 0 CA--C 1.522 0.47 0 N-CA-C 108.903 -1.679 . . . . 0.75 108.903 175.853 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . 0.439 ' HB2' ' CE1' ' A' ' 48' ' ' PHE . . . -66.06 -36.79 84.18 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 117.601 0.701 . . . . 0.69999999999999996 110.404 -177.242 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 -60.02 -59.13 5.9 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-O 118.797 -0.62 . . . . 2.5099999999999998 110.13 173.594 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -52.24 -47.98 65.44 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-O 121.767 0.794 . . . . 1.4299999999999999 110.648 -179.664 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 58.7 t80 -62.46 -54.22 43.34 Favored 'General case' 0 N--CA 1.454 -0.27 0 O-C-N 121.821 -0.55 . . . . 3.6000000000000001 110.363 -178.205 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 46.7 tt0 -55.44 -46.44 76.73 Favored 'General case' 0 C--O 1.22 -0.497 0 CA-C-O 118.294 -0.86 . . . . 2.1699999999999999 110.613 177.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -51.96 -58.88 5.19 Favored 'General case' 0 CA--C 1.522 -0.126 0 CA-C-N 119.462 1.028 . . . . 3.0899999999999999 110.075 176.67 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -55.8 -47.21 77.52 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 109.44 -0.578 . . . . 4.7300000000000004 109.44 -179.475 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . 0.518 ' HA ' ' CE1' ' A' ' 31' ' ' PHE . 76.1 t -75.35 -6.06 8.08 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.795 0 C-N-CA 124.293 1.037 . . . . 1.3999999999999999 112.552 -177.284 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 6.6 t60 -90.15 -11.58 40.75 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 120.086 -1.634 . . . . 2.7200000000000002 110.221 173.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 28.5 t . . . . . 0 C--O 1.252 1.219 0 CA-C-O 114.935 -2.459 . . . . 2.3100000000000001 114.016 -174.109 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.9 ttt . . . . . 0 N--CA 1.474 0.753 0 N-CA-C 108.3 -1.0 . . . . 6.9199999999999999 108.3 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 11.6 t 157.74 -72.24 0.0 OUTLIER 'General case' 0 C--O 1.224 -0.284 0 C-N-CA 126.533 1.933 . . . . 3.9300000000000002 106.154 -171.572 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.484 HG22 HG12 ' A' ' 47' ' ' VAL . 1.7 pp -96.66 -23.1 4.86 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.289 0 CA-C-O 121.65 0.738 . . . . 1.21 111.942 -167.73 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 12.9 t -65.91 -15.38 62.9 Favored 'General case' 0 N--CA 1.422 -1.844 0 C-N-CA 126.879 2.071 . . . . 1.96 111.616 -174.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 36.6 t0 -134.0 44.72 2.7 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.914 0.886 . . . . 2.8599999999999999 109.537 -179.326 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 20.1 t -121.02 -61.82 2.09 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.229 0 C-N-CA 124.912 1.285 . . . . 1.5800000000000001 109.4 177.636 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 9.1 tp -171.95 -61.55 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 104.991 -2.226 . . . . 1.6699999999999999 104.991 -174.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -33.03 -37.83 0.03 OUTLIER 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 128.921 2.888 . . . . 1.2 115.8 -173.213 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -51.27 -41.12 60.18 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 118.94 0.791 . . . . 0.80000000000000004 112.893 179.54 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.3 t0 -68.2 -45.5 73.17 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 122.86 1.314 . . . . 1.8999999999999999 108.56 177.027 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -62.62 -47.63 82.9 Favored 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 125.143 1.377 . . . . 2.5099999999999998 109.34 -170.171 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 26.6 pt -60.57 -38.28 77.8 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.877 0 C-N-CA 123.188 0.595 . . . . 0.96999999999999997 111.394 176.402 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.84 -44.72 93.94 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 118.34 0.518 . . . . 1.0700000000000001 110.045 177.484 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.85 -54.76 43.52 Favored 'General case' 0 C--O 1.234 0.247 0 O-C-N 122.174 -0.328 . . . . 0.89000000000000001 110.471 172.055 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -48.55 -46.49 39.01 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 124.549 1.14 . . . . 0.71999999999999997 111.272 -177.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -54.32 -43.44 71.17 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 124.6 1.16 . . . . 3.75 109.65 -179.475 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -77.99 -49.27 14.39 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 109.699 -0.482 . . . . 2.9700000000000002 109.699 -176.096 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -59.69 -33.2 71.29 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 122.025 0.13 . . . . 3.2000000000000002 110.904 -175.205 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 75.0 m -107.98 36.91 2.6 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 124.796 1.238 . . . . 1.3400000000000001 110.493 177.359 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 53.7 ttt-85 -78.93 -30.86 44.91 Favored 'General case' 0 C--O 1.234 0.242 0 O-C-N 121.364 -0.835 . . . . 5.3600000000000003 109.964 179.155 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 61.3 m-20 -74.27 144.87 82.18 Favored Pre-proline 0 CA--C 1.539 0.551 0 C-N-CA 123.789 0.836 . . . . 2.0499999999999998 109.613 177.212 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -64.31 140.79 72.18 Favored 'Trans proline' 0 N--CA 1.456 -0.68 0 C-N-CA 123.505 2.803 . . . . 1.3300000000000001 111.02 -176.087 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 62.73 10.83 4.45 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.084 1.353 . . . . 2.4100000000000001 113.184 177.356 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 29.3 m -92.7 16.21 12.76 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.299 1.44 . . . . 1.1200000000000001 110.957 -177.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 7.4 t80 -99.86 112.47 24.74 Favored 'General case' 0 N--CA 1.444 -0.764 0 N-CA-C 106.767 -1.568 . . . . 2.6800000000000002 106.767 179.693 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -104.42 147.64 34.7 Favored Pre-proline 0 C--O 1.235 0.303 0 N-CA-C 108.257 -1.016 . . . . 4.8600000000000003 108.257 167.598 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -62.05 -62.67 0.11 Allowed 'Trans proline' 0 N--CA 1.451 -1.015 0 C-N-CA 122.88 2.387 . . . . 0.56999999999999995 111.176 -176.013 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 48.9 mt-30 -59.0 -40.63 85.5 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 123.177 0.591 . . . . 2.2000000000000002 110.937 -173.684 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -50.45 -69.41 0.11 Allowed 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.54 1.136 . . . . 4.96 108.966 169.817 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 80.8 t80 -53.65 -43.39 68.77 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 123.583 0.753 . . . . 2.46 112.183 -175.216 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -50.59 -59.07 4.42 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 127.325 2.25 . . . . 4.7800000000000002 109.983 177.093 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.73 -48.0 76.2 Favored 'General case' 0 N--CA 1.445 -0.693 0 N-CA-C 107.972 -1.121 . . . . 3.79 107.972 -177.072 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -63.35 -35.74 81.4 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 123.514 0.726 . . . . 0.68999999999999995 112.914 -171.682 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 43.5 m -76.49 2.65 13.16 Favored 'General case' 0 N--CA 1.449 -0.518 0 O-C-N 123.705 0.628 . . . . 2.0600000000000001 110.803 176.87 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 79.62 9.42 86.86 Favored Glycine 0 C--N 1.339 0.73 0 N-CA-C 110.951 -0.859 . . . . 0.69999999999999996 110.951 169.258 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 50.0 mt -73.91 -24.06 59.63 Favored 'General case' 0 N--CA 1.441 -0.879 0 O-C-N 121.378 -1.072 . . . . 1.4199999999999999 109.818 -172.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 26.3 p -66.29 -25.69 66.97 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.34 0.656 . . . . 2.5699999999999998 111.063 168.853 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 13.1 tptt -86.27 -34.09 20.48 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 108.175 -1.046 . . . . 3.8100000000000001 108.175 -177.726 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.4 ' O ' ' CB ' ' A' ' 40' ' ' SER . 36.2 mtt -47.67 -66.88 0.33 Allowed 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 114.702 1.371 . . . . 3.7000000000000002 114.702 -177.064 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.4 ' CB ' ' O ' ' A' ' 39' ' ' MET . 42.1 t 113.99 139.93 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 128.714 2.806 . . . . 1.9399999999999999 108.021 -172.788 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -37.22 -40.34 0.32 Allowed 'General case' 0 C--N 1.341 0.217 0 C-N-CA 125.206 1.402 . . . . 0.73999999999999999 112.688 173.695 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 60.8 m-80 -56.9 -61.37 2.49 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-O 122.028 0.918 . . . . 2.1099999999999999 109.703 -179.031 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.453 ' O ' HG13 ' A' ' 47' ' ' VAL . 28.8 tt0 -70.43 -35.57 73.46 Favored 'General case' 0 N--CA 1.439 -1.002 0 CA-C-N 115.165 -0.925 . . . . 3.2400000000000002 109.558 -176.244 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 51.8 t -59.26 -49.31 83.91 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.67 0 CA-C-N 119.063 0.847 . . . . 0.56000000000000005 108.994 178.653 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -55.08 -46.78 75.49 Favored 'General case' 0 N--CA 1.455 -0.221 0 O-C-N 121.361 -0.837 . . . . 2.8199999999999998 110.608 173.31 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 33.7 t0 -56.2 -55.36 34.08 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 118.076 0.398 . . . . 2.4700000000000002 110.778 178.597 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.484 HG12 HG22 ' A' ' 3' ' ' ILE . 3.1 m -52.79 -44.4 47.75 Favored 'Isoleucine or valine' 0 C--N 1.342 0.27 0 CA-C-O 118.983 -0.532 . . . . 0.79000000000000004 110.304 179.468 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 16.0 m-30 -49.98 -39.71 41.82 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 118.535 0.607 . . . . 5.6500000000000004 112.067 177.109 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 69.0 mtp180 -58.89 -30.17 67.58 Favored 'General case' 0 CA--C 1.532 0.259 0 O-C-N 121.195 -0.941 . . . . 3.2200000000000002 111.989 179.145 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 18.1 t80 -70.02 -25.14 63.44 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.503 0.721 . . . . 4.0099999999999998 110.919 178.054 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.438 HG21 ' CD1' ' A' ' 67' ' ' PHE . 4.1 mp -125.69 99.61 6.08 Favored 'Isoleucine or valine' 0 C--N 1.342 0.266 0 C-N-CA 124.066 0.946 . . . . 2.6600000000000001 111.206 -177.02 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 57.0 t0 -155.99 -49.04 0.08 Allowed 'General case' 0 C--O 1.223 -0.338 0 C-N-CA 125.979 1.712 . . . . 3.8999999999999999 106.388 166.56 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 17.6 t-20 97.62 -52.88 0.01 OUTLIER 'General case' 0 C--N 1.34 0.195 0 C-N-CA 128.31 2.644 . . . . 4.8700000000000001 107.825 -178.128 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 40.6 m-20 -56.88 -46.22 82.03 Favored 'General case' 0 CA--C 1.528 0.107 0 CA-C-O 121.455 0.645 . . . . 2.9900000000000002 110.24 169.201 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 59.26 63.32 1.61 Allowed 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 114.468 -1.242 . . . . 3.9900000000000002 109.491 -152.569 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 98.0 p -103.22 -43.69 5.39 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 127.185 2.194 . . . . 2.4700000000000002 110.424 178.821 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 108.97 -11.73 34.5 Favored Glycine 0 CA--C 1.534 1.23 0 C-N-CA 124.591 1.091 . . . . 1.8100000000000001 111.626 -166.447 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 76.6 m-85 -100.51 115.44 30.11 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 124.698 1.199 . . . . 3.3399999999999999 109.187 175.412 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -87.43 81.51 7.8 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 125.889 1.676 . . . . 1.8700000000000001 106.855 167.101 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -63.59 144.14 57.25 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 114.306 -1.316 . . . . 1.3799999999999999 109.19 174.674 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -40.26 -51.35 2.73 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 125.247 1.419 . . . . 3.48 113.95 -171.056 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -71.57 -22.27 61.76 Favored 'General case' 0 N--CA 1.452 -0.325 0 O-C-N 121.274 -0.891 . . . . 3.54 112.14 -173.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 89.0 mt-10 -67.9 -38.42 82.96 Favored 'General case' 0 N--CA 1.456 -0.171 0 O-C-N 120.725 -1.235 . . . . 2.0899999999999999 108.694 169.29 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -51.02 -47.35 61.67 Favored 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 109.231 -0.655 . . . . 2.6200000000000001 109.231 171.714 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 29.3 ttpt -54.99 -13.57 1.17 Allowed 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 114.466 1.284 . . . . 2.3199999999999998 114.466 176.234 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 78.8 m-85 -124.03 10.21 8.79 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 119.876 1.217 . . . . 5.3499999999999996 112.289 173.61 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.438 ' CD1' HG21 ' A' ' 51' ' ' ILE . 85.5 t80 -49.76 -64.51 0.79 Allowed 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.89 1.276 . . . . 2.77 111.548 -169.321 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 70.2 mt -65.2 -12.86 55.7 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 113.443 0.905 . . . . 2.4199999999999999 113.443 -176.79 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 11.1 mm-40 -61.31 -30.66 70.64 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 120.458 1.481 . . . . 1.6699999999999999 110.505 -179.796 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.9 mptm? -59.74 -30.03 68.56 Favored 'General case' 0 CA--C 1.531 0.247 0 O-C-N 122.157 -0.339 . . . . 2.8399999999999999 111.897 172.344 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 9.4 m-30 -86.75 -53.75 4.76 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 123.305 0.642 . . . . 3.1000000000000001 109.659 -179.438 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -143.22 123.29 13.63 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.275 1.03 . . . . 3.7000000000000002 108.493 -174.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 79.8 p -44.7 -37.12 3.5 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 126.423 1.889 . . . . 2.3999999999999999 112.26 174.585 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -106.4 28.44 13.54 Favored Glycine 0 CA--C 1.525 0.669 0 C-N-CA 125.883 1.706 . . . . 1.48 111.946 -172.649 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -71.42 -165.85 0.16 Allowed 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 117.956 0.878 . . . . 1.4199999999999999 111.681 174.546 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 6.0 tpt180 -113.48 -9.75 13.27 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 115.626 1.713 . . . . 3.1099999999999999 115.626 -158.412 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 55.1 mm-40 -59.35 -6.9 1.11 Allowed 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 114.06 1.133 . . . . 4.5700000000000003 114.06 -175.827 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.576 HD22 ' H ' ' A' ' 78' ' ' LEU . 0.9 OUTLIER -57.31 -39.97 76.92 Favored 'General case' 0 N--CA 1.446 -0.673 0 O-C-N 121.105 -0.997 . . . . 1.3400000000000001 110.562 171.922 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 4.1 m -76.84 129.95 36.95 Favored 'General case' 0 C--N 1.345 0.385 0 C-N-CA 118.987 -1.085 . . . . 0.95999999999999996 109.875 177.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -65.45 -43.81 89.22 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-N 115.285 -0.87 . . . . 3.25 110.677 177.497 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 73.7 m -50.11 -62.86 1.33 Allowed 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 119.41 1.005 . . . . 1.1799999999999999 111.761 171.755 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -54.09 -42.51 69.45 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 118.207 0.458 . . . . 2.9399999999999999 111.074 -177.532 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 5.8 m -57.7 -53.62 56.08 Favored 'General case' 0 C--N 1.34 0.179 0 CA-C-O 121.913 0.863 . . . . 0.89000000000000001 109.785 173.824 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 8.5 tptt -58.67 -38.58 78.48 Favored 'General case' 0 N--CA 1.445 -0.722 0 C-N-CA 125.91 1.684 . . . . 3.9700000000000002 110.591 -170.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 67.4 m -52.1 -46.99 65.49 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 118.988 0.813 . . . . 1.25 111.696 170.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -65.66 -56.38 12.44 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 108.298 -1.001 . . . . 2.2200000000000002 108.298 177.542 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 3.5 ttp -45.3 -45.27 12.08 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.456 0.702 . . . . 3.4300000000000002 111.991 178.628 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -58.84 -43.57 90.78 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 126.086 1.755 . . . . 0.67000000000000004 112.21 -171.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -90.27 -31.66 16.88 Favored 'General case' 0 N--CA 1.461 0.098 0 C-N-CA 122.552 0.341 . . . . 0.64000000000000001 111.45 -179.694 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -62.05 -48.56 79.69 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 123.025 0.53 . . . . 0.34000000000000002 110.675 175.525 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -71.24 114.41 9.28 Favored 'General case' 0 N--CA 1.446 -0.626 0 N-CA-C 108.856 -0.794 . . . . 1.01 108.856 178.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 8.0 m-80 -110.22 37.14 2.8 Favored 'General case' 0 N--CA 1.463 0.202 0 N-CA-C 109.661 -0.496 . . . . 3.1000000000000001 109.661 -179.135 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 32.9 m-20 -119.06 -47.53 2.48 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 125.093 1.357 . . . . 1.4299999999999999 110.195 173.333 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 89.75 41.56 5.63 Favored Glycine 0 CA--C 1.53 0.989 0 N-CA-C 108.672 -1.771 . . . . 0.87 108.672 -155.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -121.94 -55.03 1.91 Allowed 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.363 1.065 . . . . 2.6899999999999999 110.134 -179.861 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 121.44 -38.15 2.74 Favored Glycine 0 CA--C 1.527 0.828 0 C-N-CA 124.19 0.9 . . . . 0.69999999999999996 111.253 176.78 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 77.9 mttt -69.58 121.87 17.95 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 107.384 -1.339 . . . . 4.1600000000000001 107.384 176.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 9.0 mt -105.71 127.65 60.49 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.323 0 N-CA-C 108.603 -0.888 . . . . 0.70999999999999996 108.603 -173.728 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -85.11 158.88 33.46 Favored Glycine 0 CA--C 1.528 0.905 0 N-CA-C 110.387 -1.085 . . . . 0.55000000000000004 110.387 169.688 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -51.27 -34.82 34.52 Favored 'General case' 0 C--N 1.34 0.176 0 O-C-N 122.044 -0.68 . . . . 0.80000000000000004 109.896 167.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 25.8 tt0 -61.67 -62.27 1.92 Allowed 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 123.57 0.748 . . . . 2.48 110.67 179.021 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -44.57 -48.61 10.31 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.164 0.985 . . . . 2.1899999999999999 110.167 172.613 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -65.72 -42.05 91.53 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 115.956 -0.566 . . . . 2.7599999999999998 111.522 -175.682 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 12.4 tt0 -61.19 -43.8 98.3 Favored 'General case' 0 C--O 1.222 -0.38 0 CA-C-O 118.166 -0.921 . . . . 2.7200000000000002 108.962 173.697 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -54.15 -53.16 57.2 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 120.032 1.287 . . . . 3.1200000000000001 110.916 176.57 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.97 -54.42 47.15 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 108.449 -0.945 . . . . 2.7000000000000002 108.449 -179.026 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 92.5 t -74.9 -15.74 16.04 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 CA-C-N 115.308 -0.86 . . . . 1.5600000000000001 112.866 -169.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 3.0 t60 -98.15 3.86 49.05 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 120.423 -1.423 . . . . 2.6200000000000001 111.186 175.521 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 31.3 t . . . . . 0 C--O 1.254 1.297 0 CA-C-O 115.995 -1.955 . . . . 2.3999999999999999 111.37 179.491 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.47 0.568 0 N-CA-C 106.602 -1.629 . . . . 7.2999999999999998 106.602 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 51.1 m -144.61 176.13 9.64 Favored 'General case' 0 N--CA 1.443 -0.808 0 O-C-N 125.265 1.603 . . . . 3.4500000000000002 106.952 179.49 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.61 HG22 HG12 ' A' ' 47' ' ' VAL . 1.2 pp -52.08 -39.16 25.68 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 CA-C-N 115.795 -0.638 . . . . 1.78 110.275 178.449 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 2.8 t -82.44 52.37 2.04 Favored 'General case' 0 N--CA 1.438 -1.063 0 C-N-CA 125.979 1.712 . . . . 3.0899999999999999 108.919 179.885 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -174.64 -50.89 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.126 0 C-N-CA 125.026 1.33 . . . . 3.1099999999999999 108.394 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 24.2 t -51.08 -46.71 31.52 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 C-N-CA 124.144 0.978 . . . . 1.8600000000000001 111.683 -177.734 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 11.7 tp -164.34 -58.47 0.03 OUTLIER 'General case' 0 CA--C 1.517 -0.305 0 N-CA-C 106.901 -1.518 . . . . 1.6200000000000001 106.901 -177.229 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 2.3 m -49.26 -26.08 2.76 Favored 'General case' 0 C--O 1.215 -0.747 0 CA-C-O 117.785 -1.103 . . . . 0.98999999999999999 112.948 -171.382 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -36.86 -48.46 0.75 Allowed 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 114.402 1.26 . . . . 1.0600000000000001 114.402 168.741 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -70.17 -44.39 68.89 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-O 122.69 1.233 . . . . 2.0899999999999999 109.375 -179.825 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -64.0 -41.57 97.44 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 124.612 1.165 . . . . 2.6000000000000001 110.434 -173.365 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 45.8 pt -60.6 -39.74 82.38 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.811 0 O-C-N 121.289 -0.882 . . . . 1.4399999999999999 110.299 175.153 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.16 -41.16 99.21 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 118.347 0.521 . . . . 1.0 109.788 178.86 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.48 -59.7 4.98 Favored 'General case' 0 CA--C 1.536 0.415 0 O-C-N 122.229 -0.294 . . . . 0.77000000000000002 110.416 171.701 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -48.78 -47.52 41.9 Favored 'General case' 0 C--O 1.234 0.248 0 C-N-CA 125.842 1.657 . . . . 0.66000000000000003 111.589 -176.525 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 18.9 tp -48.52 -43.86 35.63 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 126.199 1.799 . . . . 3.0699999999999998 110.227 178.164 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -90.73 -42.98 10.4 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 110.052 -0.351 . . . . 2.9199999999999999 110.052 -173.106 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -65.86 -34.46 78.2 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 122.379 0.271 . . . . 2.3100000000000001 111.374 -173.657 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 58.2 m -123.18 62.93 1.01 Allowed 'General case' 0 C--O 1.234 0.263 0 C-N-CA 124.038 0.935 . . . . 1.8100000000000001 108.495 171.777 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 36.4 ttt180 -82.5 -18.75 40.49 Favored 'General case' 0 CA--C 1.535 0.392 0 O-C-N 121.715 -0.616 . . . . 5.9100000000000001 111.729 176.817 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -97.21 147.34 32.81 Favored Pre-proline 0 C--O 1.235 0.341 0 C-N-CA 124.986 1.315 . . . . 2.23 111.314 -166.429 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_endo -60.0 127.94 24.93 Favored 'Trans proline' 0 N--CA 1.452 -0.934 0 C-N-CA 123.049 2.499 . . . . 1.25 111.233 -173.658 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 41.7 m-20 76.29 18.44 1.87 Allowed 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 126.925 2.09 . . . . 2.9199999999999999 111.944 169.36 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 7.2 m -90.15 -17.09 28.25 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.494 0.718 . . . . 0.69999999999999996 111.989 -178.615 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -86.01 97.15 10.11 Favored 'General case' 0 CA--C 1.534 0.362 0 O-C-N 121.731 -0.606 . . . . 3.75 111.313 -157.857 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -80.44 155.47 74.02 Favored Pre-proline 0 CA--C 1.534 0.331 0 C-N-CA 123.918 0.887 . . . . 2.71 110.548 -178.938 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -70.81 -63.27 0.04 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.209 0 C-N-CA 122.534 2.156 . . . . 0.63 111.243 -177.636 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 38.2 mt-30 -61.12 -31.93 71.63 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 122.765 0.426 . . . . 2.46 110.867 -178.245 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.79 -64.43 0.96 Allowed 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 109.337 -0.616 . . . . 3.4100000000000001 109.337 171.014 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 4.8 t80 -54.82 -48.38 72.88 Favored 'General case' 0 C--O 1.22 -0.469 0 C-N-CA 123.281 0.632 . . . . 2.21 110.676 -174.355 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -34.99 -64.09 0.29 Allowed 'General case' 0 C--O 1.234 0.267 0 C-N-CA 127.741 2.417 . . . . 5.1100000000000003 111.837 171.86 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 -66.75 -48.61 68.58 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 108.747 -0.834 . . . . 3.3199999999999998 108.747 -177.408 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -60.63 -25.57 66.39 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 123.582 0.753 . . . . 0.67000000000000004 112.238 -174.627 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 30.7 t -89.82 -3.53 58.08 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 126.616 1.967 . . . . 1.4299999999999999 111.086 -179.472 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 80.61 5.85 89.68 Favored Glycine 0 C--N 1.335 0.52 0 N-CA-C 111.326 -0.709 . . . . 0.68000000000000005 111.326 172.359 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 80.7 mt -68.55 -26.57 65.48 Favored 'General case' 0 N--CA 1.445 -0.695 0 O-C-N 121.831 -0.805 . . . . 1.49 109.902 -177.153 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 24.2 t -64.02 -30.61 71.67 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.604 1.162 . . . . 2.1499999999999999 111.387 169.117 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -86.6 -38.09 17.46 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 109.296 -0.631 . . . . 4.0 109.296 -176.353 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 28.6 mtt -56.18 128.13 34.1 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-O 120.968 0.413 . . . . 3.1499999999999999 111.039 174.66 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 7.7 m -63.73 158.67 21.03 Favored 'General case' 0 N--CA 1.452 -0.335 0 O-C-N 121.74 -0.6 . . . . 2.1000000000000001 110.057 173.428 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -43.01 -41.55 3.46 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 124.231 1.013 . . . . 0.71999999999999997 111.983 177.005 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 7.8 m120 -55.0 -58.46 7.53 Favored 'General case' 0 N--CA 1.457 -0.093 0 C-N-CA 123.787 0.835 . . . . 2.5299999999999998 110.075 177.648 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 13.4 mm-40 -60.49 -48.0 83.68 Favored 'General case' 0 C--O 1.219 -0.527 0 N-CA-C 109.555 -0.535 . . . . 2.8500000000000001 109.555 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 77.1 t -54.55 -48.69 70.16 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 CA-C-N 118.975 0.807 . . . . 0.56000000000000005 110.489 -179.645 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 63.9 tttt -74.9 -24.05 58.47 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 121.087 -1.008 . . . . 3.1499999999999999 111.812 -178.784 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 61.3 t0 -66.66 -65.46 0.68 Allowed 'General case' 0 CA--C 1.529 0.151 0 N-CA-C 108.782 -0.821 . . . . 2.8399999999999999 108.782 168.888 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.61 HG12 HG22 ' A' ' 3' ' ' ILE . 15.2 m -47.35 -50.88 7.2 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 C-N-CA 123.678 0.791 . . . . 0.58999999999999997 110.805 179.406 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 20.9 m-85 -55.29 -43.77 75.07 Favored 'General case' 0 C--O 1.225 -0.225 0 CA-C-N 118.843 0.747 . . . . 6.7199999999999998 111.975 177.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 84.0 mtm180 -68.37 -36.44 79.2 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 119.169 0.895 . . . . 6.0899999999999999 112.261 176.524 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 49.4 t80 -63.96 -41.2 97.64 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 118.448 0.567 . . . . 2.9100000000000001 109.509 -179.819 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.0 mp -78.02 -32.52 17.46 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 CA-C-O 118.607 -0.711 . . . . 2.0699999999999998 111.975 177.003 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 52.4 t0 -66.98 75.57 0.12 Allowed 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 119.354 0.979 . . . . 1.8600000000000001 108.983 170.501 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 25.3 t-20 -54.73 156.46 3.58 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 107.699 -1.223 . . . . 3.3700000000000001 107.699 167.922 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 72.23 -44.77 0.6 Allowed 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 123.916 0.886 . . . . 3.48 113.118 -173.861 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 59.09 52.09 6.53 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 124.207 1.003 . . . . 3.8399999999999999 111.312 -172.645 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 16.6 p -57.78 -6.98 0.6 Allowed 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.3 1.44 . . . . 1.9399999999999999 113.093 166.419 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 73.78 14.07 80.18 Favored Glycine 0 CA--C 1.527 0.808 0 N-CA-C 110.0 -1.24 . . . . 1.5900000000000001 110.0 -167.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 -148.06 141.93 25.78 Favored 'General case' 0 N--CA 1.441 -0.894 0 C-N-CA 124.929 1.292 . . . . 3.3999999999999999 108.207 -179.235 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 4.9 mp -95.25 78.99 3.49 Favored 'General case' 0 N--CA 1.435 -1.212 0 N-CA-C 105.26 -2.126 . . . . 3.1800000000000002 105.26 161.333 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -63.19 170.39 2.92 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-N 113.754 -1.566 . . . . 1.5 109.224 175.733 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -48.7 -57.33 6.45 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 120.059 1.299 . . . . 4.0800000000000001 111.727 -171.255 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -45.32 -35.4 3.48 Favored 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 115.258 1.577 . . . . 3.5099999999999998 115.258 172.082 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -57.86 -44.08 86.37 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 121.213 1.824 . . . . 2.3799999999999999 109.379 174.498 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -77.89 16.81 0.65 Allowed 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 115.219 -0.901 . . . . 2.4399999999999999 111.259 175.439 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 26.7 ttpt -106.22 5.78 30.19 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.825 1.25 . . . . 2.4199999999999999 109.019 161.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 25.3 p90 -152.8 30.28 0.51 Allowed 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 118.606 0.639 . . . . 5.75 112.189 171.631 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 27.4 t80 -57.83 -61.75 2.3 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 119.116 0.871 . . . . 2.4399999999999999 108.916 -179.277 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 1.3 mp -82.58 -13.91 55.75 Favored 'General case' 0 CA--C 1.535 0.374 0 O-C-N 120.951 -1.093 . . . . 2.46 113.238 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 48.9 mm-40 -69.5 14.06 0.11 Allowed 'General case' 0 CA--C 1.544 0.734 0 O-C-N 121.146 -0.971 . . . . 1.5800000000000001 112.114 176.881 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.86 -25.85 12.46 Favored 'General case' 0 CA--C 1.533 0.293 0 O-C-N 120.21 -1.556 . . . . 3.6400000000000001 110.326 165.28 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -81.14 -48.26 12.37 Favored 'General case' 0 N--CA 1.456 -0.159 0 N-CA-C 108.184 -1.043 . . . . 7.5300000000000002 108.184 173.629 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -120.7 177.46 5.07 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 123.688 0.795 . . . . 4.0300000000000002 110.672 -175.073 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 7.0 m -96.32 -28.16 14.62 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.704 1.202 . . . . 2.1499999999999999 111.031 165.581 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -113.08 15.01 23.46 Favored Glycine 0 CA--C 1.527 0.802 0 C-N-CA 123.706 0.669 . . . . 1.26 112.081 -166.504 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -72.09 157.58 37.52 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 117.288 0.544 . . . . 2.0699999999999998 111.059 -176.567 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.87 18.41 0.1 Allowed 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 115.597 1.702 . . . . 3.4300000000000002 115.597 -159.228 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 73.1 mm-40 -58.96 -34.25 71.57 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 122.43 1.109 . . . . 3.96 111.718 -173.229 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.534 HD22 ' H ' ' A' ' 78' ' ' LEU . 0.1 OUTLIER -55.21 -35.4 64.83 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 114.764 -1.107 . . . . 0.76000000000000001 111.912 175.759 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 52.6 m -76.6 106.03 8.01 Favored 'General case' 0 C--N 1.342 0.273 0 CA-C-N 119.117 0.871 . . . . 0.84999999999999998 109.758 -179.045 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -56.17 -41.33 75.32 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 114.942 -1.027 . . . . 3.1699999999999999 110.92 -176.605 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 69.8 m -62.38 -53.33 56.61 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.103 0.561 . . . . 1.49 111.864 -178.266 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -58.7 -46.63 86.84 Favored 'General case' 0 C--O 1.233 0.229 0 O-C-N 121.482 -0.761 . . . . 3.1699999999999999 110.341 176.773 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -50.0 -51.17 43.87 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-O 121.545 0.688 . . . . 0.55000000000000004 109.764 175.176 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 89.2 mttt -66.62 -28.25 68.34 Favored 'General case' 0 C--O 1.22 -0.481 0 C-N-CA 124.969 1.308 . . . . 5.0199999999999996 111.61 -177.517 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 3.4 t -60.79 -47.19 87.46 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 119.561 1.073 . . . . 1.71 109.446 171.14 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -63.67 -51.3 65.72 Favored 'General case' 0 C--O 1.234 0.28 0 O-C-N 121.871 -0.518 . . . . 3.2400000000000002 110.412 174.744 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 31.6 ttm -45.82 -50.97 13.6 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 123.263 0.352 . . . . 3.0899999999999999 111.747 173.659 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -54.6 -46.27 73.76 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 125.831 1.652 . . . . 0.47999999999999998 111.863 -169.177 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -86.54 -41.29 14.45 Favored 'General case' 0 C--O 1.226 -0.157 0 N-CA-C 111.635 0.235 . . . . 0.45000000000000001 111.635 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -59.16 -39.3 82.03 Favored 'General case' 0 CA--C 1.521 -0.135 0 CA-C-N 118.092 0.406 . . . . 0.31 111.288 179.761 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 15.7 t0 -67.04 112.56 4.45 Favored 'General case' 0 N--CA 1.443 -0.811 0 N-CA-C 108.206 -1.035 . . . . 1.5900000000000001 108.206 174.087 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 76.0 m-20 -93.14 4.97 53.09 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-O 118.747 -0.644 . . . . 2.6499999999999999 110.908 -179.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 49.8 m-20 -99.71 -56.22 2.45 Favored 'General case' 0 C--N 1.345 0.404 0 CA-C-N 118.904 0.775 . . . . 1.21 110.975 -178.799 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 99.44 50.62 1.4 Allowed Glycine 0 CA--C 1.53 1.025 0 N-CA-C 108.69 -1.764 . . . . 0.80000000000000004 108.69 -156.63 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 30.1 p-10 -134.74 -50.63 0.78 Allowed 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 126.191 1.796 . . . . 1.9199999999999999 110.544 176.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 126.9 -46.87 1.05 Allowed Glycine 0 CA--C 1.521 0.428 0 C-N-CA 124.785 1.183 . . . . 0.82999999999999996 110.716 170.473 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 6.3 ptpp? -57.21 136.29 56.46 Favored 'General case' 0 C--O 1.241 0.649 0 CA-C-N 117.282 0.541 . . . . 4.3600000000000003 109.542 171.304 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 8.1 mt -125.41 114.6 40.45 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.197 0 C-N-CA 124.538 1.135 . . . . 0.67000000000000004 108.646 -172.001 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -71.13 160.16 54.01 Favored Glycine 0 CA--C 1.531 1.032 0 N-CA-C 110.121 -1.192 . . . . 0.56000000000000005 110.121 172.643 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -57.76 -36.91 72.75 Favored 'General case' 0 C--O 1.227 -0.12 0 O-C-N 121.848 -0.796 . . . . 1.0800000000000001 109.354 171.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -47.51 -69.57 0.12 Allowed 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.98 0.912 . . . . 4.0199999999999996 111.847 166.256 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -44.01 -46.46 8.36 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.428 1.091 . . . . 2.1499999999999999 111.942 179.045 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -67.38 -50.16 60.88 Favored 'General case' 0 CA--C 1.541 0.629 0 O-C-N 121.997 -0.439 . . . . 3.7400000000000002 111.869 -178.698 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 5.7 tm0? -62.22 -32.75 73.46 Favored 'General case' 0 C--O 1.223 -0.301 0 C-N-CA 124.083 0.953 . . . . 2.21 110.618 178.189 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -60.1 -60.11 4.35 Favored 'General case' 0 N--CA 1.456 -0.156 0 CA-C-N 119.123 0.874 . . . . 4.2999999999999998 109.523 169.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 7.7 tpt -54.0 -44.32 70.77 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-O 121.072 0.463 . . . . 2.7799999999999998 109.919 -174.019 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 46.0 t -72.44 -64.59 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.595 0 CA-C-N 115.872 -0.604 . . . . 1.26 111.403 178.825 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 22.5 t60 -58.17 -36.19 72.66 Favored 'General case' 0 C--N 1.331 -0.233 0 O-C-N 121.038 -1.039 . . . . 3.4700000000000002 110.529 -169.529 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 80.6 p . . . . . 0 C--O 1.251 1.175 0 C-N-CA 125.938 1.695 . . . . 5.71 113.166 173.622 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.472 0.661 0 N-CA-C 106.465 -1.68 . . . . 7.3700000000000001 106.465 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.4 m 143.9 -82.17 0.0 OUTLIER 'General case' 0 C--O 1.223 -0.334 0 C-N-CA 129.267 3.027 . . . . 2.8700000000000001 106.0 -176.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.57 HG22 HG12 ' A' ' 47' ' ' VAL . 2.9 pt -84.04 -24.67 7.59 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.181 0 CA-C-O 121.509 0.671 . . . . 1.6399999999999999 112.237 -168.39 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 11.9 t -54.51 -37.44 65.35 Favored 'General case' 0 N--CA 1.424 -1.763 0 C-N-CA 126.281 1.832 . . . . 2.27 112.355 -178.753 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 39.5 t0 -112.58 45.17 1.34 Allowed 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.769 0.828 . . . . 3.0600000000000001 109.994 -175.635 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 66.1 t -120.05 -64.4 1.63 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.21 0 C-N-CA 124.23 1.012 . . . . 1.4199999999999999 109.724 175.367 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -169.89 -54.45 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 106.704 -1.591 . . . . 1.1699999999999999 106.704 -173.849 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 2.5 m -34.7 -29.61 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 129.507 3.123 . . . . 0.85999999999999999 116.446 -172.185 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -49.08 -49.77 40.09 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 119.076 0.853 . . . . 0.78000000000000003 111.939 172.781 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -63.03 -42.15 99.7 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-O 122.51 1.147 . . . . 2.0899999999999999 109.484 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -68.29 -43.68 77.18 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-N 115.197 -0.911 . . . . 2.4199999999999999 108.905 -171.647 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 10.0 pt -61.92 -37.49 78.37 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.943 0 O-C-N 121.21 -0.931 . . . . 1.3200000000000001 111.526 174.029 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.44 -44.57 89.22 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 118.928 0.785 . . . . 0.78000000000000003 110.305 175.331 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.21 -56.26 24.4 Favored 'General case' 0 CA--C 1.535 0.4 0 O-C-N 122.198 -0.314 . . . . 0.56000000000000005 110.737 173.018 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -53.72 -44.19 69.67 Favored 'General case' 0 N--CA 1.457 -0.097 0 C-N-CA 124.691 1.196 . . . . 0.59999999999999998 111.256 -175.579 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.9 tt -51.29 -38.72 54.4 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 125.302 1.441 . . . . 3.4199999999999999 110.838 177.428 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 13.0 tt0 -89.18 -43.54 10.94 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 117.725 0.238 . . . . 2.8999999999999999 110.807 -177.328 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -69.15 -34.74 75.46 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 117.865 0.302 . . . . 3.1600000000000001 111.104 -175.528 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 19.6 t -108.29 52.62 0.71 Allowed 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 125.303 1.441 . . . . 2.9500000000000002 109.462 175.416 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 5.8 ttt-85 -92.41 -46.92 7.43 Favored 'General case' 0 C--O 1.231 0.112 0 C-N-CA 123.426 0.69 . . . . 4.1500000000000004 109.516 179.027 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -62.72 148.67 90.89 Favored Pre-proline 0 CA--C 1.537 0.471 0 C-N-CA 125.523 1.529 . . . . 2.8100000000000001 109.483 178.665 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -67.83 138.58 45.12 Favored 'Trans proline' 0 N--CA 1.451 -1.022 0 C-N-CA 122.123 1.882 . . . . 1.3100000000000001 111.386 -175.364 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 64.48 25.58 13.31 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 126.165 1.786 . . . . 2.3599999999999999 111.695 170.78 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 8.6 m -91.53 -13.62 31.78 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 124.558 1.143 . . . . 1.05 111.574 -179.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 3.4 t80 -54.51 120.6 6.89 Favored 'General case' 0 CA--C 1.534 0.339 0 O-C-N 121.635 -0.666 . . . . 4.0199999999999996 111.325 179.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -119.43 155.37 54.11 Favored Pre-proline 0 CA--C 1.537 0.477 0 C-N-CA 125.393 1.477 . . . . 2.4199999999999999 109.665 169.674 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -67.19 -82.21 0.01 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.706 0 C-N-CA 123.736 2.958 . . . . 1.01 112.083 -176.085 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 47.1 mt-30 -49.31 -45.64 45.61 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 124.584 1.154 . . . . 1.77 111.189 -176.481 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -39.41 -68.2 0.18 Allowed 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 125.111 1.364 . . . . 2.6099999999999999 110.004 166.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 25.2 t80 -65.05 -38.21 90.1 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 122.421 0.288 . . . . 3.0299999999999998 111.291 -174.764 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 9.0 m-30 -57.41 -43.0 83.37 Favored 'General case' 0 CA--C 1.53 0.189 0 O-C-N 121.345 -0.847 . . . . 4.8700000000000001 110.323 179.001 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -69.73 -52.45 25.31 Favored 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 109.481 -0.563 . . . . 2.7400000000000002 109.481 174.643 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -63.64 -26.72 68.8 Favored 'General case' 0 N--CA 1.446 -0.63 0 C-N-CA 123.033 0.533 . . . . 0.98999999999999999 111.559 -170.141 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 25.8 t -93.42 1.14 56.97 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 125.488 1.515 . . . . 1.6799999999999999 111.787 178.623 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 88.79 -11.46 68.75 Favored Glycine 0 C--N 1.337 0.632 0 C-N-CA 124.276 0.941 . . . . 1.05 111.288 171.398 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 52.8 mt -65.15 -38.17 89.72 Favored 'General case' 0 N--CA 1.44 -0.936 0 C-N-CA 124.578 1.151 . . . . 1.4399999999999999 111.367 -167.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 46.0 m -70.13 -20.6 63.16 Favored 'General case' 0 N--CA 1.461 0.106 0 CA-C-N 118.524 0.602 . . . . 3.0299999999999998 111.954 174.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 13.2 tttt -86.65 -38.04 17.44 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 108.678 -0.86 . . . . 4.1100000000000003 108.678 -178.76 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 31.1 mmt -58.87 131.47 51.08 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-O 121.588 0.709 . . . . 3.1600000000000001 109.625 169.331 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -68.63 158.47 34.0 Favored 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 108.659 -0.867 . . . . 2.1600000000000001 108.659 179.575 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -41.82 -42.58 2.71 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 124.407 1.083 . . . . 0.71999999999999997 112.408 177.606 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -52.34 -55.11 23.71 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.523 0.729 . . . . 2.5099999999999998 111.535 174.707 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 16.9 mm100 -69.0 -39.1 79.52 Favored 'General case' 0 N--CA 1.454 -0.234 0 O-C-N 122.04 -0.413 . . . . 2.8900000000000001 110.426 -177.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 94.2 t -59.1 -41.14 82.65 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 O-C-N 121.568 -0.707 . . . . 0.63 109.408 175.736 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 83.2 tttt -64.47 -40.21 95.26 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.21 0.604 . . . . 2.5600000000000001 111.023 175.772 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -57.5 -64.65 0.82 Allowed 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 118.759 0.709 . . . . 3.23 110.513 173.164 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.57 HG12 HG22 ' A' ' 3' ' ' ILE . 14.9 m -53.61 -45.27 59.64 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.306 0 N-CA-C 110.32 -0.252 . . . . 0.69999999999999996 110.32 -175.71 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.833 ' CZ ' ' HB2' ' A' ' 100' ' ' ALA . 14.6 t80 -40.96 -44.83 2.43 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 125.16 1.384 . . . . 4.71 112.72 172.67 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 47.4 mtp180 -58.63 -30.34 67.21 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 119.107 0.867 . . . . 3.02 112.071 -178.046 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -79.0 -38.07 37.6 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 123.291 0.636 . . . . 4.1299999999999999 109.509 -178.559 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 4.1 mp -66.72 176.14 0.44 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.939 0 C-N-CA 124.319 1.048 . . . . 2.4199999999999999 108.398 168.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 18.5 t70 73.67 -51.05 0.7 Allowed 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 127.199 2.2 . . . . 3.8599999999999999 111.209 -174.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 7.1 t30 77.51 -42.09 0.38 Allowed 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 125.442 1.497 . . . . 1.8500000000000001 112.581 175.456 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 86.1 m-20 -48.48 -52.32 22.94 Favored 'General case' 0 C--N 1.342 0.242 0 N-CA-C 108.237 -1.023 . . . . 2.8700000000000001 108.237 165.302 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 91.88 -1.88 0.17 Allowed 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 128.817 2.847 . . . . 4.3300000000000001 110.477 -164.565 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 95.5 p -46.75 -41.86 15.89 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 126.936 2.094 . . . . 2.1699999999999999 111.309 168.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 87.3 -14.16 58.31 Favored Glycine 0 CA--C 1.528 0.892 0 C-N-CA 123.747 0.689 . . . . 2.5099999999999998 113.073 -174.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 33.6 m-85 -76.86 100.75 5.63 Favored 'General case' 0 CA--C 1.511 -0.524 0 N-CA-C 107.064 -1.458 . . . . 2.3799999999999999 107.064 165.113 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 8.6 mp -68.87 87.93 0.37 Allowed 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 106.137 -1.801 . . . . 2.75 106.137 163.012 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -67.28 152.18 46.18 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.133 1.373 . . . . 1.47 108.415 168.015 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -46.4 -53.83 10.27 Favored 'General case' 0 CA--C 1.535 0.374 0 O-C-N 121.229 -0.919 . . . . 3.7599999999999998 112.973 -173.192 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -55.38 -27.7 49.2 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.256 0.622 . . . . 3.1699999999999999 112.509 179.739 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 64.9 mt-10 -75.18 -29.29 60.34 Favored 'General case' 0 C--N 1.33 -0.268 0 O-C-N 120.083 -1.635 . . . . 2.0099999999999998 111.074 177.376 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 17.4 mt -66.42 -20.65 66.11 Favored 'General case' 0 N--CA 1.449 -0.476 0 O-C-N 121.82 -0.55 . . . . 2.3599999999999999 110.498 173.165 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 26.6 ttpt -63.52 -6.83 5.63 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.299 0.64 . . . . 2.1400000000000001 111.843 168.054 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 20.6 p90 -135.33 31.37 3.18 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 120.061 1.3 . . . . 5.2000000000000002 112.561 169.306 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -50.92 -70.45 0.08 Allowed 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 123.567 0.747 . . . . 2.21 112.304 -178.327 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 2.4 tp -77.94 -20.47 52.71 Favored 'General case' 0 CA--C 1.533 0.318 0 O-C-N 121.059 -1.026 . . . . 2.4900000000000002 111.63 -179.8 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.07 -13.09 10.05 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.638 1.175 . . . . 2.3999999999999999 111.111 175.684 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.56 -34.11 77.17 Favored 'General case' 0 N--CA 1.449 -0.479 0 O-C-N 120.996 -1.065 . . . . 2.7799999999999998 111.991 170.413 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -90.62 -61.86 1.58 Allowed 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 108.06 -1.089 . . . . 7.0800000000000001 108.06 178.09 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -104.1 -176.65 3.14 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 124.467 1.107 . . . . 3.5800000000000001 108.418 -170.368 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 66.3 m -124.55 -15.57 6.55 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 119.639 1.109 . . . . 2.3399999999999999 113.686 -177.801 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -131.72 39.34 1.78 Allowed Glycine 0 CA--C 1.525 0.681 0 C-N-CA 125.151 1.358 . . . . 1.28 111.007 -176.256 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -74.9 -134.51 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.183 0.993 . . . . 1.72 110.286 173.839 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 5.4 tpt85 -124.47 -4.14 7.8 Favored 'General case' 0 CA--C 1.534 0.362 0 O-C-N 121.028 -1.045 . . . . 3.8999999999999999 113.028 -168.057 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -57.18 -23.52 48.17 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.274 1.03 . . . . 3.1200000000000001 112.956 -163.177 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.821 HD22 ' H ' ' A' ' 78' ' ' LEU . 0.0 OUTLIER -56.07 -42.19 76.27 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 125.104 1.362 . . . . 0.95999999999999996 111.834 173.31 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 90.6 m -71.78 102.44 2.84 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 121.599 0.714 . . . . 0.82999999999999996 110.258 -176.127 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -52.35 -42.1 63.62 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 114.663 -1.153 . . . . 3.0899999999999999 111.754 -179.278 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 65.7 m -57.76 -40.64 80.25 Favored 'General case' 0 CA--C 1.531 0.23 0 O-C-N 121.342 -0.849 . . . . 1.24 112.308 177.331 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -79.39 -45.77 18.87 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 108.634 -0.876 . . . . 2.6899999999999999 108.634 -172.705 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -47.79 -55.18 10.24 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-O 121.144 0.497 . . . . 0.56999999999999995 110.136 167.658 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 27.4 pttt -71.54 -22.27 61.79 Favored 'General case' 0 C--O 1.217 -0.642 0 CA-C-O 118.535 -0.745 . . . . 5.5300000000000002 111.132 -172.281 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 15.6 t -60.6 -49.83 75.96 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 119.965 1.257 . . . . 1.9299999999999999 109.073 169.084 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.7 tt -58.16 -54.4 47.41 Favored 'General case' 0 C--N 1.342 0.256 0 N-CA-C 109.404 -0.591 . . . . 3.0299999999999998 109.404 174.15 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 25.2 ttp -48.21 -52.54 20.54 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 121.046 0.451 . . . . 2.6899999999999999 111.853 178.717 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -55.01 -40.62 70.36 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 126.293 1.837 . . . . 0.56999999999999995 111.749 -169.38 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -92.41 -40.35 10.93 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 122.369 0.267 . . . . 0.58999999999999997 111.701 -178.828 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -58.23 -40.39 81.58 Favored 'General case' 0 C--N 1.339 0.119 0 CA-C-N 118.123 0.42 . . . . 0.40000000000000002 110.533 176.787 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -70.18 120.68 16.22 Favored 'General case' 0 N--CA 1.444 -0.768 0 N-CA-C 108.469 -0.938 . . . . 1.02 108.469 174.772 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 9.2 m-80 -106.53 12.78 29.14 Favored 'General case' 0 C--N 1.331 -0.21 0 C-N-CA 122.794 0.438 . . . . 2.8700000000000001 111.152 -179.602 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 38.1 m-20 -99.1 -39.25 8.59 Favored 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 122.987 0.515 . . . . 1.3799999999999999 109.901 178.09 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 86.09 38.98 8.18 Favored Glycine 0 CA--C 1.529 0.907 0 N-CA-C 108.753 -1.739 . . . . 0.81999999999999995 108.753 -156.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -119.87 -58.77 1.86 Allowed 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 117.795 0.797 . . . . 2.4700000000000002 111.089 -178.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 126.77 -38.93 2.07 Favored Glycine 0 CA--C 1.528 0.889 0 C-N-CA 124.171 0.891 . . . . 0.66000000000000003 111.506 178.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 31.6 mmtp -60.81 117.25 5.17 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 108.141 -1.059 . . . . 3.9900000000000002 108.141 173.798 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 6.8 mt -108.66 113.8 45.02 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.09 0 N-CA-C 109.317 -0.623 . . . . 0.82999999999999996 109.317 -178.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -75.96 170.42 54.71 Favored Glycine 0 CA--C 1.53 1.015 0 N-CA-C 110.879 -0.888 . . . . 0.5 110.879 170.6 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . 0.833 ' HB2' ' CZ ' ' A' ' 48' ' ' PHE . . . -55.34 -42.39 73.77 Favored 'General case' 0 CA--C 1.515 -0.372 0 O-C-N 122.234 -0.568 . . . . 0.68000000000000005 109.672 173.104 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.16 -63.54 1.26 Allowed 'General case' 0 N--CA 1.447 -0.576 0 O-C-N 124.264 0.977 . . . . 2.75 108.822 -177.057 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -42.25 -52.59 4.4 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.787 0.835 . . . . 1.3500000000000001 111.769 173.139 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 42.3 t80 -59.76 -56.37 22.7 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-O 121.267 0.556 . . . . 3.4500000000000002 110.603 -176.625 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -61.57 -37.91 85.6 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 124.764 1.226 . . . . 3.0299999999999998 110.89 -176.264 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -54.61 -62.98 1.3 Allowed 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 119.411 1.005 . . . . 3.77 109.155 172.095 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 1.7 tpt -63.59 -37.59 87.89 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 120.622 -0.431 . . . . 3.6299999999999999 111.417 -171.685 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 49.7 t -62.74 -48.21 89.24 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.22 0 C-N-CA 123.063 0.545 . . . . 1.28 110.886 174.024 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 83.9 t60 -67.83 -30.82 70.31 Favored 'General case' 0 N--CA 1.456 -0.141 0 C-N-CA 123.371 0.668 . . . . 2.0800000000000001 110.55 -173.435 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 5.1 t . . . . . 0 C--O 1.251 1.159 0 C-N-CA 125.962 1.705 . . . . 2.6400000000000001 112.141 177.694 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.3 ptm . . . . . 0 N--CA 1.477 0.921 0 N-CA-C 112.929 0.714 . . . . 7.5800000000000001 112.929 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.6 m -174.08 -56.47 0.01 OUTLIER 'General case' 0 C--O 1.223 -0.325 0 C-N-CA 125.066 1.346 . . . . 2.3100000000000001 107.973 177.494 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.642 HG22 HG12 ' A' ' 47' ' ' VAL . 1.5 pp -92.5 -38.17 9.77 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.224 0 CA-C-O 121.397 0.618 . . . . 1.25 111.139 179.333 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 62.8 p -58.12 -56.27 24.26 Favored 'General case' 0 N--CA 1.439 -1.004 0 C-N-CA 123.881 0.872 . . . . 3.0600000000000001 108.81 -178.085 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 38.5 t0 -80.99 45.33 0.82 Allowed 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.929 2.091 . . . . 2.4300000000000002 111.4 -169.73 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 73.9 t -143.46 -57.59 0.16 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.14 0 C-N-CA 126.832 2.053 . . . . 1.5700000000000001 107.77 -178.085 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 4.2 tp -166.25 -56.11 0.03 OUTLIER 'General case' 0 C--N 1.334 -0.093 0 N-CA-C 106.302 -1.74 . . . . 1.0900000000000001 106.302 -176.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -45.9 -23.57 0.3 Allowed 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 127.631 2.372 . . . . 1.1299999999999999 115.496 -165.313 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -49.66 -47.57 49.95 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 119.558 1.072 . . . . 0.93000000000000005 111.525 170.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -63.81 -39.81 95.13 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-O 122.449 1.119 . . . . 1.79 109.725 -179.414 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -72.76 -42.58 63.86 Favored 'General case' 0 N--CA 1.443 -0.792 0 C-N-CA 123.714 0.806 . . . . 2.4399999999999999 109.987 -173.271 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 29.0 pt -61.92 -41.43 90.83 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.769 0 O-C-N 121.224 -0.923 . . . . 0.96999999999999997 110.249 172.707 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.25 -46.53 76.07 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 118.947 0.794 . . . . 0.70999999999999996 111.129 173.062 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -57.04 -59.14 5.5 Favored 'General case' 0 CA--C 1.536 0.41 0 O-C-N 121.617 -0.677 . . . . 0.53000000000000003 110.837 174.046 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -46.11 -43.58 14.92 Favored 'General case' 0 CA--C 1.528 0.132 0 C-N-CA 125.633 1.573 . . . . 0.68000000000000005 111.484 178.717 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 39.5 tp -60.26 -40.56 90.76 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 123.833 0.853 . . . . 2.7799999999999998 110.508 -176.622 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 18.2 tt0 -87.91 -40.1 14.23 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 110.3 -0.259 . . . . 2.7000000000000002 110.3 -173.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.4 pp20? -68.11 -49.19 62.7 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 109.232 -0.655 . . . . 3.3999999999999999 109.232 -179.392 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -86.4 46.88 1.39 Allowed 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 124.543 1.137 . . . . 1.95 108.855 -179.608 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 61.1 ttt180 -87.29 -56.42 3.38 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 108.458 -0.941 . . . . 4.25 108.458 -176.351 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -55.13 131.35 68.62 Favored Pre-proline 0 N--CA 1.449 -0.508 0 CA-C-O 118.657 -0.687 . . . . 2.3199999999999998 109.47 176.381 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -62.78 150.1 89.21 Favored 'Trans proline' 0 N--CA 1.453 -0.895 0 C-N-CA 122.443 2.095 . . . . 1.25 110.304 -173.813 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 66.99 3.78 3.27 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.902 1.681 . . . . 2.9900000000000002 113.367 174.62 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 12.5 m -77.9 -7.74 57.14 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 120.783 -1.198 . . . . 0.81000000000000005 111.981 -176.519 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 41.3 t80 -68.48 113.68 6.23 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 121.429 -0.794 . . . . 4.2599999999999998 111.927 -173.114 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -102.87 155.61 36.35 Favored Pre-proline 0 CA--C 1.542 0.65 0 C-N-CA 125.396 1.478 . . . . 2.7400000000000002 111.035 166.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.36 -71.8 0.02 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.531 0 C-N-CA 124.47 3.446 . . . . 0.78000000000000003 112.575 -175.114 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 35.1 mt-30 -52.94 -46.35 68.08 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 123.734 0.814 . . . . 2.6499999999999999 110.567 -178.428 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -44.56 -67.39 0.29 Allowed 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 124.931 1.292 . . . . 3.7000000000000002 108.349 170.182 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 51.1 t80 -48.95 -52.96 21.83 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-O 118.635 -0.697 . . . . 2.8199999999999998 111.768 178.47 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.465 ' CE1' HD21 ' A' ' 86' ' ' LEU . 16.9 m-85 -52.11 -45.46 64.9 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 119.486 1.039 . . . . 4.7800000000000002 111.698 -176.441 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -72.87 -42.84 63.23 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 119.704 -0.798 . . . . 3.1000000000000001 110.293 179.265 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -61.31 -36.28 79.69 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 123.357 0.663 . . . . 0.81000000000000005 111.716 -178.517 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 57.7 p -83.03 -0.12 47.45 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 124.245 1.018 . . . . 1.99 111.206 178.848 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 82.19 -8.58 60.44 Favored Glycine 0 C--N 1.337 0.636 0 N-CA-C 110.773 -0.931 . . . . 0.82999999999999996 110.773 176.363 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 75.0 mt -59.39 -38.03 79.5 Favored 'General case' 0 N--CA 1.442 -0.855 0 C-N-CA 124.456 1.102 . . . . 1.3100000000000001 111.212 -174.381 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 21.3 m -71.45 -23.14 61.78 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 118.663 0.665 . . . . 2.8500000000000001 112.057 176.352 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 6.8 ttpt -83.87 -36.36 23.47 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 109.124 -0.695 . . . . 4.4199999999999999 109.124 179.008 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 14.2 mmt -59.95 135.72 57.79 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-O 121.631 0.729 . . . . 2.5699999999999998 110.445 173.21 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 69.5 m -63.58 152.45 38.74 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 116.082 -0.508 . . . . 1.8400000000000001 110.382 174.458 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -39.51 -40.76 0.9 Allowed 'General case' 0 C--O 1.224 -0.246 0 C-N-CA 125.674 1.59 . . . . 0.66000000000000003 111.976 172.805 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 67.7 m-20 -52.33 -56.16 16.73 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.632 1.173 . . . . 1.5700000000000001 111.45 176.103 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -72.65 -38.87 67.54 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 108.98 -0.748 . . . . 3.6200000000000001 108.98 -174.922 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.422 ' CG1' ' CZ ' ' A' ' 48' ' ' PHE . 52.7 t -58.52 -47.77 87.39 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 CA-C-O 121.342 0.591 . . . . 0.59999999999999998 109.557 175.565 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -55.58 -48.97 73.95 Favored 'General case' 0 N--CA 1.453 -0.291 0 O-C-N 121.228 -0.92 . . . . 2.8300000000000001 109.952 173.84 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -57.31 -51.13 70.63 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 120.224 -0.59 . . . . 2.9900000000000002 111.294 179.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.642 HG12 HG22 ' A' ' 3' ' ' ILE . 3.7 m -55.19 -42.14 64.17 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 O-C-N 121.785 -0.572 . . . . 0.65000000000000002 110.484 178.186 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.499 ' CZ ' ' HB3' ' A' ' 103' ' ' PHE . 17.3 m-30 -54.34 -34.42 61.03 Favored 'General case' 0 C--N 1.341 0.217 0 N-CA-C 113.027 0.751 . . . . 5.8899999999999997 113.027 174.746 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 81.2 mtp180 -61.58 -40.53 95.09 Favored 'General case' 0 CA--C 1.529 0.154 0 CA-C-N 119.506 1.048 . . . . 4.2400000000000002 109.975 174.882 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -64.5 -43.56 93.72 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 109.36 -0.607 . . . . 4.0700000000000003 109.36 176.23 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.423 HD11 ' CZ ' ' A' ' 71' ' ' PHE . 27.9 mm -58.09 -54.91 25.92 Favored 'Isoleucine or valine' 0 C--O 1.237 0.401 0 CA-C-O 118.799 -0.62 . . . . 1.55 110.874 177.64 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -75.89 64.19 1.81 Allowed 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 124.821 1.248 . . . . 1.9199999999999999 109.326 -173.179 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 31.6 t30 -55.27 -32.83 62.68 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 125.869 1.668 . . . . 1.8700000000000001 111.942 -174.139 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 16.6 p-10 -74.5 -29.05 61.26 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.947 1.699 . . . . 2.3599999999999999 111.977 175.163 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 8.7 mt-30 57.31 60.64 2.83 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 125.285 1.434 . . . . 2.9199999999999999 110.859 -173.152 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 79.1 p -89.34 -46.02 9.06 Favored 'General case' 0 C--N 1.337 0.048 0 C-N-CA 123.858 0.863 . . . . 1.3999999999999999 111.134 174.193 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 113.47 -18.87 20.06 Favored Glycine 0 CA--C 1.531 1.066 0 C-N-CA 123.912 0.768 . . . . 1.29 111.42 -164.871 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 77.9 m-85 -118.48 142.8 47.22 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 124.073 0.949 . . . . 2.5299999999999998 110.076 178.324 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.428 HD13 ' CE2' ' A' ' 103' ' ' PHE . 0.2 OUTLIER -104.01 70.3 0.99 Allowed 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 124.648 1.179 . . . . 3.0899999999999999 108.695 173.352 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -56.29 158.5 4.13 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.584 1.553 . . . . 2.04 111.472 176.931 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 54.9 mt-10 -43.67 -56.29 3.85 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 125.029 1.332 . . . . 3.4100000000000001 113.633 -175.728 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 16.3 tt0 -62.88 -25.64 68.39 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 121.969 -0.457 . . . . 3.0800000000000001 111.789 -178.633 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -71.02 -41.2 71.18 Favored 'General case' 0 N--CA 1.446 -0.652 0 O-C-N 121.109 -0.994 . . . . 2.8100000000000001 109.272 175.205 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -53.78 -40.67 66.46 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 122.85 0.46 . . . . 2.8100000000000001 110.416 172.629 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 21.3 ttpt -53.58 -16.55 1.6 Allowed 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.143 0.977 . . . . 1.97 112.814 174.805 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 59.5 m-85 -132.8 53.76 1.99 Allowed 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 118.923 0.783 . . . . 4.6500000000000004 110.368 167.295 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 48.8 t80 -79.21 -75.84 0.23 Allowed 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.98 0.912 . . . . 2.3100000000000001 109.97 173.787 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 1.7 tp -76.11 -8.91 58.07 Favored 'General case' 0 CA--C 1.542 0.636 0 O-C-N 120.438 -1.414 . . . . 2.4500000000000002 112.341 -176.776 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 61.1 mm-40 -47.5 -49.43 25.91 Favored 'General case' 0 C--N 1.343 0.289 0 C-N-CA 124.264 1.025 . . . . 1.6499999999999999 110.886 175.478 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.4 -11.25 14.62 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 112.919 0.711 . . . . 3.5299999999999998 112.919 -177.958 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.423 ' CZ ' HD11 ' A' ' 51' ' ' ILE . 13.4 m-30 -100.96 -60.13 1.58 Allowed 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 124.025 0.93 . . . . 3.6200000000000001 110.067 178.688 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -101.21 -22.43 14.66 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 112.354 0.502 . . . . 3.5099999999999998 112.354 -170.256 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 3.4 t 74.97 -50.7 0.67 Allowed 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 125.663 1.585 . . . . 2.46 110.654 -174.385 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -99.99 41.02 2.26 Favored Glycine 0 CA--C 1.526 0.777 0 O-C-N 121.239 -0.913 . . . . 1.03 111.065 179.096 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -80.98 -172.03 3.51 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 117.199 0.499 . . . . 1.3899999999999999 111.287 179.805 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -87.84 -7.26 57.49 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 123.427 0.691 . . . . 2.9700000000000002 112.536 -167.187 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -49.28 -35.55 18.2 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.453 1.501 . . . . 3.1800000000000002 113.299 -163.426 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.557 HD22 ' H ' ' A' ' 78' ' ' LEU . 0.1 OUTLIER -52.08 -44.57 64.41 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.389 1.076 . . . . 0.84999999999999998 112.025 173.58 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 32.1 m -65.1 107.71 1.62 Allowed 'General case' 0 C--O 1.236 0.366 0 CA-C-O 122.075 0.94 . . . . 0.81000000000000005 110.294 179.025 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -58.29 -41.58 84.69 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 113.925 -1.489 . . . . 2.7200000000000002 110.347 -178.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -48.1 -59.13 3.62 Favored 'General case' 0 C--O 1.225 -0.215 0 CA-C-N 118.863 0.756 . . . . 1.54 111.341 176.649 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 14.5 mt-10 -71.7 -42.68 67.08 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 123.795 0.838 . . . . 2.6800000000000002 109.382 -168.049 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -49.08 -52.73 24.03 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 116.105 -0.498 . . . . 0.58999999999999997 110.049 168.3 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 15.0 mmmt -69.17 -31.91 70.87 Favored 'General case' 0 C--O 1.22 -0.463 0 C-N-CA 123.402 0.681 . . . . 4.5099999999999998 111.07 -174.323 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 70.9 m -58.26 -42.82 87.27 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 120.084 1.311 . . . . 1.3999999999999999 110.644 170.2 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.465 HD21 ' CE1' ' A' ' 31' ' ' PHE . 0.5 OUTLIER -61.33 -62.56 1.75 Allowed 'General case' 0 C--O 1.234 0.254 0 N-CA-C 108.397 -0.964 . . . . 2.9900000000000002 108.397 172.062 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 9.7 ttm -49.27 -48.51 45.84 Favored 'General case' 0 CA--C 1.536 0.418 0 O-C-N 123.666 0.604 . . . . 4.4000000000000004 112.435 -173.272 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -49.72 -46.04 49.84 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 126.627 1.971 . . . . 0.69999999999999996 111.955 -178.89 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -83.63 -49.86 8.77 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 110.433 -0.21 . . . . 0.82999999999999996 110.433 -177.689 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.479 ' HB3' HD13 ' A' ' 98' ' ' ILE . . . -54.46 -41.83 69.94 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 122.691 0.396 . . . . 0.64000000000000001 111.681 -178.753 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -74.42 81.75 1.92 Allowed 'General case' 0 N--CA 1.446 -0.658 0 CA-C-O 121.352 0.596 . . . . 1.23 110.084 178.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 42.6 p-10 -77.46 49.88 0.76 Allowed 'General case' 0 CA--C 1.536 0.414 0 O-C-N 121.646 -0.659 . . . . 2.6699999999999999 111.315 176.023 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 34.2 m-20 -137.53 -60.44 0.66 Allowed 'General case' 0 C--N 1.341 0.231 0 C-N-CA 126.356 1.862 . . . . 1.22 109.258 178.595 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 102.26 43.27 2.06 Favored Glycine 0 CA--C 1.533 1.199 0 C-N-CA 125.028 1.299 . . . . 1.0600000000000001 110.247 -161.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -121.85 -61.53 1.49 Allowed 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.948 1.699 . . . . 1.9399999999999999 109.552 173.427 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 119.55 -24.13 8.17 Favored Glycine 0 CA--C 1.53 0.975 0 C-N-CA 125.2 1.381 . . . . 0.79000000000000004 111.28 -179.533 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 41.0 mttt -78.86 103.72 9.0 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 107.673 -1.232 . . . . 5.1699999999999999 107.673 171.393 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . 0.479 HD13 ' HB3' ' A' ' 90' ' ' ALA . 67.8 mt -94.43 118.92 41.57 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.577 0 N-CA-C 107.794 -1.188 . . . . 0.91000000000000003 107.794 -176.121 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -72.51 166.87 53.83 Favored Glycine 0 CA--C 1.534 1.244 0 CA-C-O 121.69 0.606 . . . . 0.55000000000000004 111.835 170.577 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -61.18 -37.15 81.92 Favored 'General case' 0 N--CA 1.456 -0.143 0 O-C-N 121.285 -1.127 . . . . 0.58999999999999997 110.087 178.058 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 56.0 mt-10 -62.34 -55.81 24.45 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-O 118.686 -0.673 . . . . 2.75 110.552 176.173 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -43.7 -50.3 7.61 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-O 121.829 0.824 . . . . 1.4399999999999999 110.008 173.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . 0.499 ' HB3' ' CZ ' ' A' ' 48' ' ' PHE . 0.8 OUTLIER -61.3 -54.2 47.0 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 112.868 0.692 . . . . 4.0099999999999998 112.868 177.867 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 18.7 tt0 -53.66 -49.88 66.99 Favored 'General case' 0 C--O 1.223 -0.308 0 C-N-CA 124.55 1.14 . . . . 2.4100000000000001 108.756 -178.714 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 65.4 mt-10 -48.99 -58.23 5.23 Favored 'General case' 0 C--O 1.232 0.165 0 C-N-CA 123.952 0.901 . . . . 3.46 110.064 176.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.3 -47.86 84.02 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 120.776 -0.37 . . . . 3.6099999999999999 111.193 -175.518 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 37.4 t -58.67 -44.95 90.9 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.193 0 C-N-CA 122.974 0.509 . . . . 1.28 111.393 178.444 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 63.4 t60 -62.88 -30.08 71.24 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 125.65 1.58 . . . . 2.52 110.179 -173.268 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 2.9 t . . . . . 0 C--O 1.251 1.154 0 CA-C-O 116.848 -1.549 . . . . 2.77 111.701 -177.195 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.411 ' N ' ' OD2' ' A' ' 5' ' ' ASP . 12.6 ptm . . . . . 0 N--CA 1.473 0.704 0 N-CA-C 113.793 1.034 . . . . 8.1600000000000001 113.793 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.0 m -136.05 -88.86 0.31 Allowed 'General case' 0 C--O 1.224 -0.241 0 N-CA-C 109.674 -0.491 . . . . 2.3500000000000001 109.674 -174.477 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.439 HG22 HG12 ' A' ' 47' ' ' VAL . 1.2 pp -105.45 -25.05 3.8 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.157 0 CA-C-O 121.641 0.734 . . . . 1.29 110.035 -175.426 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 9.9 t -74.12 7.78 2.51 Favored 'General case' 0 N--CA 1.436 -1.173 0 C-N-CA 126.574 1.95 . . . . 1.8999999999999999 111.056 -174.486 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.411 ' OD2' ' N ' ' A' ' 1' ' ' MET . 11.1 t70 -168.38 45.84 0.04 OUTLIER 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 126.54 1.936 . . . . 3.6200000000000001 105.804 -158.493 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -148.13 -50.83 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.529 0.152 0 CA-C-N 115.38 -0.827 . . . . 1.78 110.879 179.849 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 177.98 -56.1 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 105.945 -1.872 . . . . 1.1899999999999999 105.945 -172.81 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 8.4 m -44.39 -32.92 1.49 Allowed 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 126.243 1.817 . . . . 0.91000000000000003 115.393 -172.344 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -49.53 -43.9 46.02 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 119.489 1.041 . . . . 0.83999999999999997 112.941 175.349 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 42.9 t0 -72.34 -39.24 68.28 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 122.725 1.25 . . . . 2.04 109.751 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 43.9 m-20 -62.16 -44.99 95.38 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 123.581 0.752 . . . . 2.5099999999999998 110.276 -178.213 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 39.0 pt -62.83 -40.94 90.65 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.196 0 CA-C-O 118.231 -0.89 . . . . 0.79000000000000004 110.13 177.479 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -52.36 -47.74 65.96 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 119.291 0.95 . . . . 0.68999999999999995 111.043 174.538 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -54.17 -60.78 2.88 Favored 'General case' 0 CA--C 1.529 0.162 0 O-C-N 122.334 -0.229 . . . . 0.65000000000000002 111.083 173.173 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -50.98 -48.63 61.15 Favored 'General case' 0 C--O 1.233 0.222 0 C-N-CA 123.269 0.628 . . . . 0.66000000000000003 112.09 -177.77 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -48.73 -50.03 35.48 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 125.203 1.401 . . . . 4.1200000000000001 110.053 178.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -79.23 -46.96 16.81 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 120.033 -0.667 . . . . 2.8900000000000001 109.484 -174.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 43.9 tp10 -45.81 -50.4 14.16 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 124.507 1.123 . . . . 4.2699999999999996 110.662 178.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 76.2 m -105.94 46.91 0.9 Allowed 'General case' 0 C--O 1.236 0.361 0 C-N-CA 123.053 0.541 . . . . 1.6000000000000001 110.242 -178.078 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.24 -43.28 82.32 Favored 'General case' 0 C--N 1.343 0.322 0 CA-C-O 121.798 0.809 . . . . 7.1399999999999997 109.078 -179.699 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -67.35 134.92 93.19 Favored Pre-proline 0 N--CA 1.442 -0.846 0 C-N-CA 125.885 1.674 . . . . 2.3199999999999998 109.404 -173.223 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -63.76 148.31 92.09 Favored 'Trans proline' 0 N--CA 1.456 -0.705 0 C-N-CA 122.835 2.356 . . . . 1.29 112.01 -171.35 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 9.5 t70 69.27 -0.15 2.63 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 127.608 2.363 . . . . 3.6800000000000002 113.639 179.172 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 14.9 m -77.55 -21.03 53.21 Favored 'General case' 0 C--N 1.341 0.215 0 N-CA-C 114.099 1.148 . . . . 0.93000000000000005 114.099 -175.45 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -75.27 90.9 2.62 Favored 'General case' 0 CA--C 1.539 0.538 0 O-C-N 121.42 -0.8 . . . . 3.7599999999999998 111.61 -165.063 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -77.48 155.11 81.61 Favored Pre-proline 0 CA--C 1.535 0.396 0 O-C-N 121.717 -0.614 . . . . 2.75 110.453 175.264 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -71.57 -67.23 0.03 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.108 0 C-N-CA 122.987 2.458 . . . . 0.77000000000000002 111.804 -176.271 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 71.5 mt-30 -53.54 -44.6 69.34 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 118.565 0.62 . . . . 2.04 110.487 179.503 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 25.3 tptt -43.84 -62.29 1.16 Allowed 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.429 1.091 . . . . 2.8300000000000001 110.062 169.105 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 16.0 t80 -53.6 -51.54 62.7 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.13 0.572 . . . . 2.8199999999999998 111.406 179.025 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 7.4 m-30 -58.08 -34.69 70.42 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 121.593 -0.692 . . . . 5.0 111.576 -176.8 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 12.9 tt0 -73.58 -57.57 3.9 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 108.616 -0.883 . . . . 3.6099999999999999 108.616 175.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -54.51 -38.03 66.03 Favored 'General case' 0 N--CA 1.444 -0.76 0 C-N-CA 124.829 1.252 . . . . 1.28 110.631 -172.605 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 69.2 m -88.6 1.78 54.34 Favored 'General case' 0 N--CA 1.445 -0.72 0 N-CA-C 112.926 0.713 . . . . 2.2000000000000002 112.926 -177.165 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 76.83 -15.35 6.27 Favored Glycine 0 CA--C 1.532 1.147 0 O-C-N 119.951 -1.718 . . . . 1.23 112.836 172.295 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 94.2 mt -45.01 -35.24 2.82 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 127.445 2.298 . . . . 1.5800000000000001 112.434 170.527 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 9.1 t -60.57 -37.99 83.11 Favored 'General case' 0 CA--C 1.529 0.157 0 O-C-N 121.683 -0.636 . . . . 2.02 110.57 176.281 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 29.1 tttp -89.45 -30.38 18.35 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-O 118.857 -0.592 . . . . 4.7999999999999998 111.235 -174.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -31.73 -67.31 0.1 Allowed 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 125.852 1.661 . . . . 3.3300000000000001 113.303 -174.545 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 26.1 m 135.34 143.97 0.0 OUTLIER 'General case' 0 C--O 1.234 0.242 0 C-N-CA 130.433 3.493 . . . . 1.71 106.719 -177.442 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -42.61 -41.9 3.23 Favored 'General case' 0 C--O 1.226 -0.179 0 C-N-CA 124.668 1.187 . . . . 0.64000000000000001 111.393 175.485 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 50.2 m-20 -58.94 -57.74 11.73 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 123.616 0.766 . . . . 1.8300000000000001 110.006 -176.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 3.4 mm-40 -62.42 -53.88 48.43 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 109.328 -0.619 . . . . 2.98 109.328 -178.353 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 70.0 t -49.62 -46.2 20.88 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.724 0 CA-C-O 121.664 0.745 . . . . 0.79000000000000004 111.192 177.737 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -63.17 -46.22 88.14 Favored 'General case' 0 N--CA 1.452 -0.37 0 O-C-N 120.61 -1.306 . . . . 3.3599999999999999 111.419 177.927 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -55.69 -52.03 65.27 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 118.191 0.451 . . . . 2.9900000000000002 110.878 175.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.439 HG12 HG22 ' A' ' 3' ' ' ILE . 3.4 m -56.21 -42.94 74.98 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 C-N-CA 120.516 -0.474 . . . . 0.76000000000000001 109.885 177.687 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 25.3 m-85 -60.49 -39.37 87.47 Favored 'General case' 0 C--N 1.342 0.253 0 CA-C-N 119.055 0.843 . . . . 6.5999999999999996 112.35 176.547 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 43.5 mtp180 -58.49 -43.02 88.85 Favored 'General case' 0 C--N 1.339 0.111 0 CA-C-N 119.287 0.949 . . . . 3.6699999999999999 110.918 171.843 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 27.3 t80 -58.98 -44.62 91.59 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 118.197 0.453 . . . . 4.0099999999999998 110.249 177.619 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.632 ' CG2' HD11 ' A' ' 59' ' ' LEU . 1.6 mp -58.68 -49.34 82.98 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 CA-C-O 118.088 -0.958 . . . . 1.6100000000000001 112.061 174.461 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 45.1 t0 -69.91 70.02 0.33 Allowed 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.275 1.03 . . . . 1.79 109.567 -175.259 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 20.3 t30 -61.81 -38.43 88.1 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 126.849 2.06 . . . . 1.8 111.958 -165.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -69.74 -25.48 63.85 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 125.471 1.509 . . . . 2.3199999999999998 111.559 171.76 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 4.9 mt-30 65.2 36.08 7.37 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 125.693 1.597 . . . . 2.79 113.036 -179.703 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 70.9 p -57.8 -31.88 67.0 Favored 'General case' 0 CA--C 1.534 0.341 0 O-C-N 121.373 -0.829 . . . . 1.3300000000000001 112.3 169.421 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 88.51 37.43 7.53 Favored Glycine 0 CA--C 1.526 0.772 0 N-CA-C 109.011 -1.636 . . . . 1.4099999999999999 109.011 -164.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 11.8 m-85 -164.74 135.83 4.18 Favored 'General case' 0 CA--C 1.516 -0.356 0 C-N-CA 125.273 1.429 . . . . 2.6400000000000001 108.796 -177.269 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.632 HD11 ' CG2' ' A' ' 51' ' ' ILE . 1.0 OUTLIER -86.19 78.01 9.45 Favored 'General case' 0 N--CA 1.443 -0.786 0 N-CA-C 107.511 -1.292 . . . . 2.1800000000000002 107.511 167.358 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -69.55 157.66 36.74 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 114.336 -1.302 . . . . 1.6499999999999999 110.199 177.093 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -53.14 -51.51 61.71 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.422 1.089 . . . . 4.5599999999999996 112.969 -168.281 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.9 tm-20 -59.92 -47.89 83.92 Favored 'General case' 0 CA--C 1.531 0.228 0 N-CA-C 109.719 -0.474 . . . . 4.04 109.719 -173.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -56.69 -36.26 69.41 Favored 'General case' 0 C--N 1.332 -0.18 0 C-N-CA 123.399 0.679 . . . . 2.04 111.219 177.611 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 7.0 tp -55.74 -34.68 65.4 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 122.496 0.318 . . . . 2.3399999999999999 110.546 176.719 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 31.1 ttpt -62.73 -10.82 14.07 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.881 1.272 . . . . 2.1499999999999999 112.761 174.252 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -124.85 18.99 8.56 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 126.089 1.756 . . . . 5.0199999999999996 110.561 175.21 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 83.3 t80 -52.2 -70.99 0.07 Allowed 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.391 1.077 . . . . 2.1499999999999999 111.689 -172.797 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.56 -19.24 62.18 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.495 0.718 . . . . 3.3500000000000001 109.53 -176.597 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -71.31 1.52 6.06 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 126.608 1.963 . . . . 2.1299999999999999 113.09 178.459 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.75 -32.06 59.83 Favored 'General case' 0 CA--C 1.529 0.156 0 O-C-N 121.308 -0.87 . . . . 3.1099999999999999 110.496 159.817 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.44 ' CZ ' HD11 ' A' ' 51' ' ' ILE . 4.4 m-30 -93.43 -58.74 2.2 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 124.289 1.036 . . . . 3.3100000000000001 108.845 -174.228 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -96.01 -170.95 2.21 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 124.804 1.242 . . . . 2.9199999999999999 107.898 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 23.8 m -136.35 48.68 2.13 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 123.603 0.761 . . . . 2.3799999999999999 110.271 175.516 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 141.61 60.88 0.03 OUTLIER Glycine 0 C--N 1.336 0.554 0 N-CA-C 109.92 -1.272 . . . . 1.4099999999999999 109.92 -178.594 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -89.17 -98.82 0.09 Allowed 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.038 0.535 . . . . 2.0099999999999998 109.994 179.674 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -144.07 24.53 1.63 Allowed 'General case' 0 CA--C 1.528 0.12 0 CA-C-O 121.682 0.753 . . . . 3.2799999999999998 111.51 -179.396 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 5.2 mp0 -72.29 -36.07 68.85 Favored 'General case' 0 N--CA 1.445 -0.717 0 C-N-CA 125.229 1.412 . . . . 4.6900000000000004 108.7 -172.052 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.497 HD22 ' H ' ' A' ' 78' ' ' LEU . 0.2 OUTLIER -51.77 -56.48 13.6 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 126.305 1.842 . . . . 0.96999999999999997 111.434 178.74 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 58.9 m -59.89 114.44 2.81 Favored 'General case' 0 C--N 1.341 0.231 0 N-CA-C 110.021 -0.363 . . . . 0.89000000000000001 110.021 -173.755 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -64.97 -44.68 88.53 Favored 'General case' 0 N--CA 1.447 -0.609 0 N-CA-C 109.825 -0.435 . . . . 3.3900000000000001 109.825 -176.149 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.5 m -50.9 -59.69 3.86 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 123.815 0.846 . . . . 1.54 110.374 177.058 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.93 -49.38 71.47 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 123.8 0.84 . . . . 2.6000000000000001 110.737 178.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -58.83 -39.19 80.51 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 120.125 -0.63 . . . . 0.90000000000000002 109.594 179.757 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 90.3 mttt -69.42 -27.61 65.42 Favored 'General case' 0 C--O 1.219 -0.51 0 C-N-CA 124.054 0.942 . . . . 4.7400000000000002 111.388 177.81 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 14.6 m -58.36 -46.15 86.85 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 120.183 1.356 . . . . 1.3100000000000001 109.907 169.806 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.3 mp -61.01 -59.79 4.82 Favored 'General case' 0 C--O 1.233 0.226 0 N-CA-C 109.829 -0.434 . . . . 3.04 109.829 170.077 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 29.8 ttp -46.09 -53.8 9.67 Favored 'General case' 0 C--O 1.221 -0.431 0 C-N-CA 123.06 0.544 . . . . 2.73 111.592 -175.209 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -47.41 -64.11 0.87 Allowed 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 127.456 2.302 . . . . 1.0 110.741 -174.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -65.07 -53.11 50.71 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 116.348 -0.387 . . . . 0.68000000000000005 110.037 179.879 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -50.41 -39.29 46.78 Favored 'General case' 0 C--O 1.226 -0.143 0 N-CA-C 111.769 0.285 . . . . 0.51000000000000001 111.769 -176.131 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -72.28 -58.33 3.49 Favored 'General case' 0 N--CA 1.445 -0.719 0 C-N-CA 124.124 0.97 . . . . 2.4199999999999999 110.333 178.843 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 46.31 25.61 0.38 Allowed 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.344 1.458 . . . . 3.04 114.837 -175.039 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 69.2 m-20 -112.23 -45.16 3.31 Favored 'General case' 0 N--CA 1.463 0.192 0 C-N-CA 123.752 0.821 . . . . 1.8500000000000001 109.452 177.178 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 97.68 39.81 3.79 Favored Glycine 0 CA--C 1.53 0.971 0 C-N-CA 125.681 1.61 . . . . 1.24 109.48 -161.792 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -127.39 -47.29 1.45 Allowed 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 118.386 1.093 . . . . 1.77 111.856 174.505 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 109.27 -27.89 11.87 Favored Glycine 0 CA--C 1.527 0.841 0 C-N-CA 124.175 0.893 . . . . 0.72999999999999998 112.347 172.089 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 23.7 mttt -78.9 131.43 36.4 Favored 'General case' 0 C--O 1.241 0.642 0 N-CA-C 107.986 -1.116 . . . . 4.1200000000000001 107.986 174.08 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 10.6 mt -123.8 106.14 16.62 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.457 0 C-N-CA 124.659 1.183 . . . . 1.1200000000000001 108.426 -166.416 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -62.68 161.0 32.45 Favored Glycine 0 CA--C 1.53 0.981 0 N-CA-C 110.159 -1.176 . . . . 0.69999999999999996 110.159 168.082 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -58.88 -37.08 75.75 Favored 'General case' 0 N--CA 1.453 -0.284 0 O-C-N 121.604 -0.939 . . . . 0.95999999999999996 109.81 177.068 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 61.5 mt-10 -66.13 -47.89 72.6 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 122.947 0.499 . . . . 3.79 111.431 -179.594 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -47.88 -53.51 15.52 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 121.853 0.835 . . . . 1.95 109.632 170.495 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -66.92 -44.38 80.89 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 116.113 -0.494 . . . . 3.1899999999999999 111.201 -173.285 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 10.1 tt0 -51.96 -54.38 30.28 Favored 'General case' 0 C--O 1.221 -0.439 0 C-N-CA 125.157 1.383 . . . . 2.7200000000000002 109.515 172.356 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -48.36 -52.42 21.8 Favored 'General case' 0 C--O 1.231 0.097 0 CA-C-N 119.071 0.85 . . . . 4.0 110.212 177.231 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -61.88 -46.26 90.18 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 119.921 -0.712 . . . . 3.1099999999999999 110.879 -176.937 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 44.0 t -59.97 -38.03 74.83 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.23 0 CA-C-O 119.196 -0.431 . . . . 1.46 111.828 175.181 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 2.0 t60 -64.66 -19.79 65.92 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 125.512 1.525 . . . . 2.46 109.997 -171.397 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 34.8 t . . . . . 0 C--O 1.254 1.296 0 CA-C-O 115.077 -2.392 . . . . 2.71 113.148 175.742 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.472 0.644 0 N-CA-C 105.792 -1.929 . . . . 9.2100000000000009 105.792 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 28.2 t -156.62 176.46 12.69 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 106.272 -1.751 . . . . 2.7200000000000002 106.272 172.65 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.65 HG22 HG12 ' A' ' 47' ' ' VAL . 1.3 pp -58.93 -27.32 35.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 C-N-CA 124.527 1.131 . . . . 1.3999999999999999 110.784 -175.398 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.54 ' HA ' ' HB2' ' A' ' 9' ' ' ALA . 0.6 OUTLIER -68.21 -10.76 56.77 Favored 'General case' 0 N--CA 1.439 -0.989 0 C-N-CA 126.082 1.753 . . . . 1.8799999999999999 112.014 179.013 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.0 t0 -135.83 32.5 2.97 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.096 1.359 . . . . 2.5600000000000001 109.948 -174.238 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 11.2 m -125.34 -56.33 2.04 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 N-CA-C 112.576 0.584 . . . . 2.5899999999999999 112.576 172.643 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 22.3 tp -171.55 -59.2 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.135 0 N-CA-C 106.131 -1.803 . . . . 1.4299999999999999 106.131 -172.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 28.5 m -42.06 -35.78 0.98 Allowed 'General case' 0 C--O 1.217 -0.656 0 C-N-CA 125.501 1.52 . . . . 1.22 113.698 -175.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.54 ' HB2' ' HA ' ' A' ' 4' ' ' THR . . . -40.68 -45.63 2.42 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 114.094 1.146 . . . . 0.83999999999999997 114.094 172.245 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -70.9 -43.63 67.94 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 122.261 1.029 . . . . 1.78 109.597 179.352 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -62.83 -46.55 87.38 Favored 'General case' 0 N--CA 1.449 -0.518 0 C-N-CA 123.963 0.905 . . . . 2.5499999999999998 109.966 -175.654 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 35.9 pt -58.94 -41.67 83.76 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.767 0 C-N-CA 123.752 0.821 . . . . 0.96999999999999997 110.354 178.362 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.8 -46.76 84.19 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 110.267 -0.272 . . . . 1.0900000000000001 110.267 176.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.49 -52.28 66.27 Favored 'General case' 0 CA--C 1.529 0.15 0 O-C-N 121.781 -0.574 . . . . 0.91000000000000003 110.715 173.458 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.418 ' HB1' ' CE2' ' A' ' 30' ' ' PHE . . . -53.11 -43.82 67.15 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 124.769 1.227 . . . . 1.03 111.537 -176.259 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -55.36 -43.24 74.91 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 124.225 1.01 . . . . 3.7000000000000002 109.017 176.455 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 21.7 mt-30 -77.23 -39.17 49.45 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-O 119.164 -0.446 . . . . 4.1399999999999997 111.663 -176.513 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.34 -44.58 82.9 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 108.99 -0.744 . . . . 3.3799999999999999 108.99 179.25 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 76.4 m -85.49 41.58 0.9 Allowed 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.219 1.008 . . . . 2.2599999999999998 111.195 175.873 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 15.1 mtt180 -77.69 -55.58 5.23 Favored 'General case' 0 CA--C 1.518 -0.285 0 O-C-N 121.142 -0.974 . . . . 4.9900000000000002 108.605 178.813 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -69.46 140.52 90.0 Favored Pre-proline 0 N--CA 1.448 -0.55 0 CA-C-N 115.83 -0.623 . . . . 2.7200000000000002 109.509 -175.036 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -63.63 142.65 84.66 Favored 'Trans proline' 0 N--CA 1.449 -1.108 0 C-N-CA 122.208 1.939 . . . . 1.24 111.207 -175.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 17.8 t70 57.62 36.92 27.24 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 127.009 2.124 . . . . 3.6200000000000001 112.179 178.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 24.4 m -102.31 -29.57 11.59 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.872 1.269 . . . . 0.81999999999999995 111.281 177.085 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -53.87 125.44 18.64 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 125.688 1.595 . . . . 2.3900000000000001 109.155 -177.488 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -119.64 152.06 52.79 Favored Pre-proline 0 C--O 1.232 0.134 0 C-N-CA 124.686 1.194 . . . . 2.1800000000000002 108.294 172.537 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -64.94 -66.47 0.04 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.217 0 C-N-CA 122.707 2.271 . . . . 0.56000000000000005 110.52 178.428 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 35.0 mt-30 -60.61 -36.53 78.82 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 122.978 0.511 . . . . 2.1699999999999999 111.297 -175.103 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -58.5 -64.85 0.78 Allowed 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 109.316 -0.624 . . . . 5.1600000000000001 109.316 173.108 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.418 ' CE2' ' HB1' ' A' ' 15' ' ' ALA . 55.9 t80 -56.6 -45.55 81.37 Favored 'General case' 0 C--O 1.221 -0.42 0 CA-C-O 121.427 0.632 . . . . 2.1899999999999999 110.593 -174.717 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.404 ' CE1' ' HA ' ' A' ' 107' ' ' VAL . 4.4 t80 -41.29 -57.24 2.19 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 126.784 2.034 . . . . 4.71 111.047 176.422 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 12.0 mt-30 -70.96 -45.36 64.26 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 109.933 -0.395 . . . . 2.96 109.933 178.698 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -55.99 -29.06 59.74 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 123.11 0.564 . . . . 0.71999999999999997 112.439 -179.001 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 14.7 t -88.5 -8.74 54.34 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 126.489 1.916 . . . . 1.4399999999999999 110.429 -175.505 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 81.05 -1.99 82.7 Favored Glycine 0 C--N 1.34 0.795 0 O-C-N 121.322 -0.861 . . . . 0.67000000000000004 111.04 174.047 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.413 ' HB3' HG13 ' A' ' 107' ' ' VAL . 85.0 mt -63.36 -28.85 70.27 Favored 'General case' 0 N--CA 1.441 -0.896 0 C-N-CA 124.737 1.215 . . . . 1.3300000000000001 110.217 -176.246 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 60.4 p -63.02 -35.52 80.5 Favored 'General case' 0 C--N 1.338 0.102 0 C-N-CA 123.711 0.805 . . . . 2.3599999999999999 111.62 171.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 7.5 tttt -82.79 -32.08 27.88 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 108.945 -0.761 . . . . 5.0999999999999996 108.945 -176.158 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 21.5 mtt -57.62 124.66 19.84 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-O 121.088 0.471 . . . . 2.8599999999999999 110.342 174.273 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 6.9 m -61.2 157.09 16.89 Favored 'General case' 0 N--CA 1.452 -0.368 0 O-C-N 121.525 -0.734 . . . . 1.9099999999999999 110.15 172.171 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -43.33 -40.26 3.51 Favored 'General case' 0 C--O 1.225 -0.22 0 C-N-CA 124.031 0.932 . . . . 0.67000000000000004 111.414 175.399 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 49.9 m-20 -47.02 -60.07 2.7 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 124.351 1.061 . . . . 1.8700000000000001 110.381 174.559 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 30.6 mm100 -69.32 -43.56 73.47 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 115.778 -0.646 . . . . 3.25 109.547 -175.696 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 95.2 t -56.91 -45.89 83.6 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 CA-C-N 119.166 0.894 . . . . 0.56000000000000005 110.087 -179.937 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 14.2 tttt -63.03 -43.15 99.49 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 109.598 -0.519 . . . . 3.54 109.598 176.206 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 27.0 t0 -61.75 -54.99 34.94 Favored 'General case' 0 CA--C 1.535 0.38 0 O-C-N 121.947 -0.471 . . . . 2.4500000000000002 110.964 -179.098 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.65 HG12 HG22 ' A' ' 3' ' ' ILE . 15.0 m -55.19 -43.65 71.43 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.202 0 C-N-CA 123.045 0.538 . . . . 0.68999999999999995 110.364 176.694 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -44.8 -48.25 10.95 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 118.679 0.672 . . . . 5.25 111.221 171.733 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 83.6 mtm180 -60.27 -30.91 69.75 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 118.807 0.731 . . . . 6.5 112.479 177.857 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 14.0 m-85 -70.46 -34.59 72.59 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 118.963 0.801 . . . . 3.8199999999999998 111.105 172.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.764 HG22 ' H ' ' A' ' 52' ' ' ASP . 18.0 mm -77.83 -171.82 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.84 0 CA-C-N 118.994 0.816 . . . . 2.3900000000000001 109.692 177.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.764 ' H ' HG22 ' A' ' 51' ' ' ILE . 41.8 t0 75.55 -55.8 0.62 Allowed 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 127.331 2.253 . . . . 4.1100000000000003 110.216 -178.472 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 11.3 t30 96.52 -54.41 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.187 0 C-N-CA 127.935 2.494 . . . . 2.1299999999999999 108.437 -179.787 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -56.06 -35.23 66.72 Favored 'General case' 0 CA--C 1.529 0.14 0 C-N-CA 124.371 1.069 . . . . 2.3700000000000001 111.642 170.937 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 75.8 mt-30 55.8 49.96 15.09 Favored 'General case' 0 CA--C 1.539 0.523 0 N-CA-C 109.19 -0.67 . . . . 4.5499999999999998 109.19 -159.768 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 51.0 p -90.47 -44.25 9.73 Favored 'General case' 0 C--N 1.339 0.13 0 C-N-CA 123.422 0.689 . . . . 2.1200000000000001 110.045 174.508 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 117.44 -37.88 3.16 Favored Glycine 0 C--N 1.336 0.573 0 N-CA-C 111.241 -0.743 . . . . 2.27 111.241 -177.411 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 11.2 m-85 -70.73 110.12 5.35 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 106.453 -1.684 . . . . 2.48 106.453 167.744 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -84.71 81.49 8.85 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 106.117 -1.808 . . . . 1.8799999999999999 106.117 166.034 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -69.65 150.62 46.83 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 114.122 -1.399 . . . . 1.46 109.161 -179.628 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -47.76 -46.5 30.24 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.768 1.227 . . . . 3.8999999999999999 112.112 -171.642 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -57.39 -39.99 77.28 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 123.143 0.577 . . . . 3.6800000000000002 111.089 -178.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -71.54 -28.34 63.81 Favored 'General case' 0 CA--C 1.517 -0.289 0 O-C-N 120.959 -1.088 . . . . 2.3399999999999999 110.399 -178.889 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.27 -30.36 59.96 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 119.285 -0.388 . . . . 2.3300000000000001 110.375 170.137 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 31.5 ttpt -60.71 -9.92 4.63 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.093 0.957 . . . . 1.96 113.222 172.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 30.4 m-85 -132.39 23.12 4.41 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.299 1.039 . . . . 4.9699999999999998 111.244 172.217 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 44.2 t80 -55.02 -65.54 0.56 Allowed 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 118.827 0.739 . . . . 2.48 110.742 -178.624 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 14.3 tp -84.35 -13.65 51.73 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.399 0.68 . . . . 2.4100000000000001 111.598 -176.065 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 83.5 mm-40 -52.56 -57.02 11.31 Favored 'General case' 0 C--N 1.344 0.343 0 N-CA-C 109.006 -0.739 . . . . 2.1299999999999999 109.006 173.719 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.78 42.31 0.37 Allowed 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 112.296 0.48 . . . . 2.3500000000000001 112.296 -179.658 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.598 ' CE1' HD11 ' A' ' 51' ' ' ILE . 0.1 OUTLIER -147.04 -56.87 0.26 Allowed 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 127.384 2.273 . . . . 3.3300000000000001 106.404 -179.258 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -104.8 -46.34 4.34 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.516 1.126 . . . . 3.8900000000000001 111.657 -178.295 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 19.9 m 81.4 109.13 0.07 Allowed 'General case' 0 C--N 1.34 0.182 0 C-N-CA 126.687 1.995 . . . . 3.2400000000000002 110.358 -170.684 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 86.64 40.73 7.11 Favored Glycine 0 CA--C 1.525 0.711 0 N-CA-C 110.594 -1.002 . . . . 1.21 110.594 -179.597 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -85.88 -154.77 0.22 Allowed 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.041 0.937 . . . . 1.3400000000000001 110.886 177.739 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 1.6 tpt85 -102.28 -9.26 20.55 Favored 'General case' 0 N--CA 1.463 0.182 0 C-N-CA 123.524 0.729 . . . . 4.0800000000000001 112.684 -161.744 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -43.89 -39.75 4.12 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 129.253 3.021 . . . . 3.3799999999999999 113.038 -167.004 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.571 HD22 ' H ' ' A' ' 78' ' ' LEU . 0.6 OUTLIER -50.55 -41.48 54.07 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 124.669 1.188 . . . . 1.0800000000000001 111.991 176.128 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 63.7 m -65.33 109.47 2.28 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 108.63 -0.878 . . . . 0.84999999999999998 108.63 171.722 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 16.5 pt-20 -54.95 -46.62 75.03 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-N 115.457 -0.792 . . . . 3.1699999999999999 110.525 176.199 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.1 m -50.13 -58.08 6.31 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 119.457 1.026 . . . . 1.28 112.393 176.912 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -64.82 -40.52 95.34 Favored 'General case' 0 N--CA 1.453 -0.325 0 N-CA-C 109.836 -0.431 . . . . 2.7000000000000002 109.836 -173.402 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -61.85 -44.92 95.86 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 122.515 1.15 . . . . 0.93999999999999995 109.563 174.224 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -62.65 -31.62 72.52 Favored 'General case' 0 N--CA 1.444 -0.743 0 C-N-CA 124.898 1.279 . . . . 7.0999999999999996 109.91 -176.406 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 50.6 m -53.82 -43.21 69.21 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 119.529 1.059 . . . . 1.3100000000000001 111.284 171.087 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 8.0 mt -64.92 -56.61 12.27 Favored 'General case' 0 C--O 1.233 0.228 0 N-CA-C 109.184 -0.673 . . . . 2.1699999999999999 109.184 170.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 7.7 ttm -43.59 -47.55 7.48 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 124.077 0.861 . . . . 3.0699999999999998 112.056 -177.592 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -54.5 -46.86 73.55 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 127.661 2.384 . . . . 0.89000000000000001 112.392 -173.47 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -87.08 -41.53 13.75 Favored 'General case' 0 CA--C 1.522 -0.111 0 CA-C-N 117.821 0.282 . . . . 0.75 110.783 179.18 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -54.83 -46.85 74.66 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 116.554 -0.294 . . . . 0.34999999999999998 110.212 -179.252 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -73.7 77.97 1.54 Allowed 'General case' 0 N--CA 1.447 -0.589 0 CA-C-O 121.625 0.726 . . . . 0.97999999999999998 109.7 178.669 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 51.4 p30 -77.07 41.58 0.29 Allowed 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.61 -0.681 . . . . 2.6499999999999999 111.793 177.794 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 26.4 m-20 -128.14 -59.72 1.17 Allowed 'General case' 0 C--N 1.34 0.158 0 C-N-CA 126.614 1.966 . . . . 1.23 108.527 179.3 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 103.78 45.41 1.52 Allowed Glycine 0 CA--C 1.531 1.083 0 C-N-CA 125.19 1.376 . . . . 0.77000000000000002 110.096 -164.129 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -125.1 -63.89 1.13 Allowed 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.58 1.552 . . . . 1.8799999999999999 110.194 173.754 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 128.08 -30.8 3.82 Favored Glycine 0 CA--C 1.531 1.079 0 C-N-CA 124.885 1.231 . . . . 0.79000000000000004 111.794 -179.915 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 37.9 mttp -73.17 108.4 6.03 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 108.153 -1.055 . . . . 4.46 108.153 169.439 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 18.1 mt -97.6 115.25 36.98 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.353 0 C-N-CA 123.952 0.901 . . . . 0.76000000000000001 108.855 -174.393 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -69.93 164.9 51.34 Favored Glycine 0 CA--C 1.537 1.446 0 CA-C-N 118.73 0.696 . . . . 0.83999999999999997 112.527 172.534 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -59.08 -39.56 82.5 Favored 'General case' 0 N--CA 1.456 -0.163 0 O-C-N 121.518 -0.989 . . . . 1.23 108.525 171.613 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -51.22 -57.94 7.48 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 124.344 1.057 . . . . 4.0700000000000003 111.288 170.216 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -51.13 -48.1 61.86 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.133 0.973 . . . . 1.99 110.406 176.637 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -56.54 -60.3 3.74 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 112.349 0.5 . . . . 3.54 112.349 176.267 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -59.82 -35.69 75.23 Favored 'General case' 0 C--O 1.22 -0.467 0 CA-C-O 118.587 -0.721 . . . . 3.1000000000000001 110.19 -178.286 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 17.8 mm-40 -57.5 -59.86 4.52 Favored 'General case' 0 N--CA 1.456 -0.128 0 CA-C-N 119.686 1.13 . . . . 3.21 109.654 174.068 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -56.14 -50.7 70.38 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-O 121.719 0.771 . . . . 3.8599999999999999 109.119 -177.349 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . 0.413 HG13 ' HB3' ' A' ' 36' ' ' LEU . 96.6 t -72.49 -30.6 34.96 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.761 0 CA-C-N 115.604 -0.726 . . . . 1.49 112.58 -172.528 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 15.2 t60 -95.16 15.36 19.31 Favored 'General case' 0 CA--C 1.532 0.286 0 O-C-N 120.117 -1.614 . . . . 3.4399999999999999 110.952 178.367 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 5.8 t . . . . . 0 C--O 1.253 1.239 0 CA-C-O 116.868 -1.539 . . . . 3.4500000000000002 109.142 179.661 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 94.5 mtp . . . . . 0 N--CA 1.472 0.653 0 N-CA-C 107.595 -1.261 . . . . 10.390000000000001 107.595 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 18.7 t -173.26 48.68 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 124.493 1.117 . . . . 3.7400000000000002 108.17 176.553 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.583 HG22 HG12 ' A' ' 47' ' ' VAL 0.311 0.6 OUTLIER 69.41 -48.35 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.882 0 C-N-CA 126.76 2.024 . . . . 1.5800000000000001 112.858 -177.022 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 5.7 t -38.77 -29.94 0.04 OUTLIER 'General case' 0 N--CA 1.442 -0.83 1 C-N-CA 133.036 4.535 . . . . 1.9299999999999999 115.5 176.59 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 39.5 t0 -145.22 57.25 1.25 Allowed 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 121.822 0.82 . . . . 3.5899999999999999 109.08 170.176 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 97.0 t -116.83 -59.47 3.1 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.17 0 CA-C-N 115.226 -0.897 . . . . 1.75 109.366 173.813 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 13.6 tp -169.67 -60.55 0.02 OUTLIER 'General case' 0 CA--C 1.519 -0.213 0 N-CA-C 106.075 -1.824 . . . . 1.47 106.075 -178.354 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -53.18 -20.42 3.94 Favored 'General case' 0 N--CA 1.446 -0.666 0 C-N-CA 125.507 1.523 . . . . 1.02 113.152 -172.012 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -50.13 -40.97 47.92 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 113.516 0.932 . . . . 0.93999999999999995 113.516 169.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -70.87 -42.45 70.05 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 122.4 1.095 . . . . 1.8500000000000001 109.264 176.013 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -65.29 -44.12 88.97 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 115.489 -0.778 . . . . 2.48 109.659 -172.538 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 36.3 pt -58.67 -39.15 75.37 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.671 0 O-C-N 120.855 -1.153 . . . . 0.77000000000000002 111.066 175.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.63 -43.2 93.92 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 109.689 -0.486 . . . . 0.64000000000000001 109.689 176.394 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.43 -56.66 19.24 Favored 'General case' 0 CA--C 1.535 0.397 0 O-C-N 122.115 -0.366 . . . . 0.51000000000000001 110.419 172.699 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -50.34 -46.79 55.93 Favored 'General case' 0 C--O 1.231 0.116 0 C-N-CA 125.224 1.41 . . . . 0.51000000000000001 111.448 -176.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.1 mt -50.01 -44.88 51.46 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.056 -0.975 . . . . 3.2200000000000002 109.712 178.386 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.38 -46.5 17.48 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 109.763 -0.458 . . . . 4.5099999999999998 109.763 -175.945 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.74 -28.26 66.65 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 121.207 -0.197 . . . . 2.7400000000000002 111.416 -169.867 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 62.5 m -112.78 49.59 0.93 Allowed 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.887 1.275 . . . . 1.3600000000000001 109.054 171.199 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -73.49 -33.65 64.91 Favored 'General case' 0 C--O 1.236 0.351 0 O-C-N 121.25 -0.906 . . . . 5.54 109.716 177.521 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -83.97 141.27 40.57 Favored Pre-proline 0 N--CA 1.449 -0.499 0 C-N-CA 125.456 1.502 . . . . 1.96 109.46 -171.205 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -59.96 148.94 86.85 Favored 'Trans proline' 0 N--CA 1.451 -0.98 0 C-N-CA 122.342 2.028 . . . . 1.21 110.441 -170.879 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 50.81 42.24 27.49 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 126.243 1.817 . . . . 2.6499999999999999 111.333 173.525 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 10.4 m -109.65 -24.49 10.9 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 125.089 1.356 . . . . 1.04 112.869 179.451 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -53.38 112.51 0.91 Allowed 'General case' 0 N--CA 1.445 -0.718 0 C-N-CA 123.417 0.687 . . . . 3.1499999999999999 112.141 -177.04 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -102.78 156.16 35.64 Favored Pre-proline 0 CA--C 1.539 0.531 0 C-N-CA 124.531 1.132 . . . . 2.6299999999999999 109.836 173.663 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_endo -68.4 -78.42 0.01 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.883 0 C-N-CA 123.563 2.842 . . . . 1.0900000000000001 112.187 -176.481 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 46.3 mt-30 -50.1 -43.91 51.78 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.991 0.916 . . . . 2.8799999999999999 110.892 -178.562 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -44.59 -63.55 0.88 Allowed 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 124.266 1.026 . . . . 3.3100000000000001 110.163 169.863 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 5.3 t80 -60.76 -42.47 97.52 Favored 'General case' 0 C--O 1.224 -0.266 0 CA-C-N 118.21 0.459 . . . . 2.1099999999999999 110.915 -179.071 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 8.3 m-30 -56.08 -37.77 69.79 Favored 'General case' 0 CA--C 1.532 0.272 0 O-C-N 121.21 -0.931 . . . . 4.5999999999999996 110.93 -179.242 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 12.6 tt0 -76.31 -53.27 8.44 Favored 'General case' 0 N--CA 1.456 -0.134 0 O-C-N 121.921 -0.487 . . . . 3.0 110.101 174.119 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -66.3 -17.39 64.73 Favored 'General case' 0 N--CA 1.447 -0.608 0 C-N-CA 123.557 0.743 . . . . 0.90000000000000002 112.618 -171.931 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 2.6 t -96.41 -3.82 42.87 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 125.747 1.619 . . . . 1.46 111.154 176.236 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 80.43 -21.78 5.02 Favored Glycine 0 CA--C 1.532 1.144 0 O-C-N 120.662 -1.274 . . . . 0.72999999999999998 112.308 178.673 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -40.75 -48.02 2.94 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 126.968 2.107 . . . . 2.7599999999999998 114.018 178.32 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 43.6 p -68.47 -26.15 65.34 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 118.873 0.761 . . . . 2.02 112.016 -179.731 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 22.2 tttt -78.89 -38.0 38.66 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 107.903 -1.147 . . . . 4.2300000000000004 107.903 178.345 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 9.8 mmt -62.64 139.47 58.64 Favored 'General case' 0 N--CA 1.44 -0.95 0 CA-C-O 121.575 0.703 . . . . 3.7400000000000002 109.541 176.006 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 44.5 p -74.97 162.07 28.92 Favored 'General case' 0 N--CA 1.449 -0.48 0 O-C-N 121.759 -0.588 . . . . 2.02 109.889 -179.164 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -45.7 -35.99 4.61 Favored 'General case' 0 C--O 1.225 -0.223 0 C-N-CA 124.235 1.014 . . . . 0.60999999999999999 112.239 176.738 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -49.9 -60.34 3.01 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 123.331 0.652 . . . . 2.77 110.681 172.334 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 5.8 mm100 -69.38 -42.38 75.23 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-O 119.134 -0.46 . . . . 2.5299999999999998 109.948 -176.776 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 60.7 t -59.55 -38.41 75.22 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-N 119.148 0.885 . . . . 0.60999999999999999 110.051 179.363 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 54.8 tttp -63.62 -48.92 75.35 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 118.719 0.69 . . . . 2.77 110.245 174.079 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -55.65 -57.55 11.51 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 120.626 0.251 . . . . 3.1200000000000001 110.709 -179.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.583 HG12 HG22 ' A' ' 3' ' ' ILE . 5.5 m -57.91 -46.94 87.45 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.214 0 N-CA-C 109.579 -0.526 . . . . 0.53000000000000003 109.579 177.776 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 13.8 t80 -46.15 -48.46 17.39 Favored 'General case' 0 C--O 1.224 -0.285 0 CA-C-O 118.454 -0.784 . . . . 4.0499999999999998 110.663 177.243 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 76.2 mtp180 -54.74 -40.59 69.46 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-N 119.302 0.956 . . . . 3.9100000000000001 111.493 177.169 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -63.78 -41.26 97.98 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 110.242 -0.281 . . . . 3.8399999999999999 110.242 176.487 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.424 HG22 HD11 ' A' ' 59' ' ' LEU . 3.3 mp -65.42 -42.09 92.63 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.687 0 O-C-N 121.623 -0.673 . . . . 1.6599999999999999 110.716 176.396 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 54.3 t0 -75.76 63.09 1.59 Allowed 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 124.933 1.293 . . . . 1.95 110.073 179.311 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -47.11 144.11 2.79 Favored 'General case' 0 C--O 1.232 0.175 0 N-CA-C 107.715 -1.217 . . . . 3.6400000000000001 107.715 168.008 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 75.91 -33.82 0.23 Allowed 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 125.048 1.339 . . . . 3.3999999999999999 112.209 -173.86 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 56.75 41.08 28.71 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 124.7 1.2 . . . . 4.5899999999999999 111.532 -175.275 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 11.8 p -48.22 -32.15 6.75 Favored 'General case' 0 C--N 1.341 0.238 0 C-N-CA 126.36 1.864 . . . . 2.1299999999999999 112.196 176.02 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 113.34 -17.79 21.22 Favored Glycine 0 CA--C 1.525 0.673 0 N-CA-C 109.365 -1.494 . . . . 1.8700000000000001 109.365 -164.229 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 84.7 m-85 -135.39 159.44 41.57 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-O 123.041 1.4 . . . . 2.1400000000000001 112.005 179.727 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.424 HD11 HG22 ' A' ' 51' ' ' ILE . 3.5 mm? -98.21 73.8 2.2 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 105.426 -2.064 . . . . 1.8899999999999999 105.426 164.731 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -55.17 146.22 19.27 Favored 'General case' 0 CA--C 1.545 0.765 0 CA-C-N 113.807 -1.542 . . . . 1.6100000000000001 108.815 172.376 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -50.15 -54.45 20.67 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 113.952 1.093 . . . . 3.3399999999999999 113.952 -160.937 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 64.5 mt-10 -55.34 -31.69 61.92 Favored 'General case' 0 CA--C 1.535 0.368 0 O-C-N 121.589 -0.695 . . . . 3.5899999999999999 111.982 177.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -71.14 -43.09 68.24 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 123.149 0.58 . . . . 2.3199999999999998 109.614 176.767 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -51.6 -36.01 43.87 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.471 1.108 . . . . 2.6099999999999999 110.398 173.225 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 10.8 ttmt -46.82 -60.84 2.16 Favored 'General case' 0 N--CA 1.464 0.272 0 O-C-N 121.879 -0.513 . . . . 2.6699999999999999 110.309 169.752 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -73.38 60.48 0.62 Allowed 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.91 0.884 . . . . 4.6200000000000001 109.981 177.62 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -89.03 -69.38 0.71 Allowed 'General case' 0 C--N 1.331 -0.223 0 O-C-N 120.533 -1.354 . . . . 2.9300000000000002 108.193 175.592 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 5.8 mp -68.18 -26.24 65.64 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 122.718 0.407 . . . . 3.3599999999999999 111.368 -173.424 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -72.95 0.61 10.74 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 123.999 0.92 . . . . 3.5499999999999998 113.132 -176.25 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 7.1 mptt -70.83 -32.2 69.18 Favored 'General case' 0 N--CA 1.455 -0.215 0 O-C-N 121.405 -0.809 . . . . 4.21 109.823 161.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -92.4 -58.17 2.46 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 123.335 0.654 . . . . 3.27 109.322 -172.087 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -98.31 175.97 5.87 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 123.597 0.759 . . . . 3.04 109.095 -178.055 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 15.9 p -109.51 -9.68 14.9 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 124.01 0.924 . . . . 2.5099999999999998 112.29 171.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -137.95 41.27 1.39 Allowed Glycine 0 CA--C 1.527 0.802 0 N-CA-C 111.079 -0.809 . . . . 1.1899999999999999 111.079 179.852 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -83.67 -177.5 6.72 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-O 121.948 0.88 . . . . 1.5900000000000001 111.422 176.544 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 2.2 tpt180 -89.04 24.2 2.18 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.121 1.369 . . . . 3.0800000000000001 113.409 -162.596 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -53.52 -55.58 24.28 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-O 122.54 1.162 . . . . 6.7400000000000002 111.344 -176.006 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.408 HD22 ' H ' ' A' ' 78' ' ' LEU . 0.4 OUTLIER -49.85 -35.53 23.56 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 126.87 2.068 . . . . 1.46 112.678 -177.857 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 19.3 m -70.68 102.4 2.28 Favored 'General case' 0 CA--C 1.514 -0.41 0 C-N-CA 118.558 -1.257 . . . . 0.88 109.172 176.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -62.24 -40.15 95.21 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 113.153 -1.839 . . . . 3.4399999999999999 109.371 -177.559 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 18.4 m -49.73 -51.82 36.06 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 120.391 1.45 . . . . 1.27 112.585 171.671 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -69.93 -46.78 64.62 Favored 'General case' 0 C--O 1.234 0.261 0 N-CA-C 108.903 -0.777 . . . . 2.6499999999999999 108.903 -172.216 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -54.1 -48.88 70.24 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-O 122.059 0.933 . . . . 0.78000000000000003 109.362 174.852 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 8.0 tmtt? -74.3 -29.61 61.71 Favored 'General case' 0 N--CA 1.442 -0.829 0 C-N-CA 124.869 1.268 . . . . 5.4900000000000002 110.245 -170.707 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 23.2 t -57.57 -51.12 70.78 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 119.232 0.924 . . . . 1.6799999999999999 108.642 170.317 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -60.39 -51.66 68.53 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-O 119.296 -0.383 . . . . 3.7599999999999998 110.125 176.25 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 37.1 ttp -50.19 -44.33 52.94 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 117.798 0.272 . . . . 2.4300000000000002 111.675 175.712 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -55.3 -45.49 76.25 Favored 'General case' 0 C--O 1.226 -0.172 0 C-N-CA 125.117 1.367 . . . . 0.53000000000000003 111.226 -171.577 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -88.46 -43.99 11.05 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 116.345 -0.389 . . . . 0.54000000000000004 110.702 -178.331 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -54.95 -41.94 71.71 Favored 'General case' 0 C--N 1.339 0.142 0 CA-C-N 117.809 0.277 . . . . 0.46999999999999997 110.694 178.722 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -74.39 104.34 5.09 Favored 'General case' 0 N--CA 1.442 -0.841 0 N-CA-C 108.264 -1.013 . . . . 1.21 108.264 175.145 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 24.1 p30 -99.1 5.87 46.76 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-O 119.525 -0.274 . . . . 2.8700000000000001 111.599 -177.832 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 45.7 m-20 -79.88 -52.22 8.15 Favored 'General case' 0 C--N 1.341 0.198 0 N-CA-C 108.944 -0.761 . . . . 1.3999999999999999 108.944 167.472 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 91.64 44.75 4.17 Favored Glycine 0 CA--C 1.529 0.929 0 N-CA-C 109.275 -1.53 . . . . 0.82999999999999996 109.275 -157.875 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -126.26 -48.66 1.57 Allowed 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 124.641 1.176 . . . . 2.46 110.533 177.47 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 126.52 -46.1 1.11 Allowed Glycine 0 C--N 1.337 0.585 0 C-N-CA 124.606 1.098 . . . . 0.75 110.372 171.111 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -60.12 114.89 3.1 Favored 'General case' 0 C--O 1.237 0.446 0 N-CA-C 108.915 -0.772 . . . . 3.6200000000000001 108.915 174.099 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 7.2 mt -97.94 153.71 3.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 C-N-CA 124.781 1.233 . . . . 0.77000000000000002 108.693 177.919 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -126.62 178.85 16.6 Favored Glycine 0 CA--C 1.526 0.747 0 N-CA-C 109.062 -1.615 . . . . 1.02 109.062 174.398 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -61.41 -47.25 86.63 Favored 'General case' 0 CA--C 1.516 -0.335 0 O-C-N 122.437 -0.449 . . . . 1.04 109.822 -175.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -55.33 -68.27 0.21 Allowed 'General case' 0 N--CA 1.447 -0.588 0 O-C-N 124.573 1.171 . . . . 3.6800000000000002 109.179 176.043 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -38.28 -49.72 1.41 Allowed 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.82 0.848 . . . . 1.3999999999999999 112.153 176.871 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 63.0 t80 -61.69 -56.76 16.21 Favored 'General case' 0 CA--C 1.537 0.451 0 O-C-N 122.399 -0.188 . . . . 3.5899999999999999 111.111 179.652 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 33.4 tp60 -57.55 -47.55 81.74 Favored 'General case' 0 C--O 1.218 -0.6 0 CA-C-O 117.281 -1.342 . . . . 5.0300000000000002 110.727 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -44.95 -56.59 4.45 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 120.793 1.633 . . . . 3.79 110.528 176.286 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -64.57 -47.55 78.28 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 120.18 -0.608 . . . . 3.6800000000000002 110.465 -177.301 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 42.8 t -56.22 -35.42 42.41 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.462 0 C-N-CA 123.058 0.543 . . . . 1.3600000000000001 112.379 176.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 52.3 t60 -73.38 -22.08 60.35 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 125.958 1.703 . . . . 2.6200000000000001 110.934 -174.395 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 23.2 t . . . . . 0 C--O 1.253 1.285 0 CA-C-O 115.066 -2.397 . . . . 2.6299999999999999 112.866 -176.181 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.8 ptt? . . . . . 0 N--CA 1.48 1.051 0 N-CA-C 111.353 0.131 . . . . 9.7899999999999991 111.353 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 58.8 m -156.77 -91.25 0.03 OUTLIER 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 106.787 -1.56 . . . . 2.7799999999999998 106.787 173.81 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.574 HG22 HG12 ' A' ' 47' ' ' VAL . 1.2 pp -76.93 -32.1 19.49 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 CA-C-O 121.306 0.574 . . . . 1.3100000000000001 111.349 -171.789 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -60.76 -29.4 69.39 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 123.731 0.813 . . . . 1.8600000000000001 111.684 -175.189 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 48.0 t0 -122.18 55.84 1.12 Allowed 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 107.937 -1.134 . . . . 2.5499999999999998 107.937 -176.531 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -135.72 -52.67 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.222 0 CA-C-N 115.739 -0.664 . . . . 1.97 111.498 176.345 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 179.85 -60.8 0.01 OUTLIER 'General case' 0 N--CA 1.456 -0.135 0 N-CA-C 106.368 -1.716 . . . . 1.03 106.368 -173.386 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 25.5 m -49.94 -17.5 0.39 Allowed 'General case' 0 C--O 1.219 -0.53 0 N-CA-C 115.659 1.726 . . . . 2.02 115.659 -169.36 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -49.33 -46.13 46.4 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 121.157 1.799 . . . . 0.71999999999999997 112.151 168.381 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -66.17 -42.47 88.91 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 122.534 1.159 . . . . 2.0800000000000001 109.845 179.0 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -69.1 -41.08 77.93 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 115.341 -0.845 . . . . 2.71 109.247 -172.454 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 29.0 pt -63.52 -39.76 86.51 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.748 0 O-C-N 120.477 -1.39 . . . . 0.78000000000000003 110.78 173.37 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.57 -45.38 77.35 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 118.784 0.72 . . . . 0.68999999999999995 110.19 174.289 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -55.91 -57.34 12.5 Favored 'General case' 0 CA--C 1.531 0.241 0 O-C-N 122.18 -0.325 . . . . 0.63 110.975 171.131 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -48.45 -48.22 37.73 Favored 'General case' 0 C--O 1.231 0.098 0 C-N-CA 124.101 0.96 . . . . 0.59999999999999998 111.394 -177.421 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -52.23 -41.85 63.11 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 125.219 1.408 . . . . 2.8100000000000001 109.741 -177.925 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 38.4 tt0 -87.61 -49.36 7.22 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 117.747 0.248 . . . . 3.6000000000000001 110.835 -176.466 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 24.7 tp10 -47.49 -49.75 24.94 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 125.203 1.401 . . . . 3.7000000000000002 110.301 178.214 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 79.3 m -111.02 55.81 0.65 Allowed 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 108.007 -1.108 . . . . 1.52 108.007 178.169 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 71.2 ttt180 -77.95 -55.0 5.66 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 119.73 1.15 . . . . 4.2199999999999998 108.695 178.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -52.12 140.21 32.89 Favored Pre-proline 0 N--CA 1.446 -0.652 0 C-N-CA 124.795 1.238 . . . . 2.29 110.922 -178.163 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -57.8 151.53 55.68 Favored 'Trans proline' 0 N--CA 1.453 -0.873 0 C-N-CA 123.377 2.718 . . . . 1.21 110.441 -176.075 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 13.2 t70 69.52 -22.66 0.15 Allowed 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 127.472 2.309 . . . . 3.5299999999999998 114.941 -179.801 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 2.0 m -73.88 24.37 0.08 Allowed 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.837 1.655 . . . . 1.0900000000000001 113.439 -164.497 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -105.29 80.59 1.61 Allowed 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 119.374 0.988 . . . . 3.5 111.037 -163.385 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -71.0 145.04 91.04 Favored Pre-proline 0 C--O 1.234 0.26 0 C-N-CA 123.174 0.59 . . . . 2.9900000000000002 110.451 -177.597 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -66.01 -65.69 0.04 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.347 0 C-N-CA 122.193 1.928 . . . . 0.75 111.151 179.768 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.73 -42.14 67.79 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 123.829 0.851 . . . . 3.0699999999999998 110.822 -176.533 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 6.4 ttpt -58.74 -59.87 4.72 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 119.228 -0.415 . . . . 3.6699999999999999 109.955 174.678 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 11.3 t80 -53.76 -49.71 67.6 Favored 'General case' 0 C--O 1.224 -0.241 0 CA-C-N 118.261 0.482 . . . . 2.02 110.289 -176.632 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -41.32 -56.25 2.5 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 126.764 2.026 . . . . 4.7699999999999996 111.889 174.599 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 22.5 tt0 -68.58 -50.54 50.95 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 109.04 -0.726 . . . . 2.8999999999999999 109.04 -179.655 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -64.75 -20.63 66.46 Favored 'General case' 0 N--CA 1.441 -0.898 0 C-N-CA 124.207 1.003 . . . . 0.69999999999999996 112.265 -171.366 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 67.6 p -89.08 -9.19 52.07 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.482 1.513 . . . . 2.21 112.004 177.007 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 83.17 6.19 88.29 Favored Glycine 0 C--N 1.337 0.591 0 N-CA-C 111.558 -0.617 . . . . 0.68999999999999995 111.558 172.803 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 83.0 mt -66.94 -28.96 68.72 Favored 'General case' 0 N--CA 1.443 -0.802 0 O-C-N 122.182 -0.599 . . . . 1.24 109.998 179.173 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 19.5 p -58.5 -38.11 76.96 Favored 'General case' 0 N--CA 1.464 0.243 0 C-N-CA 123.395 0.678 . . . . 2.6499999999999999 111.912 165.85 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -83.66 -26.72 29.62 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 125.321 1.448 . . . . 5.9900000000000002 108.991 -166.93 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 18.2 mtt -54.26 -65.03 0.64 Allowed 'General case' 0 N--CA 1.447 -0.624 0 N-CA-C 113.85 1.056 . . . . 3.52 113.85 -177.306 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 30.8 t 117.27 147.22 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 129.031 2.933 . . . . 1.8500000000000001 108.352 -168.397 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -42.47 -37.79 1.72 Allowed 'General case' 0 C--N 1.34 0.155 0 C-N-CA 123.826 0.85 . . . . 0.57999999999999996 111.644 169.825 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 73.8 m-20 -59.5 -63.12 1.42 Allowed 'General case' 0 CA--C 1.529 0.16 0 CA-C-O 121.683 0.754 . . . . 1.8200000000000001 109.502 -178.796 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 20.8 mm100 -60.7 -40.3 91.72 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 115.755 -0.657 . . . . 3.02 110.479 -179.241 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 97.1 t -62.77 -42.54 96.63 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 CA-C-N 118.548 0.613 . . . . 0.65000000000000002 109.879 -179.762 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 21.7 ttmm -59.74 -41.47 90.99 Favored 'General case' 0 CA--C 1.533 0.299 0 O-C-N 121.426 -0.796 . . . . 3.1000000000000001 110.064 174.063 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -59.49 -58.89 6.61 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 117.729 0.24 . . . . 3.0600000000000001 111.135 174.989 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.574 HG12 HG22 ' A' ' 3' ' ' ILE . 4.1 m -56.6 -40.78 71.09 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 O-C-N 121.631 -0.668 . . . . 0.68000000000000005 110.955 -177.631 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 5.9 t80 -44.11 -44.8 7.83 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.942 0.897 . . . . 5.0899999999999999 111.884 172.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.54 -38.49 77.9 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 118.816 0.735 . . . . 4.5099999999999998 110.868 178.253 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -72.41 -34.54 67.94 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.027 0.531 . . . . 3.5699999999999998 110.173 178.221 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 5.1 mm -65.61 -54.45 27.97 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.166 0 C-N-CA 122.742 0.417 . . . . 1.8 110.325 177.753 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -75.85 67.45 2.25 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 108.478 -0.934 . . . . 2.0 108.478 -178.594 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 5.4 t30 -50.64 -40.36 52.95 Favored 'General case' 0 C--N 1.333 -0.14 0 C-N-CA 126.6 1.96 . . . . 1.9199999999999999 111.99 -172.821 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -78.79 -22.65 46.02 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 126.781 2.032 . . . . 2.3300000000000001 112.348 178.394 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 7.5 mt-30 62.4 31.53 17.19 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 126.183 1.793 . . . . 3.0600000000000001 113.473 -177.783 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 97.0 p -60.29 -35.85 76.51 Favored 'General case' 0 C--N 1.339 0.135 0 O-C-N 120.907 -1.121 . . . . 1.4099999999999999 111.236 167.555 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 88.61 -4.3 85.1 Favored Glycine 0 CA--C 1.531 1.085 0 CA-C-O 119.128 -0.818 . . . . 1.3200000000000001 111.787 -167.6 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 46.1 m-85 -109.77 140.94 43.09 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 124.012 0.925 . . . . 2.71 109.084 168.764 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.3 mt -118.23 76.61 1.09 Allowed 'General case' 0 N--CA 1.44 -0.934 0 C-N-CA 127.649 2.38 . . . . 2.7200000000000002 106.949 177.091 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -66.06 157.35 31.26 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 126.272 1.829 . . . . 2.7000000000000002 111.203 170.549 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -52.15 -44.02 64.35 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 123.524 0.73 . . . . 3.7599999999999998 112.813 -176.297 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -59.59 -37.01 77.4 Favored 'General case' 0 CA--C 1.535 0.386 0 O-C-N 121.537 -0.727 . . . . 3.4700000000000002 111.971 176.753 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 64.6 mt-10 -66.09 -42.87 88.74 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 118.922 0.783 . . . . 2.0 109.901 172.022 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 8.9 mp -57.01 -31.64 65.32 Favored 'General case' 0 CA--C 1.533 0.305 0 O-C-N 121.523 -0.736 . . . . 2.73 111.207 173.816 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 14.4 ttpt -73.62 0.73 11.86 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 113.046 0.758 . . . . 2.8999999999999999 113.046 175.808 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 66.7 t80 -150.91 68.88 0.95 Allowed 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 107.97 -1.122 . . . . 5.2000000000000002 107.97 167.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -117.01 -61.33 1.73 Allowed 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 128.529 2.732 . . . . 2.1600000000000001 108.463 -177.806 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -65.95 -21.4 66.42 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 123.858 0.863 . . . . 3.5 111.488 -178.182 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 77.8 mm-40 -62.58 -10.3 11.68 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 119.615 1.098 . . . . 2.2400000000000002 111.688 177.775 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.6 mptp? -67.98 -46.57 70.97 Favored 'General case' 0 C--N 1.342 0.247 0 O-C-N 120.51 -1.369 . . . . 2.8500000000000001 110.395 165.218 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 8.3 m-30 -74.37 -42.64 58.98 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 123.503 0.721 . . . . 3.0699999999999998 110.535 -169.239 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -142.73 -178.17 5.67 Favored 'General case' 0 C--O 1.226 -0.177 0 C-N-CA 124.561 1.145 . . . . 4.75 108.601 -176.704 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 10.2 m -116.92 22.7 12.42 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 123.079 0.552 . . . . 2.21 111.957 -178.111 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -168.19 45.3 0.23 Allowed Glycine 0 C--N 1.336 0.536 0 N-CA-C 111.157 -0.777 . . . . 1.03 111.157 -177.579 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.426 ' HB3' ' OE2' ' A' ' 77' ' ' GLU . . . -76.67 -150.27 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 121.292 0.568 . . . . 1.3700000000000001 111.073 -179.463 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -115.74 -6.77 12.13 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 123.997 0.919 . . . . 3.1299999999999999 112.801 -174.729 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.426 ' OE2' ' HB3' ' A' ' 75' ' ' ALA . 1.0 OUTLIER -49.18 -33.92 13.4 Favored 'General case' 0 C--O 1.226 -0.181 0 N-CA-C 113.348 0.869 . . . . 4.0599999999999996 113.348 -175.407 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.449 HD22 ' H ' ' A' ' 78' ' ' LEU . 0.2 OUTLIER -39.26 -53.02 1.96 Allowed 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 125.307 1.443 . . . . 0.95999999999999996 111.168 169.503 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 6.0 m -77.95 120.61 23.04 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-O 122.706 1.241 . . . . 1.1299999999999999 110.752 -176.375 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 56.4 mp0 -66.85 -33.42 75.57 Favored 'General case' 0 N--CA 1.441 -0.899 0 CA-C-N 114.025 -1.443 . . . . 3.9199999999999999 111.25 -174.967 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 5.9 t -57.75 -59.08 5.76 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 119.644 1.111 . . . . 1.8400000000000001 110.891 178.761 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 15.5 mp0 -56.28 -45.59 80.1 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 123.621 0.768 . . . . 3.4500000000000002 111.217 177.273 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -55.36 -48.67 73.91 Favored 'General case' 0 N--CA 1.457 -0.096 0 N-CA-C 109.298 -0.63 . . . . 0.58999999999999997 109.298 176.861 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 7.8 tmtt? -67.8 -32.79 73.6 Favored 'General case' 0 N--CA 1.443 -0.803 0 C-N-CA 123.661 0.785 . . . . 5.7300000000000004 110.611 -174.71 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 20.3 m -58.08 -44.83 87.8 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 124.025 0.93 . . . . 1.47 110.183 171.223 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -63.32 -54.99 28.33 Favored 'General case' 0 C--O 1.236 0.374 0 O-C-N 122.065 -0.397 . . . . 3.46 110.646 172.43 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 3.7 ttp -45.62 -45.14 13.66 Favored 'General case' 0 C--O 1.223 -0.332 0 C-N-CA 123.361 0.664 . . . . 3.5 111.486 177.458 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -55.58 -44.77 77.23 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 125.646 1.578 . . . . 0.71999999999999997 112.058 -173.405 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -84.8 -43.03 14.58 Favored 'General case' 0 N--CA 1.461 0.088 0 CA-C-O 120.626 0.25 . . . . 0.80000000000000004 110.822 179.405 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -58.3 -42.33 86.41 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 123.027 0.531 . . . . 0.45000000000000001 111.07 -178.404 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -74.34 87.0 2.0 Allowed 'General case' 0 N--CA 1.445 -0.714 0 N-CA-C 109.131 -0.692 . . . . 0.83999999999999997 109.131 178.497 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 9.3 m-80 -82.2 39.8 0.6 Allowed 'General case' 0 CA--C 1.535 0.379 0 O-C-N 121.18 -0.95 . . . . 3.2200000000000002 109.99 -177.233 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 45.8 m-20 -127.98 -58.23 1.22 Allowed 'General case' 0 C--N 1.339 0.119 0 C-N-CA 124.829 1.252 . . . . 1.3700000000000001 109.039 -178.146 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 100.78 44.98 2.0 Allowed Glycine 0 CA--C 1.53 1.028 0 N-CA-C 109.61 -1.396 . . . . 0.90000000000000002 109.61 -162.197 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -127.54 -51.9 1.37 Allowed 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.669 1.188 . . . . 1.9399999999999999 110.041 174.872 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 124.17 -36.73 2.86 Favored Glycine 0 CA--C 1.525 0.699 0 C-N-CA 124.527 1.06 . . . . 0.68000000000000005 111.543 175.224 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 51.7 mttm -70.29 116.28 10.46 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 107.806 -1.183 . . . . 4.7300000000000004 107.806 175.608 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 4.0 mt -89.18 166.4 1.86 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.334 0 N-CA-C 107.459 -1.312 . . . . 1.3899999999999999 107.459 173.71 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -144.58 178.79 22.24 Favored Glycine 0 N--CA 1.446 -0.663 0 N-CA-C 107.177 -2.369 . . . . 0.87 107.177 172.08 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -55.01 -46.04 75.17 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 109.62 -0.511 . . . . 0.81999999999999995 109.62 -176.575 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 22.9 tt0 -58.86 -63.25 1.37 Allowed 'General case' 0 N--CA 1.444 -0.766 0 O-C-N 124.24 0.962 . . . . 2.4900000000000002 109.538 -176.613 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -46.21 -47.54 17.82 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 123.455 0.702 . . . . 1.27 112.205 174.971 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -61.61 -53.76 51.91 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-O 121.405 0.621 . . . . 2.9100000000000001 109.858 -176.771 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -62.28 -32.64 73.38 Favored 'General case' 0 C--O 1.218 -0.594 0 C-N-CA 124.066 0.947 . . . . 2.5499999999999998 110.717 178.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 30.5 mm-40 -64.22 -54.02 39.97 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-N 120.07 1.304 . . . . 3.48 109.931 175.646 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.05 -52.6 62.68 Favored 'General case' 0 CA--C 1.531 0.237 0 N-CA-C 108.029 -1.101 . . . . 2.9900000000000002 108.029 -179.938 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 71.7 t -70.0 -34.07 58.12 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.607 0 CA-C-N 115.594 -0.73 . . . . 1.1699999999999999 112.821 -174.19 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 6.7 t-80 -86.66 8.12 23.71 Favored 'General case' 0 CA--C 1.534 0.356 0 O-C-N 119.734 -1.853 . . . . 3.3399999999999999 111.269 -178.037 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 32.2 t . . . . . 0 C--O 1.254 1.311 0 CA-C-O 115.518 -2.182 . . . . 2.3900000000000001 111.386 178.55 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.0 mmt . . . . . 0 N--CA 1.471 0.583 0 N-CA-C 108.819 -0.808 . . . . 6.25 108.819 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.8 m -147.62 174.23 11.96 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 106.154 -1.795 . . . . 3.9399999999999999 106.154 177.369 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.614 HG22 HG12 ' A' ' 47' ' ' VAL . 0.2 OUTLIER -49.89 -28.11 4.02 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.404 0 C-N-CA 125.153 1.381 . . . . 1.51 112.899 177.404 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -44.06 -50.27 8.49 Favored 'General case' 0 N--CA 1.442 -0.84 0 C-N-CA 125.697 1.599 . . . . 2.3399999999999999 110.106 170.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -86.02 46.41 1.32 Allowed 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.462 1.105 . . . . 3.3799999999999999 110.418 -173.273 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 25.3 t -142.01 -58.96 0.21 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.1 0 C-N-CA 123.905 0.882 . . . . 1.52 108.936 177.248 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 9.8 tp -171.41 -51.82 0.02 OUTLIER 'General case' 0 C--O 1.232 0.159 0 N-CA-C 106.943 -1.502 . . . . 1.25 106.943 -174.201 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 18.7 m -48.67 -21.14 0.55 Allowed 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 116.052 1.871 . . . . 1.02 116.052 -166.527 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -50.47 -49.09 56.15 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 120.286 1.403 . . . . 0.68999999999999995 111.46 171.461 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -65.45 -42.94 91.81 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-O 122.086 0.946 . . . . 1.8400000000000001 109.596 -177.694 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 27.7 m-20 -62.06 -51.1 69.34 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 115.187 -0.915 . . . . 2.5299999999999998 109.046 -176.889 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 16.9 pt -63.27 -39.58 85.79 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.916 0 O-C-N 121.683 -0.636 . . . . 0.81000000000000005 111.601 178.661 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -54.66 -44.94 73.73 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 118.356 0.525 . . . . 0.56000000000000005 110.774 173.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.41 -56.61 16.57 Favored 'General case' 0 CA--C 1.535 0.378 0 O-C-N 122.014 -0.429 . . . . 0.60999999999999999 110.855 173.485 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.534 ' HB1' ' CE2' ' A' ' 30' ' ' PHE . . . -47.59 -48.35 28.18 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 125.89 1.676 . . . . 0.56000000000000005 111.369 -177.052 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 14.3 tp -50.21 -42.29 51.31 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 126.166 1.786 . . . . 2.3900000000000001 110.532 177.868 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 4.9 tm0? -86.44 -45.52 11.07 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 123.884 0.874 . . . . 3.5899999999999999 109.163 -171.176 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -61.79 -44.44 96.87 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 120.737 0.303 . . . . 3.4500000000000002 110.421 -178.804 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 69.5 m -104.83 67.16 0.79 Allowed 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 107.153 -1.425 . . . . 1.48 107.153 175.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 19.2 ttt-85 -102.89 -2.8 27.19 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 119.473 1.033 . . . . 5.2699999999999996 113.27 178.545 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -103.11 155.18 36.97 Favored Pre-proline 0 CA--C 1.533 0.322 0 C-N-CA 124.277 1.031 . . . . 2.2799999999999998 110.626 -173.577 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -66.07 126.88 16.56 Favored 'Trans proline' 0 N--CA 1.453 -0.876 0 C-N-CA 122.423 2.082 . . . . 1.4099999999999999 111.121 -176.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 42.6 m-20 63.19 53.28 2.29 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 127.907 2.483 . . . . 2.5099999999999998 110.107 175.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.5 m -118.73 -18.44 8.96 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 124.326 1.05 . . . . 0.76000000000000001 112.828 179.738 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 19.4 t80 -60.74 106.05 0.52 Allowed 'General case' 0 N--CA 1.446 -0.655 0 C-N-CA 124.326 1.05 . . . . 3.1600000000000001 109.856 -174.686 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -86.99 142.78 34.22 Favored Pre-proline 0 CA--C 1.534 0.354 0 N-CA-C 108.572 -0.899 . . . . 2.6899999999999999 108.572 165.637 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -65.34 -67.97 0.04 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.107 0 C-N-CA 123.169 2.579 . . . . 0.57999999999999996 110.476 -179.337 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 40.5 mt-30 -55.39 -41.86 73.22 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.302 0.641 . . . . 2.27 110.73 -176.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 12.4 tptp -51.87 -69.71 0.11 Allowed 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 109.629 -0.508 . . . . 3.2999999999999998 109.629 172.716 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.534 ' CE2' ' HB1' ' A' ' 15' ' ' ALA . 40.2 t80 -55.72 -37.09 67.95 Favored 'General case' 0 C--O 1.221 -0.44 0 C-N-CA 123.329 0.652 . . . . 2.8900000000000001 111.043 -173.967 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.49 ' CE1' ' HA ' ' A' ' 107' ' ' VAL . 0.7 OUTLIER -55.82 -59.14 5.3 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 126.138 1.775 . . . . 4.6699999999999999 110.297 177.459 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 42.1 mt-30 -61.1 -44.24 97.65 Favored 'General case' 0 CA--C 1.517 -0.312 0 N-CA-C 108.697 -0.853 . . . . 3.0299999999999998 108.697 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -65.21 -30.56 71.46 Favored 'General case' 0 N--CA 1.434 -1.274 0 N-CA-C 113.094 0.776 . . . . 0.76000000000000001 113.094 -175.228 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 34.9 t -74.54 -0.73 18.61 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 123.712 0.805 . . . . 1.6599999999999999 109.773 174.559 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 75.32 5.45 77.19 Favored Glycine 0 C--N 1.339 0.743 0 N-CA-C 111.039 -0.824 . . . . 0.67000000000000004 111.039 178.381 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.484 HD21 HG21 ' A' ' 47' ' ' VAL . 5.0 mt -70.45 -25.12 63.04 Favored 'General case' 0 N--CA 1.447 -0.618 0 O-C-N 121.387 -1.067 . . . . 2.0299999999999998 110.822 -170.7 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.442 ' HB3' ' CZ ' ' A' ' 31' ' ' PHE . 25.4 p -65.72 -27.96 68.71 Favored 'General case' 0 CA--C 1.529 0.139 0 C-N-CA 123.644 0.778 . . . . 2.3500000000000001 110.775 171.413 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 12.5 tptt -86.86 -33.64 19.73 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 108.428 -0.952 . . . . 3.8399999999999999 108.428 -178.582 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 30.0 mtt -58.54 131.39 50.62 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 118.789 -1.164 . . . . 2.8599999999999999 111.044 172.63 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 82.2 p -70.6 158.15 36.68 Favored 'General case' 0 CA--C 1.533 0.298 0 O-C-N 121.675 -0.64 . . . . 2.6000000000000001 110.11 178.29 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -43.59 -36.84 2.26 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.78 1.232 . . . . 0.78000000000000003 113.082 177.337 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 9.3 m-80 -56.56 -61.8 2.17 Favored 'General case' 0 CA--C 1.527 0.091 0 C-N-CA 124.128 0.971 . . . . 1.5800000000000001 109.21 175.045 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 23.5 mm100 -59.54 -45.61 91.29 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 115.804 -0.634 . . . . 2.8799999999999999 110.076 -179.506 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.519 HG13 HG11 ' A' ' 107' ' ' VAL . 73.1 t -57.13 -46.15 84.51 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 CA-C-N 118.975 0.807 . . . . 0.69999999999999996 110.0 -177.452 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 3.2 ttpm? -72.59 -29.64 63.69 Favored 'General case' 0 N--CA 1.448 -0.554 0 O-C-N 121.798 -0.564 . . . . 3.8399999999999999 111.519 179.896 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -62.74 -58.51 7.22 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 118.939 0.791 . . . . 2.8399999999999999 110.67 170.365 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.614 HG12 HG22 ' A' ' 3' ' ' ILE . 12.0 m -53.02 -44.67 51.13 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.174 0 O-C-N 121.8 -0.563 . . . . 0.56000000000000005 110.224 -179.209 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.46 ' CZ ' ' HB2' ' A' ' 100' ' ' ALA . 13.5 t80 -42.3 -50.83 4.97 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 123.262 0.625 . . . . 4.6699999999999999 111.827 171.111 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 65.4 mtp85 -65.8 -34.39 78.06 Favored 'General case' 0 CA--C 1.529 0.173 0 C-N-CA 122.895 0.478 . . . . 3.1899999999999999 110.926 179.183 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -61.89 -40.55 95.8 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 109.802 -0.444 . . . . 3.75 109.802 175.445 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.504 HG21 ' CD1' ' A' ' 67' ' ' PHE . 25.5 mm -84.06 -47.49 17.65 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 CA-C-O 118.088 -0.958 . . . . 1.45 113.233 -173.648 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -72.46 71.47 0.94 Allowed 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 106.536 -1.653 . . . . 1.9399999999999999 106.536 170.876 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -57.2 -36.74 71.21 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 126.842 2.057 . . . . 2.2000000000000002 111.521 -173.476 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 12.0 p-10 -58.18 -27.24 63.67 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 126.748 2.019 . . . . 3.0299999999999998 112.23 170.224 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 22.7 mt-30 49.95 57.89 6.06 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 126.047 1.739 . . . . 3.2599999999999998 110.145 -172.795 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 78.3 p -80.1 -42.8 22.89 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 114.137 -1.392 . . . . 1.3799999999999999 109.769 171.67 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 117.38 -26.98 7.89 Favored Glycine 0 CA--C 1.53 1.005 0 CA-C-O 119.343 -0.698 . . . . 1.55 111.718 -169.622 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 37.3 m-85 -118.96 138.76 52.57 Favored 'General case' 0 C--N 1.34 0.171 0 C-N-CA 123.898 0.879 . . . . 2.9399999999999999 110.344 -178.24 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -84.7 76.07 10.25 Favored 'General case' 0 N--CA 1.456 -0.146 0 N-CA-C 107.036 -1.468 . . . . 1.75 107.036 167.725 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -54.83 155.77 4.13 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.718 1.207 . . . . 1.53 109.727 171.461 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -44.48 -54.35 6.06 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 123.647 0.779 . . . . 3.2999999999999998 111.874 -177.73 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -56.09 -35.46 67.05 Favored 'General case' 0 CA--C 1.534 0.327 0 N-CA-C 114.132 1.16 . . . . 3.6299999999999999 114.132 176.802 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -65.39 -37.47 87.07 Favored 'General case' 0 N--CA 1.462 0.127 0 CA-C-N 120.543 1.519 . . . . 3.25 109.622 174.608 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 60.1 mt -73.2 14.27 0.33 Allowed 'General case' 0 C--O 1.222 -0.393 0 CA-C-O 118.523 -0.751 . . . . 2.1800000000000002 112.408 170.193 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 27.2 ttpt -97.31 0.04 47.35 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 120.084 1.311 . . . . 2.02 109.716 162.163 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 92.1 m-85 -149.11 32.77 0.74 Allowed 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.567 0.747 . . . . 4.5800000000000001 111.795 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.504 ' CD1' HG21 ' A' ' 51' ' ' ILE . 46.0 t80 -64.77 -72.22 0.16 Allowed 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 119.625 1.102 . . . . 2.3500000000000001 109.82 -179.869 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 15.7 mt -65.98 -16.92 64.31 Favored 'General case' 0 CA--C 1.534 0.33 0 O-C-N 120.494 -1.379 . . . . 2.4100000000000001 113.205 177.48 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 74.1 mm-40 -57.25 -33.18 67.31 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 121.032 -1.042 . . . . 1.8600000000000001 111.347 176.395 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 1.6 mptp? -83.47 -13.56 54.43 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 118.792 0.723 . . . . 3.73 112.227 174.957 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 24.5 m-85 -75.29 -56.48 4.68 Favored 'General case' 0 C--N 1.338 0.104 0 N-CA-C 108.702 -0.851 . . . . 3.2200000000000002 108.702 171.309 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 28.2 tp10 -118.06 -63.76 1.38 Allowed 'General case' 0 CA--C 1.531 0.248 0 O-C-N 124.148 0.905 . . . . 3.8199999999999998 110.416 -169.824 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 8.7 t 104.3 117.68 0.01 OUTLIER 'General case' 0 C--N 1.341 0.236 0 C-N-CA 127.68 2.392 . . . . 2.9300000000000002 107.546 -170.014 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 90.36 24.9 27.54 Favored Glycine 0 CA--C 1.529 0.958 0 C-N-CA 124.59 1.09 . . . . 1.51 111.943 -176.853 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -87.19 173.42 9.24 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.742 0.817 . . . . 1.8799999999999999 110.744 176.673 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.76 -13.84 1.96 Allowed 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 126.913 2.085 . . . . 3.75 115.765 -167.048 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 73.8 mm-40 -37.71 -41.66 0.51 Allowed 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 126.494 1.917 . . . . 3.6099999999999999 114.424 -173.251 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.605 HD22 ' H ' ' A' ' 78' ' ' LEU . 1.1 mm? -48.86 -41.65 33.92 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 123.584 0.753 . . . . 0.94999999999999996 112.522 177.368 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 31.5 m -71.59 110.09 5.94 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 121.836 0.827 . . . . 0.76000000000000001 110.585 178.602 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 24.6 mp0 -59.55 -42.99 93.64 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 114.786 -1.097 . . . . 3.6000000000000001 110.09 -178.84 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 2.6 m -52.32 -55.18 23.2 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.836 0.854 . . . . 1.5800000000000001 112.278 177.168 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -67.39 -41.65 84.63 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 108.505 -0.924 . . . . 2.7799999999999998 108.505 -173.089 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -53.01 -52.16 59.34 Favored 'General case' 0 CA--C 1.517 -0.307 0 C-N-CA 123.496 0.718 . . . . 0.57999999999999996 109.151 171.718 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 12.5 tttt -73.56 -23.14 59.93 Favored 'General case' 0 N--CA 1.438 -1.039 0 CA-C-N 116.05 -0.523 . . . . 4.5899999999999999 110.465 -171.209 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 21.9 m -63.49 -43.64 96.68 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.599 0.76 . . . . 1.6200000000000001 110.22 167.232 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.6 tt -59.33 -61.77 2.38 Favored 'General case' 0 CA--C 1.533 0.3 0 N-CA-C 108.6 -0.889 . . . . 2.3199999999999998 108.6 169.957 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 35.3 ttp -47.18 -49.27 22.99 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 112.412 0.523 . . . . 2.4900000000000002 112.412 -177.616 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -52.42 -40.7 62.49 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 125.851 1.66 . . . . 0.48999999999999999 112.274 -173.604 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -90.83 -36.98 13.9 Favored 'General case' 0 C--O 1.226 -0.155 0 C-N-CA 122.355 0.262 . . . . 0.5 111.351 179.52 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -57.7 -44.44 85.88 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 122.319 0.248 . . . . 0.37 111.044 177.897 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 8.8 t0 -66.45 120.6 13.64 Favored 'General case' 0 N--CA 1.442 -0.845 0 N-CA-C 108.292 -1.003 . . . . 1.75 108.292 174.461 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 49.1 p30 -104.35 11.13 35.05 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 112.63 0.604 . . . . 3.3100000000000001 112.63 176.022 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -95.01 -52.89 4.03 Favored 'General case' 0 C--N 1.342 0.279 0 CA-C-N 118.731 0.696 . . . . 1.3899999999999999 110.414 173.626 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 97.38 47.94 2.1 Favored Glycine 0 CA--C 1.53 1.025 0 N-CA-C 108.676 -1.77 . . . . 0.89000000000000001 108.676 -156.383 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 36.2 p30 -128.29 -64.78 0.93 Allowed 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 126.355 1.862 . . . . 1.9399999999999999 110.055 175.036 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 140.13 -49.39 0.8 Allowed Glycine 0 CA--C 1.522 0.516 0 C-N-CA 125.31 1.433 . . . . 0.85999999999999999 109.52 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 23.2 pttm -53.22 128.39 27.84 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 109.473 -0.565 . . . . 5.2699999999999996 109.473 174.455 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 5.6 mt -118.6 107.94 22.94 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.325 0 C-N-CA 125.518 1.527 . . . . 0.71999999999999997 108.233 -175.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -66.97 163.8 44.3 Favored Glycine 0 CA--C 1.532 1.102 0 N-CA-C 110.993 -0.843 . . . . 0.58999999999999997 110.993 172.477 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . 0.46 ' HB2' ' CZ ' ' A' ' 48' ' ' PHE . . . -51.93 -38.78 57.65 Favored 'General case' 0 C--N 1.339 0.13 0 O-C-N 122.104 -0.645 . . . . 0.71999999999999997 109.631 168.215 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -59.59 -55.63 32.03 Favored 'General case' 0 N--CA 1.444 -0.758 0 CA-C-N 115.142 -0.935 . . . . 2.4500000000000002 109.91 178.788 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -52.66 -46.37 67.16 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.616 0.766 . . . . 2.23 110.679 175.357 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 85.4 t80 -56.51 -57.64 11.46 Favored 'General case' 0 CA--C 1.536 0.406 0 O-C-N 121.816 -0.553 . . . . 4.1699999999999999 111.349 177.548 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 30.8 tt0 -55.97 -37.81 69.56 Favored 'General case' 0 CA--C 1.533 0.299 0 O-C-N 121.748 -0.595 . . . . 2.1800000000000002 110.294 177.183 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -56.8 -60.8 3.04 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 123.42 0.688 . . . . 4.5800000000000001 109.872 178.531 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 12.0 ptm -57.47 -43.41 84.02 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 119.822 -0.751 . . . . 5.7000000000000002 109.65 178.543 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . 0.519 HG11 HG13 ' A' ' 44' ' ' VAL . 57.1 t -69.65 -16.88 20.88 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 N-CA-C 112.126 0.417 . . . . 1.3899999999999999 112.126 -175.297 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -76.01 -23.52 55.22 Favored 'General case' 0 CA--C 1.538 0.483 0 O-C-N 120.123 -1.61 . . . . 2.6000000000000001 110.903 175.981 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 15.5 t . . . . . 0 C--O 1.252 1.216 0 CA-C-O 116.36 -1.781 . . . . 2.46 114.017 -164.456 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.8 mpt? . . . . . 0 N--CA 1.474 0.743 0 N-CA-C 107.62 -1.252 . . . . 8.4100000000000001 107.62 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 30.7 t -148.79 -179.3 6.89 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 104.746 -2.316 . . . . 3.1899999999999999 104.746 159.485 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 2.3 pp -54.5 -31.51 23.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 C-N-CA 124.987 1.315 . . . . 1.2 111.392 -174.441 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 2.3 t -51.88 -44.03 63.56 Favored 'General case' 0 N--CA 1.436 -1.142 0 C-N-CA 125.401 1.48 . . . . 1.73 111.14 174.319 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 23.3 t0 -98.18 42.25 1.1 Allowed 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 126.538 1.935 . . . . 3.4100000000000001 109.423 -173.132 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 97.4 t -136.73 -59.95 0.44 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.101 0 C-N-CA 124.997 1.319 . . . . 1.72 108.611 177.646 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -170.87 -47.24 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.116 0 N-CA-C 107.395 -1.335 . . . . 1.3600000000000001 107.395 -177.432 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 20.3 m -49.08 -22.84 1.01 Allowed 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 116.639 2.088 . . . . 1.0900000000000001 116.639 -166.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -49.35 -42.16 40.99 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 119.823 1.192 . . . . 0.88 112.291 169.107 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -68.42 -40.05 81.35 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 121.829 0.823 . . . . 2.0699999999999998 110.41 176.593 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -61.28 -47.19 87.15 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 115.797 -0.638 . . . . 4.96 109.834 -177.788 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 34.6 pt -65.57 -38.22 81.87 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.11 0 CA-C-O 119.163 -0.446 . . . . 1.1100000000000001 109.797 -177.711 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.93 -46.46 78.46 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 118.341 0.519 . . . . 0.60999999999999999 111.274 173.378 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.95 -61.04 2.93 Favored 'General case' 0 C--O 1.234 0.262 0 O-C-N 121.961 -0.462 . . . . 0.65000000000000002 111.012 174.273 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -51.27 -44.79 61.89 Favored 'General case' 0 CA--C 1.528 0.099 0 C-N-CA 123.56 0.744 . . . . 0.52000000000000002 111.167 -176.892 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.438 HD23 ' HG2' ' A' ' 17' ' ' GLN . 0.8 OUTLIER -48.72 -44.41 38.23 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 125.54 1.536 . . . . 3.2999999999999998 111.903 177.907 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.438 ' HG2' HD23 ' A' ' 16' ' ' LEU . 2.9 mm100 -86.67 -49.39 7.53 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 119.222 0.919 . . . . 3.2999999999999998 110.946 178.616 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 55.3 tp10 -50.63 -47.45 58.37 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.978 0.911 . . . . 3.8999999999999999 110.803 -177.682 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 74.6 m -112.52 58.86 0.64 Allowed 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 124.757 1.223 . . . . 1.6200000000000001 108.031 177.262 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 56.8 ttt180 -82.82 -54.17 5.31 Favored 'General case' 0 CA--C 1.52 -0.176 0 O-C-N 121.522 -0.736 . . . . 4.04 109.701 178.257 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 36.6 m-20 -58.73 143.41 82.37 Favored Pre-proline 0 N--CA 1.449 -0.476 0 CA-C-N 115.171 -0.922 . . . . 2.1400000000000001 110.285 -173.5 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -64.57 134.89 43.11 Favored 'Trans proline' 0 N--CA 1.449 -1.137 0 C-N-CA 122.406 2.07 . . . . 1.2 110.402 -173.817 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 69.5 m-20 63.15 36.87 11.8 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 127.643 2.377 . . . . 2.6699999999999999 111.699 178.457 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 6.1 m -102.64 0.35 33.08 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 123.907 0.883 . . . . 0.65000000000000002 110.88 173.51 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -70.89 138.12 49.89 Favored 'General case' 0 N--CA 1.449 -0.487 0 O-C-N 121.35 -0.844 . . . . 2.29 110.582 -174.482 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -131.84 148.49 70.11 Favored Pre-proline 0 N--CA 1.452 -0.328 0 C-N-CA 123.965 0.906 . . . . 2.5099999999999998 109.395 170.731 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_endo -65.67 -71.64 0.02 OUTLIER 'Trans proline' 0 N--CA 1.451 -0.973 0 C-N-CA 123.741 2.961 . . . . 0.62 111.007 -178.856 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 53.7 mt-30 -51.8 -46.22 64.15 Favored 'General case' 0 C--O 1.233 0.205 0 C-N-CA 123.879 0.872 . . . . 2.1699999999999999 110.982 -178.725 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 16.9 tptt -47.75 -60.33 2.65 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 123.418 0.687 . . . . 2.7400000000000002 110.007 171.689 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.475 ' CE1' HD21 ' A' ' 68' ' ' LEU . 82.3 t80 -56.34 -47.06 79.57 Favored 'General case' 0 C--O 1.222 -0.362 0 C-N-CA 122.805 0.442 . . . . 2.23 110.846 -179.425 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 9.0 m-30 -54.34 -40.54 68.13 Favored 'General case' 0 CA--C 1.531 0.233 0 O-C-N 121.166 -0.959 . . . . 4.8600000000000003 111.411 -178.956 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 33.4 mt-30 -73.1 -54.75 7.73 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 110.331 -0.248 . . . . 3.1600000000000001 110.331 176.263 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -57.85 -39.07 76.87 Favored 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 123.15 0.58 . . . . 0.70999999999999996 110.332 -172.213 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 10.9 m -86.1 6.72 27.81 Favored 'General case' 0 N--CA 1.444 -0.744 0 C-N-CA 124.815 1.246 . . . . 2.1400000000000001 111.558 -177.748 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 75.23 -16.53 3.58 Favored Glycine 0 CA--C 1.531 1.063 0 O-C-N 119.366 -2.084 . . . . 0.67000000000000004 113.093 169.186 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 12.7 mt -56.15 -29.55 60.92 Favored 'General case' 0 N--CA 1.441 -0.89 0 C-N-CA 126.425 1.89 . . . . 1.6399999999999999 112.995 178.615 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 8.1 t -70.34 -32.96 70.91 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 123.521 0.728 . . . . 1.79 111.41 170.523 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 2.4 tptt -74.79 -36.7 62.5 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 108.397 -0.964 . . . . 5.1100000000000003 108.397 178.76 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 41.2 mtt -66.5 119.86 12.39 Favored 'General case' 0 N--CA 1.443 -0.788 0 N-CA-C 109.223 -0.658 . . . . 2.3100000000000001 109.223 173.512 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 16.4 t -63.46 161.97 13.44 Favored 'General case' 0 N--CA 1.453 -0.293 0 O-C-N 121.804 -0.56 . . . . 3.0899999999999999 109.651 174.454 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -37.7 -44.14 0.69 Allowed 'General case' 0 CA--C 1.527 0.091 0 C-N-CA 126.095 1.758 . . . . 0.83999999999999997 112.055 178.427 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 39.5 m-20 -39.92 -56.87 1.72 Allowed 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 125.937 1.695 . . . . 2.1200000000000001 111.565 174.761 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 9.1 mm100 -75.98 -36.68 59.15 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 122.991 0.516 . . . . 2.52 110.177 -176.589 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 4.2 t -61.17 -35.31 64.91 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.584 0 N-CA-C 108.721 -0.844 . . . . 0.95999999999999996 108.721 179.029 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 80.4 tttt -56.56 -50.03 73.11 Favored 'General case' 0 CA--C 1.531 0.235 0 O-C-N 121.157 -0.964 . . . . 3.3999999999999999 111.589 172.843 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -55.08 -52.51 62.98 Favored 'General case' 0 C--O 1.233 0.206 0 N-CA-C 110.072 -0.344 . . . . 2.6200000000000001 110.072 176.92 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 2.4 m -59.53 -45.3 94.05 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 C-N-CA 119.151 -1.019 . . . . 0.77000000000000002 110.803 179.688 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 10.9 m-85 -47.43 -48.96 26.22 Favored 'General case' 0 C--N 1.34 0.165 0 C-N-CA 124.072 0.949 . . . . 4.5700000000000003 111.912 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 4.4 mtt180 -61.01 -28.41 69.02 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 120.199 -0.601 . . . . 3.2999999999999998 111.877 179.638 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 7.6 t80 -72.18 -40.81 67.64 Favored 'General case' 0 N--CA 1.452 -0.343 0 O-C-N 121.955 -0.465 . . . . 4.1799999999999997 110.067 170.568 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 5.0 mm -66.82 -51.55 54.35 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-O 118.356 -0.831 . . . . 1.6200000000000001 111.654 -176.047 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -66.4 76.36 0.1 Allowed 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 107.361 -1.348 . . . . 2.2599999999999998 107.361 171.312 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -66.95 -30.25 70.33 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 123.665 0.786 . . . . 2.1499999999999999 109.621 178.819 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 38.5 p-10 -65.63 -44.01 87.78 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 123.545 0.738 . . . . 2.5 110.689 169.69 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . 0.297 0.0 OUTLIER 101.54 10.76 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 130.031 3.332 . . . . 4.8799999999999999 112.809 173.74 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 7.7 p -71.7 -39.77 69.97 Favored 'General case' 0 CA--C 1.528 0.133 0 N-CA-C 112.488 0.551 . . . . 1.71 112.488 -170.68 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 113.37 -26.39 10.34 Favored Glycine 0 CA--C 1.527 0.81 0 N-CA-C 111.61 -0.596 . . . . 1.8100000000000001 111.61 -179.444 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 86.5 m-85 -79.58 134.81 36.48 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 107.734 -1.209 . . . . 3.1499999999999999 107.734 166.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -92.62 71.94 5.01 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 105.526 -2.027 . . . . 2.6699999999999999 105.526 172.367 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.42 157.23 11.52 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-N 113.981 -1.463 . . . . 1.6100000000000001 108.979 179.544 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -45.0 -51.18 10.14 Favored 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 123.642 0.777 . . . . 4.2400000000000002 111.578 -172.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 20.2 mp0 -59.06 -30.6 68.18 Favored 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 114.427 1.269 . . . . 4.3200000000000003 114.427 178.708 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -59.35 -41.66 89.72 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 121.354 1.888 . . . . 2.6600000000000001 109.013 169.865 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -74.45 12.12 0.84 Allowed 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 123.632 0.773 . . . . 2.3399999999999999 112.44 174.905 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 32.2 ttpt -104.08 2.7 32.37 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 125.298 1.439 . . . . 2.6400000000000001 109.644 166.344 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 34.4 p90 -151.17 27.78 0.68 Allowed 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 119.126 0.875 . . . . 5.5999999999999996 113.342 171.881 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -56.54 -64.24 0.93 Allowed 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 119.209 0.913 . . . . 2.52 109.962 -179.585 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.475 HD21 ' CE1' ' A' ' 30' ' ' PHE . 7.1 mp -81.3 -17.02 50.74 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 112.873 0.694 . . . . 2.3700000000000001 112.873 -179.657 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 68.3 mm-40 -54.62 -33.17 60.08 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 119.653 1.115 . . . . 1.6100000000000001 110.31 174.856 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.2 mtpt -62.85 -23.43 67.3 Favored 'General case' 0 CA--C 1.535 0.383 0 O-C-N 121.962 -0.461 . . . . 3.3900000000000001 112.239 176.317 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 2.1 m-30 -98.31 -49.31 4.74 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 125.144 1.378 . . . . 3.1600000000000001 110.162 -174.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -137.47 135.71 37.07 Favored 'General case' 0 C--N 1.341 0.202 0 C-N-CA 125.12 1.368 . . . . 4.2300000000000004 108.769 -169.76 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 2.1 p -61.86 -32.95 73.34 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 124.805 1.242 . . . . 3.4100000000000001 113.978 -165.849 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -119.88 27.15 6.9 Favored Glycine 0 CA--C 1.524 0.599 0 C-N-CA 125.114 1.34 . . . . 1.55 110.761 -173.392 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.37 153.53 38.23 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 117.408 0.604 . . . . 2.0 110.77 179.182 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.48 17.14 0.07 Allowed 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 115.823 1.786 . . . . 3.29 115.823 -161.349 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 68.5 mm-40 -55.47 -35.38 65.44 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-O 122.271 1.034 . . . . 3.71 111.623 -176.603 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.414 HD22 ' H ' ' A' ' 78' ' ' LEU . 0.0 OUTLIER -56.75 -37.56 71.21 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 115.11 -0.95 . . . . 0.76000000000000001 111.507 177.242 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 54.2 m -74.57 107.63 6.82 Favored 'General case' 0 C--N 1.344 0.338 0 CA-C-N 118.994 0.815 . . . . 0.76000000000000001 109.295 -178.804 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 15.9 pt-20 -56.68 -41.48 77.37 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 114.513 -1.222 . . . . 2.6800000000000002 110.834 -178.221 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 66.1 m -59.39 -54.36 47.55 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 122.976 0.51 . . . . 1.3899999999999999 112.096 177.404 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 -59.48 -45.51 91.46 Favored 'General case' 0 C--O 1.232 0.171 0 O-C-N 121.423 -0.798 . . . . 3.0299999999999998 110.631 178.509 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -53.94 -47.86 70.84 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 121.696 0.76 . . . . 0.55000000000000004 109.71 174.529 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 14.8 mmtp -65.4 -29.71 70.45 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 123.892 0.877 . . . . 4.8499999999999996 111.357 -177.078 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.2 t -56.47 -46.61 80.32 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 119.285 0.948 . . . . 1.98 110.314 170.449 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 28.3 mt -64.2 -57.41 9.59 Favored 'General case' 0 C--O 1.235 0.319 0 O-C-N 121.761 -0.587 . . . . 2.5800000000000001 109.914 174.798 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 2.0 tpt -40.82 -52.89 2.97 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 123.675 0.79 . . . . 2.98 111.39 176.811 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -53.6 -48.4 69.3 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 126.792 2.037 . . . . 0.51000000000000001 111.875 -170.634 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -80.25 -47.44 14.59 Favored 'General case' 0 N--CA 1.457 -0.108 0 C-N-CA 121.186 -0.206 . . . . 0.60999999999999999 110.752 178.206 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -54.66 -38.38 66.87 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 120.664 0.269 . . . . 0.57999999999999996 110.996 -176.1 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -78.27 103.79 8.44 Favored 'General case' 0 N--CA 1.442 -0.842 0 CA-C-N 116.436 -0.347 . . . . 1.0900000000000001 110.197 178.191 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 9.4 m-80 -95.71 27.66 3.38 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 123.558 0.743 . . . . 2.8700000000000001 110.339 -177.664 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 45.2 m-20 -119.49 -51.07 2.3 Favored 'General case' 0 N--CA 1.46 0.041 0 C-N-CA 124.558 1.143 . . . . 1.4399999999999999 109.332 178.095 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 91.84 42.28 4.78 Favored Glycine 0 CA--C 1.527 0.829 0 N-CA-C 108.771 -1.732 . . . . 0.93999999999999995 108.771 -158.343 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 33.5 p30 -121.36 -63.21 1.35 Allowed 'General case' 0 C--N 1.342 0.253 0 C-N-CA 124.035 0.934 . . . . 2.2599999999999998 110.586 172.88 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 126.79 -31.91 3.8 Favored Glycine 0 CA--C 1.521 0.46 0 N-CA-C 111.261 -0.735 . . . . 1.0 111.261 177.745 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 25.7 pttm -58.29 101.11 0.07 Allowed 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 107.92 -1.141 . . . . 5.1200000000000001 107.92 162.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . 0.413 HG21 ' CD2' ' A' ' 103' ' ' PHE . 26.7 mt -94.57 147.99 5.3 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 N-CA-C 107.106 -1.442 . . . . 1.28 107.106 176.102 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -117.01 170.33 13.38 Favored Glycine 0 CA--C 1.523 0.572 0 N-CA-C 109.683 -1.367 . . . . 0.54000000000000004 109.683 175.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -59.59 -48.93 79.73 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 108.691 -0.855 . . . . 0.68999999999999995 108.691 178.783 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -54.22 -54.73 36.01 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 111.86 0.319 . . . . 3.02 111.86 177.201 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -47.65 -53.99 13.27 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.525 1.13 . . . . 1.6399999999999999 110.439 175.931 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . 0.413 ' CD2' HG21 ' A' ' 98' ' ' ILE . 0.1 OUTLIER -70.67 -38.83 73.82 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 119.37 -0.932 . . . . 3.8599999999999999 111.305 -177.548 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -57.53 -49.79 75.2 Favored 'General case' 0 C--O 1.221 -0.404 0 C-N-CA 124.133 0.973 . . . . 2.79 108.652 -179.154 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -50.53 -54.19 24.36 Favored 'General case' 0 CA--C 1.528 0.129 0 CA-C-N 118.819 0.736 . . . . 3.8900000000000001 110.367 176.887 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.12 -56.89 16.12 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 116.529 -0.305 . . . . 3.6600000000000001 111.013 -178.018 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 42.5 t -50.23 -45.71 24.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 C-N-CA 124.299 1.04 . . . . 1.53 111.359 177.878 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 10.9 t-160 -72.44 -11.12 60.55 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 125.053 1.341 . . . . 3.0499999999999998 111.016 -172.295 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 30.0 t . . . . . 0 C--O 1.252 1.188 0 C-N-CA 122.986 0.514 . . . . 3.3300000000000001 112.035 178.394 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 18.3 mmt . . . . . 0 N--CA 1.471 0.576 0 N-CA-C 108.414 -0.958 . . . . 9.3599999999999994 108.414 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 32.5 m -133.12 -178.11 4.82 Favored 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 106.329 -1.73 . . . . 4.0 106.329 172.804 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 2.6 pp -45.27 -42.97 3.13 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.384 0 C-N-CA 124.536 1.134 . . . . 2.4500000000000002 111.947 -179.794 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.434 HG22 ' H ' ' A' ' 4' ' ' THR . 0.6 OUTLIER -81.22 57.69 3.28 Favored 'General case' 0 N--CA 1.439 -1.015 0 C-N-CA 126.322 1.849 . . . . 2.29 107.099 178.227 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 174.42 -48.92 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 126.324 1.85 . . . . 3.8199999999999998 108.952 176.161 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -46.13 -41.89 4.37 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.307 0 C-N-CA 125.766 1.626 . . . . 1.8899999999999999 112.224 -170.642 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -175.71 -60.11 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 105.867 -1.901 . . . . 1.6399999999999999 105.867 -171.556 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 2.6 m -50.83 -29.18 11.07 Favored 'General case' 0 N--CA 1.445 -0.694 0 C-N-CA 124.736 1.214 . . . . 1.1000000000000001 113.617 -170.12 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -49.73 -46.44 50.35 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 119.547 1.067 . . . . 0.85999999999999999 113.14 171.415 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 42.5 t0 -66.18 -43.39 87.0 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-O 122.707 1.241 . . . . 1.8700000000000001 108.911 179.921 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -64.38 -50.21 68.57 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 115.399 -0.819 . . . . 2.2799999999999998 109.581 -175.486 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 9.5 pt -60.18 -41.17 85.79 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.677 0 O-C-N 121.249 -0.907 . . . . 1.21 111.341 176.477 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -54.74 -42.27 71.4 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 118.999 0.818 . . . . 1.1000000000000001 111.014 174.181 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.84 -54.08 44.41 Favored 'General case' 0 CA--C 1.533 0.299 0 O-C-N 121.61 -0.681 . . . . 1.0900000000000001 111.064 171.373 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.403 ' HB2' HG23 ' A' ' 33' ' ' THR . . . -51.9 -44.64 63.86 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 124.89 1.276 . . . . 1.1499999999999999 111.379 -174.855 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.9 tp -48.12 -48.37 34.04 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 125.483 1.513 . . . . 2.5899999999999999 109.958 174.557 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 23.7 mt-30 -82.46 -28.01 31.51 Favored 'General case' 0 CA--C 1.528 0.125 0 N-CA-C 113.381 0.882 . . . . 3.1699999999999999 113.381 -178.921 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . 0.275 0.2 OUTLIER -71.82 -37.65 70.29 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 119.942 1.246 . . . . 3.6899999999999999 109.386 176.865 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 44.4 m -92.36 38.22 1.01 Allowed 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.184 1.394 . . . . 2.5 112.407 174.153 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.93 -37.39 67.2 Favored 'General case' 0 N--CA 1.47 0.534 0 O-C-N 120.444 -1.41 . . . . 8.2599999999999998 109.78 172.41 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -83.92 142.05 41.48 Favored Pre-proline 0 N--CA 1.447 -0.592 0 C-N-CA 124.092 0.957 . . . . 2.0299999999999998 108.889 -176.27 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -69.46 150.73 70.41 Favored 'Trans proline' 0 N--CA 1.46 -0.498 0 C-N-CA 123.489 2.792 . . . . 1.3899999999999999 112.008 -176.747 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 55.68 19.35 3.31 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.923 1.689 . . . . 2.29 112.945 178.57 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 55.5 m -91.82 -25.67 18.88 Favored 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 124.639 1.176 . . . . 0.94999999999999996 111.087 -173.913 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 3.8 t80 -49.29 122.81 6.49 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 123.769 0.828 . . . . 3.46 109.731 178.002 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -114.79 152.52 46.46 Favored Pre-proline 0 CA--C 1.536 0.422 0 C-N-CA 124.354 1.062 . . . . 2.73 108.984 168.692 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_endo -66.42 -70.61 0.02 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.819 0 C-N-CA 123.434 2.756 . . . . 1.03 111.545 -175.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 -54.07 -45.72 71.81 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 123.574 0.75 . . . . 2.5699999999999998 110.492 -179.196 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 22.3 tptt -45.77 -64.46 0.73 Allowed 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 123.666 0.786 . . . . 2.8999999999999999 109.15 172.455 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.432 ' CZ ' HD11 ' A' ' 68' ' ' LEU . 75.4 t80 -59.32 -44.32 92.61 Favored 'General case' 0 N--CA 1.447 -0.616 0 C-N-CA 122.485 0.314 . . . . 2.2599999999999998 111.455 -175.921 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 34.3 m-85 -57.17 -38.81 74.15 Favored 'General case' 0 N--CA 1.453 -0.29 0 O-C-N 121.394 -0.816 . . . . 5.0199999999999996 111.054 -178.741 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 4.3 mt-30 -71.37 -51.55 23.56 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 118.643 0.656 . . . . 2.7000000000000002 110.607 170.64 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.403 HG23 ' HB2' ' A' ' 15' ' ' ALA . 0.4 OUTLIER -58.67 -31.43 68.19 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 123.94 0.896 . . . . 1.3 111.804 -172.069 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.6 t -91.29 1.65 56.95 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 126.485 1.914 . . . . 1.8799999999999999 110.497 -176.876 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 90.37 -36.78 3.48 Favored Glycine 0 C--N 1.335 0.523 0 O-C-N 120.682 -1.262 . . . . 1.3400000000000001 110.192 170.477 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 3.3 mp -33.57 -52.57 0.4 Allowed 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 126.537 1.935 . . . . 3.0499999999999998 114.865 179.158 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 10.3 t -69.39 -27.31 65.19 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 119.523 1.056 . . . . 2.4700000000000002 111.49 -176.3 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 5.6 tmtp? -79.7 -39.27 31.61 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 108.994 -0.743 . . . . 3.25 108.994 176.419 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 9.6 mtt -57.67 143.31 42.02 Favored 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 123.532 0.733 . . . . 2.71 110.629 176.684 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 3.8 m -62.09 149.32 41.56 Favored 'General case' 0 N--CA 1.446 -0.627 0 O-C-N 121.873 -0.517 . . . . 1.96 109.878 172.909 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -37.89 -43.51 0.7 Allowed 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 125.054 1.342 . . . . 0.60999999999999999 111.913 171.076 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -53.29 -60.99 2.59 Favored 'General case' 0 C--O 1.227 -0.087 0 C-N-CA 124.249 1.02 . . . . 2.4199999999999999 110.061 178.038 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 28.7 mm100 -60.81 -39.08 87.63 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 123.092 0.557 . . . . 3.1400000000000001 109.893 -178.313 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 60.1 t -60.85 -44.63 98.09 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.29 0 CA-C-N 118.823 0.738 . . . . 0.53000000000000003 109.855 177.668 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 62.0 tttt -68.84 -39.64 79.85 Favored 'General case' 0 N--CA 1.451 -0.4 0 O-C-N 121.642 -0.661 . . . . 2.9700000000000002 110.692 -178.061 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -59.71 -58.2 9.6 Favored 'General case' 0 C--O 1.232 0.153 0 C-N-CA 122.749 0.419 . . . . 3.2200000000000002 110.2 173.211 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 14.0 m -55.63 -44.92 78.5 Favored 'Isoleucine or valine' 0 C--N 1.34 0.195 0 N-CA-C 109.59 -0.522 . . . . 0.52000000000000002 109.59 -179.189 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.557 ' CZ ' HD23 ' A' ' 59' ' ' LEU . 43.3 t80 -46.43 -64.23 0.81 Allowed 'General case' 0 C--N 1.341 0.229 0 N-CA-C 109.449 -0.574 . . . . 4.1500000000000004 109.449 171.723 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 63.8 mtt180 -54.67 -37.04 65.28 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 114.005 1.113 . . . . 4.5599999999999996 114.005 -178.711 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 27.1 m-85 -64.08 -52.97 56.72 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 119.282 0.946 . . . . 4.9699999999999998 109.981 175.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 35.8 mm -76.2 -20.63 15.29 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.691 0 O-C-N 121.816 -0.552 . . . . 2.7799999999999998 111.773 -171.409 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 43.7 t0 -48.53 -28.64 3.51 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 128.759 2.824 . . . . 2.6000000000000001 113.015 173.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 11.2 t-20 79.14 -56.09 0.43 Allowed 'General case' 0 C--N 1.339 0.144 0 C-N-CA 126.318 1.847 . . . . 3.5499999999999998 112.65 162.624 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 29.4 p30 -69.57 -39.14 77.54 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.966 0.907 . . . . 3.02 110.08 168.086 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . 0.278 1.2 pt20 83.95 24.09 0.12 Allowed 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 129.641 3.176 . . . . 3.6299999999999999 111.021 -171.922 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 89.0 p -77.14 -27.2 53.8 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 113.607 0.966 . . . . 2.3799999999999999 113.607 -174.069 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 98.44 24.47 11.15 Favored Glycine 0 CA--C 1.534 1.247 0 C-N-CA 125.28 1.419 . . . . 1.99 112.397 -173.175 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 44.7 m-85 -143.22 128.05 18.3 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 118.338 1.069 . . . . 3.04 111.112 -177.543 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.557 HD23 ' CZ ' ' A' ' 48' ' ' PHE . 1.6 mm? -109.19 70.19 0.73 Allowed 'General case' 0 C--N 1.339 0.125 0 C-N-CA 127.148 2.179 . . . . 2.0299999999999998 108.588 -179.685 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -54.28 159.05 2.08 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.563 1.545 . . . . 1.6100000000000001 111.076 173.268 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -36.55 -54.53 0.87 Allowed 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 125.852 1.661 . . . . 4.3200000000000003 112.082 176.19 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 -63.81 -45.48 89.47 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 115.957 -0.565 . . . . 3.21 110.337 -173.345 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 81.7 mt-10 -62.89 -40.23 96.9 Favored 'General case' 0 N--CA 1.449 -0.517 0 O-C-N 121.506 -0.746 . . . . 2.5699999999999998 110.513 178.547 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 6.2 mt -57.18 -50.57 72.43 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 120.921 0.391 . . . . 2.2799999999999998 110.294 171.122 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 14.7 ttpt -60.76 -16.06 36.21 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 126.04 1.736 . . . . 4.2599999999999998 112.441 178.694 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 69.6 m-85 -130.97 49.28 2.34 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.009 0.924 . . . . 6.3099999999999996 110.354 170.089 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 68.3 t80 -85.77 -76.88 0.32 Allowed 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 124.419 1.088 . . . . 3.4500000000000002 110.716 -178.214 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.432 HD11 ' CZ ' ' A' ' 30' ' ' PHE . 90.9 mt -61.15 -9.09 4.14 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 113.171 0.804 . . . . 2.52 113.171 -176.643 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 80.8 mm-40 -47.96 -61.97 1.7 Allowed 'General case' 0 N--CA 1.452 -0.353 0 O-C-N 121.492 -0.755 . . . . 1.6499999999999999 110.346 168.617 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -83.79 48.01 1.38 Allowed 'General case' 0 CA--C 1.537 0.448 0 O-C-N 121.22 -0.925 . . . . 3.8300000000000001 110.252 -177.267 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -153.12 -58.21 0.13 Allowed 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.165 0.986 . . . . 3.1099999999999999 108.352 -167.712 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -108.55 -37.24 5.99 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 126.176 1.79 . . . . 3.7599999999999998 109.904 175.291 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 1.4 p 78.81 107.8 0.07 Allowed 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 125.154 1.381 . . . . 3.2400000000000002 108.734 -172.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 72.81 48.83 19.97 Favored Glycine 0 CA--C 1.527 0.8 0 N-CA-C 110.323 -1.111 . . . . 1.3999999999999999 110.323 -176.118 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -79.11 -146.9 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.758 0.823 . . . . 1.45 109.795 173.68 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 7.2 tpt180 -102.7 -30.91 10.61 Favored 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 113.317 0.858 . . . . 3.5299999999999998 113.317 -171.249 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -31.02 -33.19 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 129.717 3.207 . . . . 3.75 115.907 -175.302 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.409 HD22 ' H ' ' A' ' 78' ' ' LEU . 0.3 OUTLIER -39.94 -46.05 1.98 Allowed 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.727 1.211 . . . . 1.3600000000000001 110.856 171.636 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 7.3 m -72.17 125.64 27.81 Favored 'General case' 0 C--N 1.343 0.311 0 C-N-CA 119.541 -0.864 . . . . 0.84999999999999998 110.936 176.136 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -69.33 -38.52 78.23 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-O 118.086 -0.959 . . . . 2.8999999999999999 111.738 177.904 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 19.1 m -48.47 -69.73 0.11 Allowed 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 119.768 1.167 . . . . 1.1499999999999999 111.365 168.458 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -48.84 -45.46 40.69 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 123.757 0.823 . . . . 3.29 110.524 -176.514 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 1.2 m -60.31 -49.88 75.86 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 121.693 0.759 . . . . 1.05 110.276 177.043 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 24.2 ttpp -64.76 -29.8 70.78 Favored 'General case' 0 N--CA 1.439 -0.997 0 CA-C-N 115.966 -0.561 . . . . 4.7300000000000004 110.696 -173.432 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 9.5 m -56.7 -33.75 66.77 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 119.476 1.034 . . . . 1.3400000000000001 112.083 169.615 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.2 tt -71.68 -61.76 1.66 Allowed 'General case' 0 C--O 1.236 0.356 0 N-CA-C 108.25 -1.018 . . . . 2.5800000000000001 108.25 169.832 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 2.1 ttm -46.11 -53.71 9.85 Favored 'General case' 0 C--O 1.221 -0.414 0 C-N-CA 123.335 0.654 . . . . 2.8599999999999999 111.105 -174.003 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -42.96 -37.85 2.02 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 127.579 2.351 . . . . 0.81000000000000005 113.34 179.92 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -97.62 -44.78 6.64 Favored 'General case' 0 C--O 1.227 -0.103 0 CA-C-O 120.897 0.38 . . . . 0.62 110.676 -175.746 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -53.9 -43.09 69.41 Favored 'General case' 0 N--CA 1.456 -0.15 0 C-N-CA 123.863 0.865 . . . . 0.55000000000000004 110.926 176.792 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -73.72 72.84 1.51 Allowed 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 124.772 1.229 . . . . 1.1799999999999999 109.541 -178.749 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 48.8 p-10 -77.17 51.83 0.86 Allowed 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.752 1.221 . . . . 2.7599999999999998 112.313 -172.68 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 31.9 p30 -163.29 -46.26 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 126.281 1.833 . . . . 3.7000000000000002 109.847 -175.017 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 99.98 55.05 1.01 Allowed Glycine 0 CA--C 1.525 0.699 0 N-CA-C 110.183 -1.167 . . . . 0.71999999999999997 110.183 173.739 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -123.84 -46.97 1.95 Allowed 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 126.33 1.852 . . . . 2.3500000000000001 109.918 175.01 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 123.5 -36.64 2.97 Favored Glycine 0 CA--C 1.529 0.953 0 C-N-CA 125.436 1.493 . . . . 0.66000000000000003 111.342 178.042 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 39.9 mmtt -71.8 128.86 37.11 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 108.501 -0.926 . . . . 6.1100000000000003 108.501 177.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 23.0 mt -119.39 116.31 50.4 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.253 0 C-N-CA 124.256 1.022 . . . . 0.72999999999999998 108.644 -173.916 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -81.28 167.45 49.19 Favored Glycine 0 CA--C 1.528 0.878 0 N-CA-C 110.863 -0.895 . . . . 0.47999999999999998 110.863 174.072 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -57.99 -37.81 74.94 Favored 'General case' 0 C--O 1.224 -0.28 0 N-CA-C 109.572 -0.529 . . . . 0.59999999999999998 109.572 172.737 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 60.2 mt-10 -56.65 -67.08 0.34 Allowed 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 124.064 0.946 . . . . 2.9399999999999999 109.49 175.013 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -40.04 -50.07 2.56 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.142 0.977 . . . . 1.3799999999999999 111.393 175.551 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -66.89 -55.45 14.66 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 112.01 0.374 . . . . 2.9100000000000001 112.01 -176.371 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 10.8 tt0 -53.58 -44.43 69.33 Favored 'General case' 0 C--O 1.221 -0.41 0 C-N-CA 124.212 1.005 . . . . 2.0800000000000001 109.28 178.826 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -50.86 -62.46 1.59 Allowed 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 119.266 0.939 . . . . 3.98 110.426 173.721 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.03 -42.6 94.72 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 120.726 -0.389 . . . . 3.1699999999999999 110.9 -173.67 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 57.2 t -58.85 -48.63 85.68 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.327 0 C-N-CA 124.103 0.961 . . . . 1.28 111.3 176.171 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 50.5 t-80 -72.81 -18.19 61.49 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 125.445 1.498 . . . . 2.4399999999999999 110.834 -170.761 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 22.9 t . . . . . 0 C--O 1.254 1.332 0 CA-C-O 114.989 -2.434 . . . . 2.5800000000000001 113.41 -179.856 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 52.6 mtt . . . . . 0 N--CA 1.472 0.654 0 N-CA-C 107.504 -1.295 . . . . 7.7699999999999996 107.504 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.0 m 149.23 -86.05 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 130.055 3.342 . . . . 2.79 105.889 -175.187 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.637 HG22 HG12 ' A' ' 47' ' ' VAL . 1.5 pp -75.31 -33.34 27.78 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 CA-C-O 121.803 0.811 . . . . 1.3999999999999999 111.514 -171.038 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 10.2 t -69.03 -7.03 31.8 Favored 'General case' 0 N--CA 1.426 -1.653 0 C-N-CA 126.284 1.834 . . . . 1.79 111.662 -175.242 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 52.1 t0 -148.08 60.63 1.11 Allowed 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 108.026 -1.102 . . . . 2.6400000000000001 108.026 -179.474 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 3.1 p -145.38 -48.71 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.192 0 C-N-CA 123.842 0.857 . . . . 1.8 110.477 174.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -178.78 -48.83 0.01 OUTLIER 'General case' 0 CA--C 1.528 0.12 0 C-N-CA 126.121 1.768 . . . . 1.3600000000000001 106.536 -175.267 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 2.3 m -50.94 -24.02 3.31 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 115.67 1.729 . . . . 0.93999999999999995 115.67 -170.858 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -53.98 -41.51 67.96 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 119.543 1.065 . . . . 0.70999999999999996 112.273 172.124 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -74.4 -36.89 63.52 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 121.391 0.615 . . . . 1.97 109.931 178.546 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -56.26 -52.84 63.0 Favored 'General case' 0 C--O 1.234 0.263 0 C-N-CA 124.253 1.021 . . . . 2.8399999999999999 108.277 179.18 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 34.0 pt -63.14 -39.99 87.35 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.401 0 CA-C-N 115.087 -0.96 . . . . 0.90000000000000002 110.153 -177.278 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -52.43 -45.8 66.14 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 118.999 0.818 . . . . 0.90000000000000002 110.971 175.645 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.58 -59.6 5.19 Favored 'General case' 0 CA--C 1.533 0.322 0 O-C-N 122.144 -0.347 . . . . 0.79000000000000004 110.949 174.06 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -47.83 -44.3 28.77 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 124.055 0.942 . . . . 0.67000000000000004 111.933 -179.488 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -55.23 -37.04 66.66 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 125.058 1.343 . . . . 3.3900000000000001 110.831 -179.146 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.55 -42.73 12.54 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 122.478 0.311 . . . . 5.2000000000000002 110.368 -178.869 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -68.36 -36.99 80.03 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 118.073 0.397 . . . . 2.5 110.878 -174.189 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 39.5 m -116.83 69.05 0.75 Allowed 'General case' 0 C--N 1.339 0.119 0 C-N-CA 124.573 1.149 . . . . 1.4399999999999999 108.445 172.634 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 48.8 ttt180 -88.71 -55.19 3.81 Favored 'General case' 0 N--CA 1.456 -0.151 0 N-CA-C 109.352 -0.611 . . . . 5.2999999999999998 109.352 -179.247 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.419 ' O ' ' NH2' ' A' ' 76' ' ' ARG . 0.1 OUTLIER -60.53 138.03 92.59 Favored Pre-proline 0 C--O 1.224 -0.253 0 C-N-CA 124.43 1.092 . . . . 3.25 110.167 175.935 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -71.81 148.44 52.19 Favored 'Trans proline' 0 N--CA 1.458 -0.608 0 C-N-CA 123.462 2.775 . . . . 2.3199999999999998 111.294 -176.683 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.4 t70 82.83 4.14 1.01 Allowed 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 127.396 2.278 . . . . 2.4500000000000002 111.27 179.176 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 18.2 m -87.13 -7.28 58.17 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.621 1.168 . . . . 0.78000000000000003 112.935 -177.89 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -86.09 82.97 7.88 Favored 'General case' 0 CA--C 1.534 0.356 0 O-C-N 120.041 -1.662 . . . . 2.9900000000000002 113.196 -155.594 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -65.31 139.93 97.62 Favored Pre-proline 0 CA--C 1.534 0.364 0 O-C-N 121.64 -0.662 . . . . 2.1899999999999999 110.364 175.0 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -68.06 -63.18 0.05 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.17 0 C-N-CA 122.605 2.204 . . . . 0.82999999999999996 111.53 -176.263 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -53.94 -42.63 69.04 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 124.21 1.004 . . . . 2.7000000000000002 110.88 179.446 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -54.32 -61.56 2.23 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 123.052 0.541 . . . . 4.5099999999999998 109.714 174.858 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 8.4 t80 -53.72 -53.88 45.85 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-O 122.252 1.025 . . . . 2.1600000000000001 110.839 -177.238 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.548 ' CE1' ' HA ' ' A' ' 107' ' ' VAL . 2.7 t80 -40.0 -56.32 1.87 Allowed 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.275 1.43 . . . . 4.7699999999999996 111.81 175.2 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -70.55 -41.51 72.37 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 123.55 0.74 . . . . 2.5899999999999999 110.27 -179.457 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.2 t -63.86 -38.38 90.88 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 118.403 0.547 . . . . 1.46 110.926 -170.512 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 38.5 m -60.33 -57.09 14.26 Favored 'General case' 0 N--CA 1.443 -0.789 0 N-CA-C 107.656 -1.239 . . . . 3.3300000000000001 107.656 170.777 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 116.92 21.13 4.67 Favored Glycine 0 CA--C 1.525 0.708 0 N-CA-C 110.266 -1.134 . . . . 1.5 110.266 -172.896 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 1.8 mt -65.72 -24.6 67.02 Favored 'General case' 0 N--CA 1.451 -0.4 0 O-C-N 121.199 -1.177 . . . . 1.8899999999999999 109.587 176.203 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.406 ' HB2' ' CZ ' ' A' ' 31' ' ' PHE . 21.5 t -63.49 -18.6 63.97 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.196 0.598 . . . . 2.4300000000000002 110.4 173.07 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.24 -27.41 16.17 Favored 'General case' 0 N--CA 1.447 -0.585 0 O-C-N 121.665 -0.647 . . . . 5.5199999999999996 110.0 176.814 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 27.4 mmt -69.11 134.23 49.06 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 121.425 0.631 . . . . 3.5800000000000001 111.231 176.189 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 73.8 m -65.6 151.28 46.84 Favored 'General case' 0 N--CA 1.452 -0.326 0 O-C-N 121.876 -0.515 . . . . 1.6299999999999999 110.715 175.892 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -39.25 -41.2 0.85 Allowed 'General case' 0 C--O 1.224 -0.241 0 C-N-CA 125.595 1.558 . . . . 0.51000000000000001 111.998 172.488 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 65.6 m-20 -50.13 -59.83 3.54 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 124.049 0.94 . . . . 1.4399999999999999 110.744 175.864 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -72.11 -35.03 69.06 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 109.181 -0.674 . . . . 3.5099999999999998 109.181 -173.357 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 79.0 t -59.64 -43.04 90.3 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 O-C-N 121.584 -0.698 . . . . 0.46000000000000002 109.869 174.084 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 60.6 tttt -69.5 -42.02 75.29 Favored 'General case' 0 CA--C 1.536 0.417 0 O-C-N 120.809 -1.182 . . . . 2.5499999999999998 110.573 178.961 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -50.82 -61.41 2.23 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.33 0.652 . . . . 3.2200000000000002 110.349 171.475 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.637 HG12 HG22 ' A' ' 3' ' ' ILE . 18.0 m -54.85 -46.99 75.67 Favored 'Isoleucine or valine' 0 C--N 1.34 0.178 0 CA-C-O 118.214 -0.898 . . . . 0.5 110.821 178.499 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 25.6 t80 -43.99 -52.72 6.81 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 119.127 0.876 . . . . 4.3399999999999999 111.175 174.704 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 78.2 mtp180 -60.55 -37.38 81.04 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 120.499 -0.481 . . . . 3.3999999999999999 111.451 179.569 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 11.5 t80 -64.64 -34.19 77.71 Favored 'General case' 0 CA--C 1.534 0.348 0 O-C-N 122.274 -0.266 . . . . 3.9399999999999999 110.479 175.837 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.445 HG22 HD21 ' A' ' 59' ' ' LEU . 6.4 mm -68.58 -53.4 27.87 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 N-CA-C 109.909 -0.404 . . . . 1.4199999999999999 109.909 175.503 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -78.06 60.6 2.43 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.754 0.822 . . . . 2.1499999999999999 111.507 -172.026 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -52.05 -32.32 33.95 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 126.916 2.086 . . . . 1.97 113.334 -172.466 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 11.3 p-10 -72.25 -33.46 67.51 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.813 1.245 . . . . 2.5699999999999998 111.728 178.278 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . 0.279 0.8 OUTLIER 75.33 22.18 1.73 Allowed 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 127.166 2.187 . . . . 4.7699999999999996 114.698 -179.616 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 99.3 p -50.2 -29.13 8.7 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 120.039 1.291 . . . . 1.74 112.467 173.851 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 107.59 -24.99 22.66 Favored Glycine 0 C--N 1.338 0.681 0 N-CA-C 109.335 -1.506 . . . . 1.47 109.335 -172.595 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 96.8 m-85 -115.35 135.04 54.55 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 124.274 1.03 . . . . 2.5299999999999998 108.813 -179.63 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.445 HD21 HG22 ' A' ' 51' ' ' ILE . 6.6 mt -71.72 75.7 0.84 Allowed 'General case' 0 N--CA 1.448 -0.552 0 N-CA-C 106.896 -1.52 . . . . 2.6899999999999999 106.896 160.318 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -66.02 160.77 23.0 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 108.635 -0.876 . . . . 2.8599999999999999 108.635 172.63 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -52.38 -39.01 60.28 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.91 0.884 . . . . 3.7999999999999998 113.269 -170.199 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -66.2 -49.8 66.06 Favored 'General case' 0 N--CA 1.453 -0.31 0 O-C-N 121.714 -0.616 . . . . 3.4900000000000002 110.293 -175.517 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -61.25 -31.76 71.56 Favored 'General case' 0 C--N 1.329 -0.317 0 O-C-N 121.25 -0.907 . . . . 3.02 110.816 174.08 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -53.78 -36.58 62.57 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 117.867 0.303 . . . . 2.4399999999999999 111.558 168.996 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 33.0 ttpt -61.53 -9.18 5.28 Favored 'General case' 0 CA--C 1.54 0.564 0 O-C-N 121.292 -0.88 . . . . 2.3100000000000001 112.487 173.612 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 76.8 m-85 -128.56 28.63 5.39 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 124.301 1.04 . . . . 4.4299999999999997 111.424 171.43 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -59.08 -62.85 1.58 Allowed 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 118.652 0.66 . . . . 3.46 109.856 -177.031 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 47.1 mt -92.44 -9.42 41.64 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.442 0.697 . . . . 3.0299999999999998 112.14 -178.249 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 43.9 mm-40 -54.19 -33.42 58.12 Favored 'General case' 0 N--CA 1.463 0.193 0 O-C-N 121.514 -0.741 . . . . 1.6399999999999999 110.989 171.423 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.45 -28.69 63.56 Favored 'General case' 0 CA--C 1.533 0.311 0 O-C-N 122.155 -0.341 . . . . 3.2400000000000002 111.294 176.376 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 4.4 m-30 -85.82 -58.59 2.59 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 108.501 -0.925 . . . . 3.1200000000000001 108.501 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -140.73 127.85 20.87 Favored 'General case' 0 C--N 1.34 0.174 0 N-CA-C 109.141 -0.688 . . . . 3.3399999999999999 109.141 -171.302 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 5.9 p -55.33 -27.1 44.84 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 123.973 0.909 . . . . 3.02 112.269 -179.096 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -106.1 22.84 30.47 Favored Glycine 0 CA--C 1.526 0.722 0 CA-C-O 118.54 -1.144 . . . . 1.8400000000000001 112.04 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -54.48 -68.29 0.2 Allowed 'General case' 0 C--N 1.343 0.289 0 CA-C-N 118.805 1.303 . . . . 3.4399999999999999 111.819 -174.12 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . 0.419 ' NH2' ' O ' ' A' ' 21' ' ' ASP . 1.2 tpt180 -173.52 -47.73 0.01 OUTLIER 'General case' 0 C--N 1.339 0.136 0 N-CA-C 112.735 0.643 . . . . 3.2000000000000002 112.735 178.7 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -39.71 -31.31 0.1 Allowed 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 129.191 2.996 . . . . 3.7000000000000002 114.598 -163.135 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.409 HD22 ' H ' ' A' ' 78' ' ' LEU . 0.3 OUTLIER -31.03 -51.95 0.17 Allowed 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 126.353 1.861 . . . . 1.3600000000000001 112.158 165.322 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -82.89 121.78 27.4 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 122.91 0.484 . . . . 2.7000000000000002 110.304 178.576 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -55.62 -31.03 61.93 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 116.215 -0.448 . . . . 3.1699999999999999 111.617 176.414 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 7.9 t -58.58 -60.58 3.59 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 108.711 -0.848 . . . . 1.28 108.711 -176.659 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -65.42 -41.88 93.11 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 122.799 0.44 . . . . 2.9199999999999999 110.216 -174.315 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 1.2 m -49.01 -52.1 27.04 Favored 'General case' 0 C--N 1.344 0.333 0 N-CA-C 109.709 -0.478 . . . . 0.97999999999999998 109.709 169.816 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 51.5 mtmt -70.37 -29.1 65.67 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-O 118.311 -0.852 . . . . 4.6299999999999999 112.729 -178.779 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 10.8 m -57.6 -46.41 84.1 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 120.783 1.628 . . . . 1.98 110.085 168.691 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -60.48 -57.39 12.96 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 109.202 -0.666 . . . . 2.2000000000000002 109.202 175.271 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 17.0 ttp -47.78 -52.51 18.47 Favored 'General case' 0 C--O 1.225 -0.224 0 C-N-CA 124.026 0.93 . . . . 3.0899999999999999 111.477 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -51.89 -44.27 63.67 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 126.407 1.883 . . . . 0.65000000000000002 111.524 -172.01 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -80.58 -52.49 7.54 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-O 119.619 -0.229 . . . . 0.68000000000000005 110.595 175.964 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -48.54 -44.6 36.55 Favored 'General case' 0 C--N 1.339 0.122 0 C-N-CA 123.876 0.87 . . . . 0.46999999999999997 111.858 -175.682 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -72.72 80.39 1.12 Allowed 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 109.286 -0.635 . . . . 0.93000000000000005 109.286 177.624 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 45.3 p-10 -76.97 50.4 0.72 Allowed 'General case' 0 CA--C 1.537 0.457 0 O-C-N 121.399 -0.813 . . . . 2.5800000000000001 110.972 176.095 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 37.5 m-20 -137.01 -61.63 0.66 Allowed 'General case' 0 C--N 1.341 0.214 0 C-N-CA 126.381 1.872 . . . . 1.46 109.412 178.398 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 105.04 45.8 1.33 Allowed Glycine 0 CA--C 1.534 1.247 0 C-N-CA 125.263 1.411 . . . . 1.01 110.339 -161.618 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -127.18 -57.69 1.3 Allowed 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 125.359 1.464 . . . . 2.1600000000000001 110.554 172.696 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 123.5 -25.19 6.32 Favored Glycine 0 CA--C 1.531 1.056 0 C-N-CA 124.83 1.205 . . . . 0.66000000000000003 111.734 176.505 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 19.1 mtpp -78.98 112.83 16.57 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 106.459 -1.682 . . . . 4.0999999999999996 106.459 175.824 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 5.9 mt -100.15 140.76 18.52 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.292 0 N-CA-C 107.95 -1.13 . . . . 0.71999999999999997 107.95 -175.723 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -114.45 177.41 17.56 Favored Glycine 0 C--N 1.334 0.418 0 N-CA-C 110.82 -0.912 . . . . 0.60999999999999999 110.82 176.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -61.17 -39.07 88.76 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 109.511 -0.551 . . . . 0.65000000000000002 109.511 176.564 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -55.91 -63.71 1.09 Allowed 'General case' 0 N--CA 1.449 -0.509 0 O-C-N 123.536 0.523 . . . . 2.2999999999999998 109.987 173.432 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -49.1 -47.77 44.94 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.012 0.925 . . . . 2.2000000000000002 110.837 -179.718 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 58.2 t80 -62.16 -55.86 24.55 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 123.114 0.565 . . . . 4.2800000000000002 111.162 -179.088 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 14.2 tt0 -52.58 -42.42 64.48 Favored 'General case' 0 C--O 1.219 -0.544 0 C-N-CA 123.558 0.743 . . . . 2.5600000000000001 109.379 175.542 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -53.02 -57.32 10.76 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 124.16 0.984 . . . . 3.96 110.093 178.438 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -55.19 -51.59 66.05 Favored 'General case' 0 C--O 1.23 0.071 0 CA-C-O 121.493 0.663 . . . . 3.3599999999999999 109.499 175.564 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . 0.548 ' HA ' ' CE1' ' A' ' 31' ' ' PHE . 92.2 t -73.03 -5.97 7.34 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 CA-C-N 115.533 -0.758 . . . . 1.47 112.978 -172.369 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 78.8 t60 -91.41 -8.63 47.35 Favored 'General case' 0 CA--C 1.536 0.436 0 O-C-N 120.721 -1.237 . . . . 3.02 110.421 174.096 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 21.1 t . . . . . 0 C--O 1.252 1.208 0 CA-C-O 114.39 -2.719 . . . . 2.3700000000000001 113.91 -168.89 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.428 ' HB3' ' CB ' ' A' ' 5' ' ' ASP . 12.3 mmt . . . . . 0 N--CA 1.471 0.578 0 CA-C-O 118.425 -0.798 . . . . 7.4500000000000002 108.873 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 50.6 m -96.24 -169.72 1.97 Allowed 'General case' 0 N--CA 1.454 -0.23 0 O-C-N 124.36 1.037 . . . . 2.6699999999999999 108.801 175.332 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.473 HG21 HG12 ' A' ' 47' ' ' VAL . 1.6 pp -58.6 -35.97 57.53 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 O-C-N 121.781 -0.574 . . . . 1.8200000000000001 110.469 -178.414 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 1.5 t -86.41 53.43 2.8 Favored 'General case' 0 N--CA 1.44 -0.942 0 C-N-CA 126.202 1.801 . . . . 3.0899999999999999 108.094 -168.77 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.428 ' CB ' ' HB3' ' A' ' 1' ' ' MET . 4.8 m-20 -174.65 -56.51 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.144 0 N-CA-C 107.494 -1.298 . . . . 4.5499999999999998 107.494 -170.595 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 13.9 t -46.97 -40.67 5.15 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.236 0 C-N-CA 126.081 1.752 . . . . 1.5900000000000001 110.942 -175.914 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.578 HD23 ' CE ' ' A' ' 39' ' ' MET . 4.5 tp -164.62 -55.1 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 105.823 -1.917 . . . . 1.51 105.823 175.381 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -52.09 -15.96 0.68 Allowed 'General case' 0 N--CA 1.445 -0.69 0 N-CA-C 115.482 1.66 . . . . 0.81000000000000005 115.482 -168.118 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -50.72 -49.39 57.79 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 120.63 1.559 . . . . 0.81000000000000005 111.36 168.179 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -64.55 -40.33 95.39 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-O 122.462 1.125 . . . . 2.2200000000000002 109.753 -178.739 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -67.5 -49.57 62.87 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-N 115.395 -0.82 . . . . 2.6699999999999999 109.247 -175.705 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 19.1 pt -60.1 -40.78 84.33 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.802 0 O-C-N 121.634 -0.666 . . . . 0.76000000000000001 110.764 174.972 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -54.28 -47.8 71.94 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 119.179 0.899 . . . . 0.78000000000000003 111.019 174.302 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.45 -58.49 8.37 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 121.861 -0.524 . . . . 0.73999999999999999 110.739 174.583 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.459 ' HB2' ' CG2' ' A' ' 33' ' ' THR . . . -46.91 -47.06 21.62 Favored 'General case' 0 C--O 1.232 0.165 0 C-N-CA 126.81 2.044 . . . . 0.71999999999999997 111.736 -178.322 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -55.75 -41.7 74.33 Favored 'General case' 0 N--CA 1.445 -0.709 0 C-N-CA 125.751 1.621 . . . . 2.7200000000000002 108.883 -179.121 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 17.1 tt0 -83.06 -50.95 7.98 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 108.991 -0.744 . . . . 2.9100000000000001 108.991 -175.093 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.9 pp20? -61.88 -34.55 76.22 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 115.835 -0.62 . . . . 2.2999999999999998 110.937 -170.849 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 96.6 m -121.39 67.04 0.88 Allowed 'General case' 0 C--O 1.235 0.305 0 C-N-CA 123.802 0.841 . . . . 2.0699999999999998 109.189 168.238 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 16.6 ttp180 -84.23 -3.07 57.95 Favored 'General case' 0 N--CA 1.469 0.491 0 O-C-N 121.102 -0.999 . . . . 4.2800000000000002 112.908 174.809 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -113.28 152.17 44.94 Favored Pre-proline 0 CA--C 1.537 0.464 0 C-N-CA 123.798 0.839 . . . . 2.6899999999999999 112.064 -162.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -63.67 123.83 12.66 Favored 'Trans proline' 0 N--CA 1.453 -0.894 0 C-N-CA 122.891 2.394 . . . . 1.28 111.21 -169.549 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.9 t0 67.78 19.0 9.71 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 125.328 1.451 . . . . 3.2599999999999998 112.336 173.654 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 26.6 m -83.14 -16.62 46.03 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.318 1.047 . . . . 0.93999999999999995 111.784 176.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.416 ' HZ ' ' HB1' ' A' ' 15' ' ' ALA . 0.1 OUTLIER -94.53 98.36 10.78 Favored 'General case' 0 CA--C 1.539 0.538 0 O-C-N 121.922 -0.486 . . . . 4.0599999999999996 111.116 -155.87 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -78.8 155.61 77.94 Favored Pre-proline 0 CA--C 1.535 0.381 0 O-C-N 121.725 -0.61 . . . . 2.8100000000000001 110.667 -179.073 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -71.28 -61.2 0.05 OUTLIER 'Trans proline' 0 N--CA 1.45 -1.072 0 C-N-CA 122.595 2.197 . . . . 0.77000000000000002 111.666 -176.632 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 -59.39 -38.06 79.55 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 118.317 0.508 . . . . 2.46 110.646 -179.212 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 1.1 tptp -55.09 -62.55 1.59 Allowed 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 109.635 -0.506 . . . . 4.1200000000000001 109.635 170.7 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -53.74 -55.25 27.97 Favored 'General case' 0 C--O 1.218 -0.555 0 C-N-CA 124.335 1.054 . . . . 2.4300000000000002 109.947 -174.845 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.466 ' CE1' ' HA ' ' A' ' 107' ' ' VAL . 3.4 t80 -33.03 -66.71 0.13 Allowed 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 128.774 2.83 . . . . 4.7599999999999998 112.4 176.47 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 24.6 mt-30 -61.22 -46.31 90.96 Favored 'General case' 0 C--O 1.226 -0.16 0 N-CA-C 109.574 -0.528 . . . . 3.0600000000000001 109.574 179.668 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.459 ' CG2' ' HB2' ' A' ' 15' ' ' ALA . 0.7 OUTLIER -59.08 -30.5 68.12 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 113.239 0.829 . . . . 0.67000000000000004 113.239 -178.411 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 23.6 t -84.06 -2.67 57.13 Favored 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 125.082 1.353 . . . . 1.46 109.961 179.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 79.68 2.59 88.33 Favored Glycine 0 C--N 1.337 0.633 0 N-CA-C 110.728 -0.949 . . . . 0.68000000000000005 110.728 174.726 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.438 ' HB3' HG13 ' A' ' 107' ' ' VAL . 96.0 mt -68.06 -22.08 64.96 Favored 'General case' 0 N--CA 1.442 -0.833 0 O-C-N 121.507 -0.996 . . . . 1.3899999999999999 110.941 -172.338 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 13.9 t -71.49 -28.03 63.63 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 123.716 0.806 . . . . 2.1499999999999999 109.871 172.697 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 12.9 tttt -84.56 -36.49 22.09 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 124.012 0.925 . . . . 4.3099999999999996 108.899 -179.642 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.578 ' CE ' HD23 ' A' ' 7' ' ' LEU . 0.0 OUTLIER -55.69 128.51 35.13 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 121.228 0.537 . . . . 2.5499999999999998 110.139 176.02 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 28.8 t -64.11 154.69 33.78 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 109.152 -0.684 . . . . 2.3399999999999999 109.152 176.457 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -40.21 -43.45 1.68 Allowed 'General case' 0 C--N 1.34 0.174 0 C-N-CA 124.654 1.182 . . . . 1.0600000000000001 111.368 173.396 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 50.6 m-80 -45.92 -64.11 0.82 Allowed 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.617 1.167 . . . . 2.3500000000000001 110.764 172.874 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.652 ' O ' HG13 ' A' ' 47' ' ' VAL . 46.2 mt-30 -64.71 -39.35 93.5 Favored 'General case' 0 C--O 1.219 -0.504 0 C-N-CA 124.028 0.931 . . . . 3.48 110.555 -176.803 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.434 HG13 HG11 ' A' ' 107' ' ' VAL . 75.6 t -61.73 -46.45 96.5 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 CA-C-N 119.592 1.087 . . . . 0.55000000000000004 110.007 179.613 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 12.3 tttt -63.26 -36.48 83.81 Favored 'General case' 0 CA--C 1.535 0.382 0 O-C-N 121.834 -0.541 . . . . 3.0800000000000001 109.983 177.312 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -62.03 -52.44 63.95 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 122.555 0.342 . . . . 3.1200000000000001 111.081 174.003 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.652 HG13 ' O ' ' A' ' 43' ' ' GLN . 1.5 m -57.41 -47.37 84.91 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.306 0 O-C-N 121.563 -0.711 . . . . 1.3600000000000001 109.275 -179.526 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.541 ' CZ ' ' HB2' ' A' ' 100' ' ' ALA . 40.6 t80 -43.41 -58.86 2.38 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.285 1.034 . . . . 4.54 111.159 171.116 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 67.7 mtp180 -63.99 -36.31 83.57 Favored 'General case' 0 N--CA 1.465 0.312 0 O-C-N 121.558 -0.714 . . . . 3.29 112.867 178.626 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -55.49 -44.8 76.87 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 118.822 0.737 . . . . 3.5899999999999999 109.556 175.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.494 HD11 ' CE1' ' A' ' 71' ' ' PHE . 3.1 mp -70.53 -48.07 61.35 Favored 'Isoleucine or valine' 0 C--O 1.236 0.357 0 CA-C-O 117.914 -1.041 . . . . 1.97 112.01 176.791 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 26.4 t0 -70.29 68.4 0.34 Allowed 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 123.537 0.735 . . . . 1.8999999999999999 110.453 -178.04 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 20.1 t30 -56.53 -41.17 76.33 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 126.794 2.038 . . . . 2.1600000000000001 110.976 -177.341 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -67.61 -14.65 63.13 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.273 1.029 . . . . 2.29 112.116 175.433 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 8.9 mt-30 49.36 57.44 6.48 Favored 'General case' 0 C--N 1.341 0.205 0 C-N-CA 125.223 1.409 . . . . 2.8399999999999999 110.342 -179.195 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 95.9 p -89.86 -18.74 25.62 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 115.434 -0.803 . . . . 1.55 110.314 176.242 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 80.96 19.9 66.46 Favored Glycine 0 CA--C 1.529 0.941 0 N-CA-C 110.652 -0.979 . . . . 1.3500000000000001 110.652 -169.532 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 77.0 m-85 -145.49 131.5 19.26 Favored 'General case' 0 CA--C 1.515 -0.389 0 C-N-CA 123.982 0.913 . . . . 2.1400000000000001 109.336 179.26 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.487 HD23 ' CE1' ' A' ' 48' ' ' PHE . 0.4 OUTLIER -77.89 81.04 4.32 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 104.618 -2.364 . . . . 1.8799999999999999 104.618 160.672 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -67.8 166.86 14.54 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 114.098 -1.41 . . . . 2.6299999999999999 108.176 168.596 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -53.22 -48.1 68.44 Favored 'General case' 0 N--CA 1.452 -0.338 0 O-C-N 121.286 -0.884 . . . . 3.8900000000000001 112.332 -172.394 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.58 -39.34 80.07 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 111.646 0.239 . . . . 4.7699999999999996 111.646 -172.09 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -53.03 -36.96 61.11 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 118.692 0.678 . . . . 2.3799999999999999 112.386 173.333 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 25.4 mt -67.46 -29.23 68.63 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 118.187 0.449 . . . . 2.3399999999999999 110.204 176.816 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 27.5 ttpt -69.31 -2.39 10.63 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 118.515 -0.755 . . . . 2.5 111.306 170.172 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 17.1 p90 -148.26 44.01 1.04 Allowed 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 119.96 1.255 . . . . 5.1500000000000004 113.97 166.59 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 50.8 t80 -71.99 -68.54 0.45 Allowed 'General case' 0 CA--C 1.538 0.499 0 O-C-N 120.894 -1.129 . . . . 2.2799999999999998 110.393 -172.154 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 3.0 mp -73.38 -9.99 59.27 Favored 'General case' 0 C--O 1.234 0.242 0 C-N-CA 124.437 1.095 . . . . 2.0499999999999998 112.33 173.863 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.66 -26.27 61.41 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 119.007 0.821 . . . . 2.6400000000000001 111.326 178.622 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -92.47 -17.03 25.07 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.473 1.109 . . . . 2.6699999999999999 111.061 178.631 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.494 ' CE1' HD11 ' A' ' 51' ' ' ILE . 9.9 m-30 -82.05 -69.43 0.62 Allowed 'General case' 0 C--O 1.224 -0.275 0 N-CA-C 107.496 -1.298 . . . . 3.1299999999999999 107.496 175.256 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 25.9 tp10 -97.79 -49.44 4.82 Favored 'General case' 0 C--O 1.227 -0.094 0 C-N-CA 123.451 0.7 . . . . 3.4199999999999999 109.148 -173.486 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 82.62 109.12 0.06 Allowed 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 124.751 1.22 . . . . 3.1699999999999999 110.161 -172.417 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 93.58 32.53 7.62 Favored Glycine 0 CA--C 1.53 0.984 0 C-N-CA 124.541 1.067 . . . . 1.3 111.123 -174.933 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -85.92 -156.39 0.28 Allowed 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 123.922 0.889 . . . . 1.46 109.34 171.088 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.25 1.07 55.32 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 113.685 0.995 . . . . 3.52 113.685 -164.232 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -42.5 -37.41 1.62 Allowed 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 126.711 2.004 . . . . 2.8599999999999999 113.443 -168.07 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.823 HD22 ' H ' ' A' ' 78' ' ' LEU . 0.2 OUTLIER -57.97 -45.47 86.67 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.24 1.416 . . . . 0.97999999999999998 112.017 177.094 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 88.2 m -64.0 108.32 1.48 Allowed 'General case' 0 C--O 1.235 0.319 0 C-N-CA 124.064 0.946 . . . . 0.81000000000000005 110.679 -179.434 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 8.5 mp0 -69.24 -38.83 78.67 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-N 114.644 -1.162 . . . . 3.4399999999999999 110.572 -173.516 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 16.0 m -51.2 -52.61 42.71 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 119.455 1.025 . . . . 1.3200000000000001 111.172 176.692 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 18.4 tt0 -67.3 -48.81 66.54 Favored 'General case' 0 N--CA 1.446 -0.643 0 C-N-CA 124.084 0.954 . . . . 4.3300000000000001 109.709 -176.064 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -52.87 -46.22 67.78 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 122.164 0.983 . . . . 0.71999999999999997 108.938 178.089 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 17.1 tttt -69.73 -33.6 72.69 Favored 'General case' 0 N--CA 1.444 -0.766 0 C-N-CA 125.55 1.54 . . . . 4.2400000000000002 111.316 -179.545 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.6 t -58.73 -48.11 82.29 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 119.71 1.141 . . . . 1.6399999999999999 109.145 172.464 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -57.16 -55.43 34.9 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 108.905 -0.776 . . . . 2.3799999999999999 108.905 173.984 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 5.9 ttt -47.39 -47.0 26.48 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 112.341 0.497 . . . . 3.8500000000000001 112.341 177.151 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -60.19 -46.12 90.82 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 125.592 1.557 . . . . 0.48999999999999999 111.193 -169.912 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -84.84 -33.56 22.86 Favored 'General case' 0 C--O 1.227 -0.11 0 N-CA-C 111.776 0.287 . . . . 0.70999999999999996 111.776 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -63.63 -39.19 93.72 Favored 'General case' 0 N--CA 1.456 -0.15 0 CA-C-N 117.982 0.356 . . . . 0.38 111.114 176.362 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 24.0 t0 -67.26 117.46 9.29 Favored 'General case' 0 N--CA 1.446 -0.651 0 N-CA-C 108.808 -0.812 . . . . 1.6899999999999999 108.808 176.806 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 9.7 m-20 -100.1 10.76 40.76 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 118.649 -0.691 . . . . 2.7200000000000002 111.369 178.51 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 25.9 m-20 -103.62 -56.25 2.24 Favored 'General case' 0 C--N 1.343 0.301 0 CA-C-N 119.017 0.826 . . . . 1.3799999999999999 111.004 175.089 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 99.57 48.47 1.66 Allowed Glycine 0 CA--C 1.53 1.023 0 N-CA-C 108.751 -1.74 . . . . 0.93999999999999995 108.751 -156.604 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 58.6 p-10 -128.97 -48.65 1.22 Allowed 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 127.119 2.168 . . . . 2.0099999999999998 109.815 177.705 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 127.55 -66.01 0.57 Allowed Glycine 0 CA--C 1.523 0.585 0 C-N-CA 126.862 2.172 . . . . 1.27 108.129 -177.791 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 60.6 pttt -48.35 135.24 14.01 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.368 1.067 . . . . 4.4900000000000002 111.233 -178.863 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 4.1 mt -117.76 108.28 24.19 Favored 'Isoleucine or valine' 0 C--O 1.232 0.176 0 C-N-CA 124.54 1.136 . . . . 0.81999999999999995 109.41 -173.351 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -68.7 168.24 43.68 Favored Glycine 0 CA--C 1.534 1.25 0 N-CA-C 111.572 -0.611 . . . . 0.79000000000000004 111.572 171.025 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . 0.541 ' HB2' ' CZ ' ' A' ' 48' ' ' PHE . . . -62.39 -38.34 89.25 Favored 'General case' 0 C--N 1.34 0.192 0 O-C-N 121.569 -0.959 . . . . 0.88 109.893 175.375 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -53.48 -54.88 30.77 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 123.25 0.62 . . . . 2.4700000000000002 110.208 172.751 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -55.46 -50.92 68.6 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.254 0.621 . . . . 1.3 111.011 178.743 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 77.5 t80 -57.12 -57.13 13.91 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.389 -0.369 . . . . 3.9500000000000002 110.902 -179.704 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -54.78 -44.33 73.62 Favored 'General case' 0 C--O 1.219 -0.504 0 C-N-CA 124.17 0.988 . . . . 2.1899999999999999 110.122 177.765 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -52.44 -59.32 4.58 Favored 'General case' 0 CA--C 1.523 -0.068 0 CA-C-N 119.761 1.164 . . . . 3.1000000000000001 110.464 176.733 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.76 -50.66 69.81 Favored 'General case' 0 CA--C 1.531 0.236 0 N-CA-C 108.39 -0.967 . . . . 2.7799999999999998 108.39 -179.215 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . 0.466 ' HA ' ' CE1' ' A' ' 31' ' ' PHE . 85.4 t -69.53 -13.09 16.83 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.794 0 N-CA-C 113.001 0.741 . . . . 1.48 113.001 -175.784 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 41.6 t-80 -88.09 -5.12 58.63 Favored 'General case' 0 CA--C 1.539 0.555 0 O-C-N 120.43 -1.419 . . . . 2.6899999999999999 110.542 175.329 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 23.0 t . . . . . 0 C--O 1.253 1.262 0 CA-C-O 115.307 -2.283 . . . . 2.4500000000000002 113.275 -175.039 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.0 tpt . . . . . 0 N--CA 1.466 0.336 0 N-CA-C 112.007 0.373 . . . . 6.9900000000000002 112.007 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 50.3 m -147.04 -67.85 0.26 Allowed 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 107.109 -1.441 . . . . 2.29 107.109 172.396 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.685 HG22 HG12 ' A' ' 47' ' ' VAL . 1.6 pp -69.82 -36.4 69.49 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.285 0 CA-C-O 121.649 0.738 . . . . 1.5 111.068 176.288 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.476 ' O ' ' HB2' ' A' ' 9' ' ' ALA . 16.6 p -73.67 -2.68 24.14 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 112.53 0.567 . . . . 3.3999999999999999 112.53 -173.51 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -104.23 -35.03 8.15 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 118.668 0.667 . . . . 3.7200000000000002 111.417 177.702 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 17.1 m -71.57 -44.73 70.01 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.246 0 N-CA-C 112.453 0.538 . . . . 2.4399999999999999 112.453 -169.476 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -175.66 -58.14 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.161 0 N-CA-C 106.16 -1.793 . . . . 1.1299999999999999 106.16 -172.94 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 4.9 m -44.63 -22.81 0.09 Allowed 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 127.072 2.149 . . . . 1.0700000000000001 115.84 -168.625 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.476 ' HB2' ' O ' ' A' ' 4' ' ' THR . . . -47.67 -51.15 22.69 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 120.298 1.408 . . . . 0.56999999999999995 112.523 168.047 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -64.6 -39.31 93.49 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-O 122.545 1.164 . . . . 1.95 109.514 -177.961 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -67.97 -45.36 74.4 Favored 'General case' 0 N--CA 1.442 -0.849 0 C-N-CA 124.463 1.105 . . . . 2.2599999999999998 109.196 -174.291 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 37.7 pt -63.37 -38.06 81.17 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.803 0 O-C-N 121.458 -0.776 . . . . 0.73999999999999999 110.591 174.845 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.8 -46.32 81.65 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 118.994 0.816 . . . . 0.68000000000000005 110.487 173.247 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.12 -57.51 12.51 Favored 'General case' 0 CA--C 1.533 0.314 0 O-C-N 122.032 -0.417 . . . . 0.63 110.843 173.785 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -47.48 -49.07 26.53 Favored 'General case' 0 C--O 1.232 0.15 0 C-N-CA 125.577 1.551 . . . . 0.62 110.71 -178.941 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -53.22 -45.09 68.54 Favored 'General case' 0 N--CA 1.444 -0.762 0 C-N-CA 125.185 1.394 . . . . 2.7999999999999998 109.731 179.638 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -79.3 -46.84 16.93 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 109.903 -0.406 . . . . 3.6699999999999999 109.903 -174.187 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -63.56 -38.08 89.76 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 110.435 -0.209 . . . . 3.5600000000000001 110.435 -175.542 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 85.5 m -101.81 46.54 0.93 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.717 0.807 . . . . 1.5 110.331 175.806 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 19.1 mtp85 -69.83 -52.74 22.37 Favored 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 108.499 -0.926 . . . . 4.21 108.499 173.803 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -61.95 138.26 95.62 Favored Pre-proline 0 N--CA 1.441 -0.899 0 CA-C-N 114.174 -1.375 . . . . 2.0800000000000001 110.398 -175.88 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -60.46 150.99 78.14 Favored 'Trans proline' 0 N--CA 1.452 -0.955 0 C-N-CA 122.623 2.215 . . . . 1.25 110.498 -176.672 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 16.9 t70 56.85 15.93 2.5 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.502 1.521 . . . . 3.3700000000000001 114.033 176.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 21.0 m -87.52 -12.52 45.63 Favored 'General case' 0 CA--C 1.534 0.364 0 O-C-N 121.004 -1.06 . . . . 0.98999999999999999 110.789 177.842 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -73.78 117.41 15.53 Favored 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 123.791 0.836 . . . . 2.4500000000000002 110.449 -171.758 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -115.21 147.1 37.77 Favored Pre-proline 0 CA--C 1.538 0.507 0 C-N-CA 125.222 1.409 . . . . 3.3399999999999999 110.943 178.037 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_endo -62.71 -76.97 0.02 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.478 0 C-N-CA 124.669 3.579 . . . . 0.70999999999999996 112.557 -175.645 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.4 tt0 -50.64 -45.2 57.69 Favored 'General case' 0 N--CA 1.445 -0.703 0 C-N-CA 124.886 1.274 . . . . 3.1899999999999999 111.092 -175.505 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 40.4 tptt -47.32 -68.51 0.18 Allowed 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 124.023 0.929 . . . . 2.8500000000000001 108.631 170.381 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -50.41 -41.76 52.78 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.358 1.063 . . . . 2.1899999999999999 112.501 -177.668 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 14.8 m-30 -54.38 -52.29 62.14 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 118.48 0.582 . . . . 4.8700000000000001 110.317 179.718 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -74.27 -37.96 63.56 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 120.338 -0.545 . . . . 3.4300000000000002 110.622 -179.278 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -62.58 -34.63 77.38 Favored 'General case' 0 N--CA 1.442 -0.847 0 C-N-CA 124.052 0.941 . . . . 0.81000000000000005 112.457 -178.686 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 14.9 m -82.65 -0.99 49.8 Favored 'General case' 0 N--CA 1.451 -0.412 0 O-C-N 123.468 0.48 . . . . 1.77 111.382 174.024 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 76.45 -2.5 57.62 Favored Glycine 0 CA--C 1.527 0.831 0 N-CA-C 111.511 -0.636 . . . . 0.72999999999999998 111.511 -177.277 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -65.29 -31.46 72.61 Favored 'General case' 0 N--CA 1.445 -0.68 0 O-C-N 121.306 -1.114 . . . . 2.3100000000000001 111.819 -172.709 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 83.0 p -77.3 -15.19 59.55 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 119.392 0.996 . . . . 1.98 112.368 172.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.93 -35.67 21.94 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 108.804 -0.813 . . . . 5.3200000000000003 108.804 175.194 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 31.8 mmt -55.94 131.51 47.36 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-O 121.834 0.826 . . . . 3.1699999999999999 110.646 171.564 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 2.0 m -70.56 159.84 33.59 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 115.398 -0.819 . . . . 1.8500000000000001 109.676 178.956 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -41.33 -43.82 2.58 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.363 1.065 . . . . 0.57999999999999996 112.138 177.543 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 66.8 m-20 -48.52 -61.57 1.95 Allowed 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 123.959 0.904 . . . . 1.52 110.304 175.906 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 22.5 mm-40 -62.15 -44.52 96.44 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 115.568 -0.742 . . . . 2.6899999999999999 109.382 -179.169 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 57.8 t -59.55 -35.35 58.66 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.63 0 CA-C-N 119.079 0.854 . . . . 0.60999999999999999 110.116 -178.237 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 3.8 tttp -67.42 -44.56 78.46 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.646 0.778 . . . . 2.7599999999999998 111.201 174.196 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 73.5 m-20 -60.61 -54.87 40.17 Favored 'General case' 0 C--O 1.233 0.219 0 O-C-N 121.986 -0.446 . . . . 2.9700000000000002 110.216 177.902 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.685 HG12 HG22 ' A' ' 3' ' ' ILE . 3.9 m -58.15 -46.52 88.39 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.241 0 CA-C-O 118.575 -0.726 . . . . 0.56999999999999995 109.567 179.237 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 4.2 t80 -41.87 -55.15 3.18 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 123.95 0.9 . . . . 4.96 110.99 170.505 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 35.9 mtt85 -59.29 -37.99 79.09 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 118.177 0.444 . . . . 3.77 111.834 177.822 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 14.5 t80 -63.94 -30.2 71.3 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 122.143 -0.348 . . . . 3.77 110.544 177.292 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.3 mm -79.7 -50.01 18.56 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 CA-C-O 118.43 -0.795 . . . . 1.5 111.212 179.519 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -69.26 72.61 0.3 Allowed 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 123.862 0.865 . . . . 2.27 108.853 -176.212 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -61.4 -31.85 71.78 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 125.684 1.594 . . . . 2.0099999999999998 111.407 -168.464 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 13.5 p-10 -69.64 -32.52 71.25 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 125.395 1.478 . . . . 2.4900000000000002 111.815 171.237 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 59.23 80.04 0.21 Allowed 'General case' 0 N--CA 1.445 -0.677 0 CA-C-O 122.228 1.013 . . . . 3.0600000000000001 109.084 -177.577 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 4.9 p -118.08 -70.25 0.8 Allowed 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 107.844 -1.169 . . . . 2.3799999999999999 107.844 175.176 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 147.68 35.04 0.05 OUTLIER Glycine 0 CA--C 1.53 1.004 0 C-N-CA 126.781 2.134 . . . . 1.78 111.589 -179.831 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 33.0 m-85 -159.71 129.38 5.38 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 105.451 -2.055 . . . . 2.1400000000000001 105.451 -178.803 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -86.42 75.58 9.76 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 105.202 -2.148 . . . . 2.0099999999999998 105.202 166.302 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -55.77 133.3 50.91 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 113.874 -1.512 . . . . 1.6200000000000001 107.724 175.797 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -48.51 -46.07 38.0 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 119.073 0.851 . . . . 5.5899999999999999 113.151 -164.411 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -56.12 -31.42 63.3 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 122.705 0.402 . . . . 3.0499999999999998 111.487 -176.923 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 92.4 mt-10 -66.82 -34.34 77.59 Favored 'General case' 0 N--CA 1.453 -0.3 0 O-C-N 120.964 -1.085 . . . . 1.8799999999999999 110.954 176.66 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 86.9 mt -62.78 -29.21 70.53 Favored 'General case' 0 N--CA 1.456 -0.17 0 O-C-N 122.05 -0.406 . . . . 2.7400000000000002 110.459 176.343 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 65.9 tttt -60.9 -7.37 2.35 Favored 'General case' 0 CA--C 1.543 0.675 0 O-C-N 121.75 -0.594 . . . . 4.0999999999999996 112.426 171.438 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 11.8 t80 -137.96 37.42 2.36 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.145 0.978 . . . . 5.7300000000000004 110.596 168.214 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -75.84 -79.12 0.1 Allowed 'General case' 0 N--CA 1.464 0.231 0 O-C-N 121.434 -0.791 . . . . 2.7599999999999998 110.074 178.257 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.448 ' HB3' ' HB1' ' A' ' 75' ' ' ALA . 3.7 tt -62.75 -20.03 64.55 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.258 1.023 . . . . 2.4500000000000002 110.427 -169.349 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 93.7 mm-40 -46.71 -37.62 8.69 Favored 'General case' 0 CA--C 1.541 0.632 0 O-C-N 121.051 -1.03 . . . . 2.1699999999999999 112.013 166.154 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.68 -38.22 69.34 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 118.977 0.808 . . . . 2.7599999999999998 111.204 173.47 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 9.0 m-30 -79.4 -52.25 8.32 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 123.999 0.92 . . . . 3.21 109.698 -177.386 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -150.79 134.79 16.75 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 123.491 0.716 . . . . 3.3300000000000001 109.942 -175.325 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 15.5 t -58.86 -30.33 67.65 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.584 1.154 . . . . 3.6099999999999999 111.607 -179.551 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -87.72 16.29 51.06 Favored Glycine 0 CA--C 1.525 0.678 0 C-N-CA 125.515 1.531 . . . . 2.77 111.446 -174.95 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.448 ' HB1' ' HB3' ' A' ' 68' ' ' LEU . . . -59.17 171.32 0.75 Allowed 'General case' 0 N--CA 1.444 -0.767 0 C-N-CA 123.544 0.738 . . . . 1.5900000000000001 112.178 171.462 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 20.5 mmm180 -89.02 -27.32 20.93 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-O 118.396 -0.811 . . . . 3.8199999999999998 112.795 -176.554 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -28.15 -43.49 0.02 OUTLIER 'General case' 0 N--CA 1.461 0.088 0 C-N-CA 128.694 2.797 . . . . 3.3900000000000001 115.799 -166.822 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.492 HD22 ' H ' ' A' ' 78' ' ' LEU . 0.2 OUTLIER -40.37 -55.75 2.16 Favored 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 126.491 1.916 . . . . 1.2 110.199 174.513 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.68 133.18 42.12 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-O 122.7 1.238 . . . . 1.5600000000000001 109.432 176.058 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 48.5 mp0 -74.14 -32.39 63.12 Favored 'General case' 0 N--CA 1.436 -1.131 0 CA-C-N 113.623 -1.626 . . . . 3.46 110.513 -179.021 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 19.8 m -54.27 -66.12 0.45 Allowed 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 119.751 1.16 . . . . 1.3 111.009 176.36 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -49.53 -53.15 25.09 Favored 'General case' 0 N--CA 1.452 -0.342 0 O-C-N 122.151 -0.343 . . . . 3.4100000000000001 111.375 177.07 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -61.9 -43.5 98.72 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-O 121.813 0.816 . . . . 1.1100000000000001 110.455 -173.743 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 46.9 mmtt -64.59 -28.03 69.35 Favored 'General case' 0 C--O 1.218 -0.599 0 CA-C-O 118.6 -0.714 . . . . 5.1699999999999999 110.076 179.329 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -53.72 -44.86 70.22 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 119.467 1.031 . . . . 1.75 110.151 170.411 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.5 tt -64.29 -60.0 3.71 Favored 'General case' 0 C--N 1.342 0.249 0 O-C-N 121.85 -0.531 . . . . 3.1600000000000001 109.718 172.848 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 8.5 tmm? -48.06 -58.14 4.87 Favored 'General case' 0 CA--C 1.536 0.429 0 O-C-N 123.94 0.775 . . . . 2.7599999999999998 110.734 -173.772 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -38.64 -49.19 1.53 Allowed 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 128.105 2.562 . . . . 0.5 112.45 179.315 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -82.56 -51.79 7.45 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 110.162 -0.31 . . . . 0.53000000000000003 110.162 -178.14 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -48.83 -40.12 28.09 Favored 'General case' 0 CA--C 1.528 0.128 0 C-N-CA 124.267 1.027 . . . . 0.38 112.221 -179.528 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -72.97 83.43 1.24 Allowed 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 109.79 -0.448 . . . . 0.91000000000000003 109.79 179.121 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 46.3 m-80 -74.79 37.39 0.11 Allowed 'General case' 0 CA--C 1.539 0.526 0 O-C-N 121.383 -0.823 . . . . 2.9399999999999999 111.772 177.761 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 20.5 m-20 -121.92 -55.48 1.89 Allowed 'General case' 0 N--CA 1.458 -0.054 0 C-N-CA 124.872 1.269 . . . . 1.24 108.392 174.398 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 93.2 43.53 4.03 Favored Glycine 0 CA--C 1.531 1.071 0 N-CA-C 109.008 -1.637 . . . . 0.76000000000000001 109.008 -159.28 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -122.05 -55.73 1.87 Allowed 'General case' 0 C--N 1.34 0.182 0 C-N-CA 125.069 1.347 . . . . 2.4399999999999999 109.655 174.701 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 135.51 -58.49 0.67 Allowed Glycine 0 CA--C 1.528 0.875 0 N-CA-C 110.901 -0.879 . . . . 0.69999999999999996 110.901 -174.136 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 18.8 mttt -63.78 113.59 3.49 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 109.089 -0.708 . . . . 4.0700000000000003 109.089 -176.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 6.7 mt -90.8 150.78 3.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 N-CA-C 107.427 -1.323 . . . . 1.0 107.427 174.959 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -126.94 -178.35 15.27 Favored Glycine 0 CA--C 1.522 0.495 0 N-CA-C 109.711 -1.355 . . . . 0.54000000000000004 109.711 171.734 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -62.95 -42.67 99.89 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-N 117.288 0.544 . . . . 0.83999999999999997 109.976 -174.146 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -58.39 -63.51 1.25 Allowed 'General case' 0 N--CA 1.449 -0.515 0 CA-C-O 118.237 -0.887 . . . . 2.6200000000000001 110.282 177.37 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -45.48 -50.79 12.43 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 119.126 0.876 . . . . 1.24 111.949 175.399 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 57.6 t80 -60.98 -54.07 49.49 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 109.628 -0.508 . . . . 3.27 109.628 -175.407 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 24.9 tt0 -59.34 -46.13 89.46 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 123.769 0.828 . . . . 2.48 110.68 -179.259 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -49.58 -58.84 4.48 Favored 'General case' 0 C--O 1.23 0.038 0 CA-C-N 119.214 0.916 . . . . 3.7400000000000002 110.416 175.298 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.61 -50.2 68.09 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 120.669 -0.412 . . . . 2.71 110.589 -176.318 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 55.3 t -54.43 -39.29 44.12 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.304 0 C-N-CA 123.02 0.528 . . . . 1.28 111.227 177.912 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 13.1 t60 -66.31 -19.93 65.95 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 124.247 1.019 . . . . 2.1299999999999999 110.536 -178.161 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 4.3 t . . . . . 0 C--O 1.253 1.261 0 CA-C-O 117.506 -1.235 . . . . 3.5800000000000001 110.406 -179.989 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.3 mmt . . . . . 0 N--CA 1.471 0.623 0 N-CA-C 107.514 -1.291 . . . . 8.4499999999999993 107.514 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 42.1 t -159.96 -174.2 4.45 Favored 'General case' 0 N--CA 1.448 -0.547 0 N-CA-C 105.451 -2.055 . . . . 2.3799999999999999 105.451 166.705 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.451 ' CG2' HG12 ' A' ' 47' ' ' VAL . 5.3 pt -44.05 -38.92 1.43 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 C-N-CA 126.155 1.782 . . . . 2.73 112.877 -175.971 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 8.2 t -51.02 -27.9 8.89 Favored 'General case' 0 N--CA 1.425 -1.687 0 C-N-CA 129.326 3.05 . . . . 2.48 113.734 178.136 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 24.8 t0 -152.72 52.1 0.76 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.662 0.785 . . . . 3.5600000000000001 110.547 -178.762 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 4.5 t -118.98 -56.46 3.61 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.194 0 C-N-CA 125.139 1.376 . . . . 1.6000000000000001 109.612 175.856 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 2.4 tp -167.67 -55.92 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 105.703 -1.962 . . . . 1.0900000000000001 105.703 -177.004 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 70.1 m -51.53 -29.0 15.27 Favored 'General case' 0 N--CA 1.442 -0.871 0 N-CA-C 114.894 1.442 . . . . 1.03 114.894 -167.148 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -50.29 -42.86 53.14 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 121.151 -0.968 . . . . 0.89000000000000001 112.171 173.132 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -69.09 -38.03 78.75 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-O 121.48 0.657 . . . . 2.0699999999999998 110.462 176.293 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -58.96 -49.35 78.19 Favored 'General case' 0 C--O 1.234 0.257 0 C-N-CA 122.941 0.497 . . . . 4.9400000000000004 109.716 -179.914 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 11.5 pt -65.35 -38.88 83.62 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.41 0 N-CA-C 109.277 -0.638 . . . . 1.1100000000000001 109.277 -176.703 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -53.86 -47.7 70.77 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 118.321 0.509 . . . . 0.63 110.595 175.56 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.66 -59.22 5.73 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-O 120.512 0.196 . . . . 0.63 111.088 175.606 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -50.65 -46.83 58.61 Favored 'General case' 0 CA--C 1.528 0.117 0 C-N-CA 124.111 0.964 . . . . 0.57999999999999996 111.637 -176.827 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 5.1 mp -51.34 -37.6 48.7 Favored 'General case' 0 C--N 1.333 -0.146 0 C-N-CA 124.417 1.087 . . . . 4.0099999999999998 111.477 178.722 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -82.39 -46.62 13.31 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 109.519 -0.549 . . . . 5.2800000000000002 109.519 178.306 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -70.56 -31.16 68.09 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 112.112 0.412 . . . . 2.4199999999999999 112.112 -167.681 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 65.9 m -118.05 47.97 1.48 Allowed 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 125.572 1.549 . . . . 1.6200000000000001 108.571 171.345 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 37.9 ttt85 -68.88 -32.22 71.72 Favored 'General case' 0 CA--C 1.534 0.339 0 O-C-N 121.673 -0.642 . . . . 5.1699999999999999 109.983 173.586 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 91.8 m-20 -80.79 150.12 68.76 Favored Pre-proline 0 CA--C 1.539 0.522 0 C-N-CA 125.591 1.556 . . . . 2.25 110.924 -166.542 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -66.05 141.06 62.38 Favored 'Trans proline' 0 N--CA 1.455 -0.747 0 C-N-CA 123.105 2.537 . . . . 1.3500000000000001 110.21 -174.89 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 63.97 9.18 4.4 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.583 1.553 . . . . 2.3100000000000001 113.417 177.034 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 24.2 m -92.6 -9.52 40.74 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 119.568 1.077 . . . . 0.89000000000000001 113.221 -171.666 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -58.43 115.21 2.84 Favored 'General case' 0 N--CA 1.448 -0.569 0 O-C-N 121.764 -0.585 . . . . 2.8900000000000001 109.672 176.436 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -102.98 148.19 35.23 Favored Pre-proline 0 CA--C 1.532 0.288 0 N-CA-C 108.859 -0.793 . . . . 3.7000000000000002 108.859 164.07 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -67.23 -65.94 0.04 OUTLIER 'Trans proline' 0 N--CA 1.451 -0.998 0 C-N-CA 123.254 2.636 . . . . 1.01 111.02 -177.062 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 35.4 mt-30 -58.8 -32.33 69.24 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 124.15 0.98 . . . . 2.3300000000000001 110.841 -178.478 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 18.6 tptm -61.37 -66.56 0.52 Allowed 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 123.5 0.72 . . . . 2.8399999999999999 109.943 173.093 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 51.3 t80 -54.38 -47.69 72.38 Favored 'General case' 0 C--O 1.221 -0.402 0 C-N-CA 122.975 0.51 . . . . 2.3599999999999999 109.896 -176.93 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 3.8 t80 -39.01 -58.47 1.11 Allowed 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 126.514 1.926 . . . . 5.1900000000000004 112.078 172.566 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 30.8 tt0 -72.09 -47.02 54.44 Favored 'General case' 0 N--CA 1.45 -0.458 0 N-CA-C 109.291 -0.633 . . . . 3.0899999999999999 109.291 -176.803 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -57.63 -34.42 69.29 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 123.197 0.599 . . . . 0.82999999999999996 110.977 -177.043 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 26.1 t -81.4 -5.03 57.46 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 125.942 1.697 . . . . 1.45 109.876 -177.862 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 74.69 4.13 69.65 Favored Glycine 0 CA--C 1.527 0.841 0 O-C-N 119.11 -2.244 . . . . 0.91000000000000003 111.608 171.912 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.419 ' HB3' HG13 ' A' ' 107' ' ' VAL . 89.8 mt -60.78 -33.98 73.8 Favored 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 124.814 1.246 . . . . 1.75 109.16 178.147 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 21.1 t -61.64 -33.97 74.86 Favored 'General case' 0 N--CA 1.462 0.156 0 C-N-CA 123.952 0.901 . . . . 2.3399999999999999 111.229 172.72 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 25.9 tttt -80.6 -36.86 32.18 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 108.403 -0.962 . . . . 4.5800000000000001 108.403 -176.747 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 25.8 mmt -69.36 135.45 50.37 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-O 121.689 0.757 . . . . 3.8999999999999999 111.832 -179.573 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 2.6 m -69.89 154.19 42.29 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 123.356 0.662 . . . . 1.8200000000000001 110.671 179.593 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -42.27 -40.02 2.29 Favored 'General case' 0 C--O 1.222 -0.359 0 C-N-CA 123.853 0.861 . . . . 0.47999999999999998 112.099 175.301 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 62.8 m-20 -47.52 -59.46 3.23 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.232 1.013 . . . . 1.5600000000000001 110.94 175.259 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 2.6 mm100 -69.19 -40.17 78.24 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 109.441 -0.577 . . . . 2.6099999999999999 109.441 -176.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 89.6 t -62.58 -36.6 75.85 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.525 0 CA-C-N 118.748 0.704 . . . . 0.48999999999999999 109.53 -178.386 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 48.2 tttm -66.26 -46.09 78.3 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 123.213 0.605 . . . . 3.0600000000000001 109.824 174.372 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -55.31 -57.83 10.19 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 117.93 0.332 . . . . 3.1000000000000001 110.935 176.141 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.451 HG12 ' CG2' ' A' ' 3' ' ' ILE . 4.7 m -55.77 -46.08 79.67 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.239 0 CA-C-O 118.858 -0.592 . . . . 0.48999999999999999 109.929 179.218 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -45.24 -53.69 7.97 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 118.603 0.638 . . . . 4.8399999999999999 110.677 172.017 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 68.3 mtp180 -61.39 -43.42 98.89 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 119.057 0.844 . . . . 3.2200000000000002 111.721 -179.868 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 13.6 m-85 -62.52 -38.63 90.69 Favored 'General case' 0 C--O 1.235 0.313 0 O-C-N 121.835 -0.541 . . . . 4.7599999999999998 110.751 179.678 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.405 HG21 ' CD1' ' A' ' 67' ' ' PHE . 38.6 mm -82.65 -39.93 16.3 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 CA-C-O 118.053 -0.975 . . . . 2.1400000000000001 112.005 -174.988 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 60.8 t0 -64.12 74.62 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 125.313 1.445 . . . . 1.98 108.141 169.097 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -54.49 155.38 4.02 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 106.612 -1.625 . . . . 3.21 106.612 164.647 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 76.22 -47.15 0.55 Allowed 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 118.757 0.708 . . . . 3.1099999999999999 111.97 -173.686 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 8.3 mt-30 61.12 45.83 8.73 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.578 0.751 . . . . 3.6299999999999999 110.351 -174.087 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 34.3 p -53.6 -33.02 53.51 Favored 'General case' 0 C--N 1.34 0.156 0 C-N-CA 124.703 1.201 . . . . 1.6499999999999999 111.24 173.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 121.34 -23.78 7.5 Favored Glycine 0 CA--C 1.528 0.872 0 N-CA-C 109.633 -1.387 . . . . 1.4299999999999999 109.633 -167.152 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 65.9 m-85 -126.38 151.89 47.03 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 123.785 0.834 . . . . 2.3700000000000001 110.107 -176.165 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 18.6 mt -80.56 82.33 6.6 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 105.316 -2.105 . . . . 2.6099999999999999 105.316 152.516 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -65.17 146.89 54.39 Favored 'General case' 0 CA--C 1.549 0.909 0 CA-C-N 113.268 -1.787 . . . . 2.3799999999999999 108.416 173.122 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -45.22 -55.87 5.39 Favored 'General case' 0 C--O 1.234 0.287 0 O-C-N 120.668 -1.27 . . . . 3.8900000000000001 114.324 -171.34 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -51.35 -30.69 19.52 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.781 0.832 . . . . 3.6200000000000001 111.547 179.041 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -68.34 -45.82 71.85 Favored 'General case' 0 N--CA 1.444 -0.754 0 O-C-N 121.749 -0.595 . . . . 2.8999999999999999 110.465 178.532 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.74 -30.21 71.34 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 119.556 -0.858 . . . . 2.8999999999999999 110.156 178.236 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 12.1 ttpp -57.5 -5.96 0.41 Allowed 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.772 1.229 . . . . 2.0499999999999998 113.465 171.111 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 36.7 p90 -137.67 27.72 2.73 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 119.864 1.211 . . . . 5.0199999999999996 112.395 165.476 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.405 ' CD1' HG21 ' A' ' 51' ' ' ILE . 63.8 t80 -53.99 -73.38 0.05 OUTLIER 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 124.543 1.137 . . . . 2.8100000000000001 112.263 -176.136 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.81 -26.0 65.86 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 108.909 -0.774 . . . . 3.8700000000000001 108.909 -171.636 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -52.22 -38.43 57.98 Favored 'General case' 0 C--O 1.226 -0.151 0 C-N-CA 126.861 2.065 . . . . 2.8199999999999998 111.231 174.313 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 20.8 mtpt -63.34 -29.29 70.62 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 117.997 0.362 . . . . 3.1800000000000002 111.744 176.383 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -79.59 -56.18 4.49 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 124.126 0.97 . . . . 5.3700000000000001 108.875 -178.5 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -104.24 -123.52 0.21 Allowed 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 108.023 -1.102 . . . . 4.1600000000000001 108.023 -173.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 21.8 p -157.29 -5.64 0.1 Allowed 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 116.577 2.066 . . . . 2.73 116.577 175.608 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -169.33 66.25 0.17 Allowed Glycine 0 C--N 1.334 0.465 0 N-CA-C 108.222 -1.951 . . . . 1.8700000000000001 108.222 175.528 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -89.02 -106.46 0.08 Allowed 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 117.385 0.593 . . . . 1.74 109.557 -171.16 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 9.4 tpt180 -151.11 50.49 0.84 Allowed 'General case' 0 N--CA 1.457 -0.109 0 CA-C-O 122.194 0.997 . . . . 4.6799999999999997 110.474 -174.421 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -95.85 -18.05 20.66 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 126.008 1.723 . . . . 4.7699999999999996 108.946 178.636 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -71.54 -42.86 67.37 Favored 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 124.375 1.07 . . . . 1.1499999999999999 110.632 -179.204 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.91 126.5 28.73 Favored 'General case' 0 C--N 1.343 0.308 0 C-N-CA 118.401 -1.32 . . . . 1.1100000000000001 109.47 179.485 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -61.91 -37.41 84.56 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 114.098 -1.41 . . . . 3.6200000000000001 109.412 174.514 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -66.75 -60.16 2.93 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 117.994 0.361 . . . . 1.98 111.09 -179.083 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -52.94 -41.57 64.62 Favored 'General case' 0 N--CA 1.454 -0.246 0 O-C-N 121.135 -0.978 . . . . 3.1099999999999999 110.797 177.071 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 4.4 m -59.44 -60.32 4.03 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 119.355 -0.938 . . . . 0.81999999999999995 110.911 173.144 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 35.4 pttt -61.37 -27.52 68.58 Favored 'General case' 0 C--O 1.213 -0.848 0 C-N-CA 123.511 0.724 . . . . 6.2699999999999996 110.603 -168.732 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 34.8 m -48.26 -47.3 36.2 Favored 'General case' 0 C--N 1.326 -0.426 0 O-C-N 121.251 -0.906 . . . . 1.48 110.832 170.822 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 11.6 mt -75.09 -54.42 7.18 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 109.183 -0.673 . . . . 2.3100000000000001 109.183 171.349 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 1.6 tpt -54.67 -20.09 7.49 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 115.178 1.547 . . . . 5.6200000000000001 115.178 -175.808 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -83.12 -61.17 1.93 Allowed 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 127.057 2.143 . . . . 0.83999999999999997 109.457 -179.128 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -80.89 -34.14 33.76 Favored 'General case' 0 N--CA 1.455 -0.213 0 O-C-N 121.903 -0.498 . . . . 0.90000000000000002 111.917 -171.654 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -60.2 -38.94 84.82 Favored 'General case' 0 C--O 1.227 -0.086 0 CA-C-N 118.418 0.554 . . . . 0.51000000000000001 109.69 172.256 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -66.18 -62.67 1.36 Allowed 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 109.549 -0.538 . . . . 1.8999999999999999 109.549 176.842 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 10.1 p30 43.59 23.13 0.04 OUTLIER 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 126.553 1.941 . . . . 3.5499999999999998 115.038 -173.668 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 52.4 m-20 -95.78 -45.44 6.99 Favored 'General case' 0 C--N 1.338 0.091 0 C-N-CA 124.373 1.069 . . . . 1.9299999999999999 108.339 171.947 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 97.75 41.49 3.34 Favored Glycine 0 CA--C 1.53 0.97 0 N-CA-C 109.463 -1.455 . . . . 1.26 109.463 -158.604 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . 0.252 1.7 p30 -127.74 -54.81 1.32 Allowed 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 118.416 1.108 . . . . 2.0800000000000001 111.917 171.604 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 114.49 -34.37 4.94 Favored Glycine 0 CA--C 1.53 1.009 0 C-N-CA 124.611 1.101 . . . . 0.87 112.46 176.868 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 52.8 pttt -70.1 127.85 34.26 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-N 118.858 1.329 . . . . 3.98 108.058 173.105 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 8.7 mt -117.46 107.45 22.24 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.156 0 N-CA-C 108.307 -0.998 . . . . 1.0800000000000001 108.307 -173.185 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -61.88 163.59 24.22 Favored Glycine 0 CA--C 1.526 0.752 0 N-CA-C 111.04 -0.824 . . . . 0.47999999999999998 111.04 172.967 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -51.01 -42.86 60.68 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 109.039 -0.726 . . . . 0.62 109.039 168.359 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 8.8 tt0 -57.64 -56.74 18.01 Favored 'General case' 0 N--CA 1.445 -0.68 0 C-N-CA 124.121 0.968 . . . . 2.73 110.044 179.003 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -50.87 -48.07 60.29 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.68 0.792 . . . . 1.5 110.98 176.22 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 79.5 t80 -58.31 -54.56 45.67 Favored 'General case' 0 CA--C 1.538 0.492 0 O-C-N 121.745 -0.597 . . . . 4.04 110.896 179.052 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 13.0 mt-30 -61.96 -29.0 69.94 Favored 'General case' 0 C--O 1.221 -0.422 0 CA-C-O 118.001 -0.999 . . . . 4.0499999999999998 112.534 177.519 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 23.5 mm-40 -63.01 -59.37 4.91 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 120.288 1.404 . . . . 3.29 107.778 172.374 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 5.6 tpt -54.99 -41.6 71.42 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 110.231 -0.285 . . . . 3.21 110.231 -176.378 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . 0.419 HG13 ' HB3' ' A' ' 36' ' ' LEU . 52.8 t -78.4 -54.86 11.35 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.51 0 N-CA-C 113.153 0.797 . . . . 1.3 113.153 -177.142 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 4.5 t-80 -72.05 -8.77 56.47 Favored 'General case' 0 C--N 1.326 -0.425 0 O-C-N 119.508 -1.995 . . . . 3.6499999999999999 111.057 -175.702 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 33.2 t . . . . . 0 C--O 1.254 1.319 0 CA-C-O 115.084 -2.389 . . . . 2.79 113.643 167.14 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 29.6 mtt . . . . . 0 N--CA 1.471 0.579 0 CA-C-O 119.384 -0.341 . . . . 7.29 111.242 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.7 m -86.4 -143.93 0.11 Allowed 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 108.83 -0.804 . . . . 2.4399999999999999 108.83 -168.304 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.521 HG22 HG12 ' A' ' 47' ' ' VAL . 1.3 pp -45.93 -33.43 1.6 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 C-N-CA 124.76 1.224 . . . . 1.24 112.393 179.083 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 9.1 t -64.87 -8.96 17.49 Favored 'General case' 0 N--CA 1.432 -1.361 0 C-N-CA 127.542 2.337 . . . . 1.6399999999999999 111.541 -176.087 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 29.8 t0 -132.83 7.35 4.05 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 126.681 1.992 . . . . 2.3999999999999999 109.477 -175.838 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 77.7 t -90.6 -61.31 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.344 0.347 0 O-C-N 121.574 -0.704 . . . . 1.51 109.827 174.361 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -166.26 -60.32 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.196 0 N-CA-C 107.517 -1.29 . . . . 1.1000000000000001 107.517 -174.116 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 27.5 m -41.45 -25.89 0.05 Allowed 'General case' 0 C--O 1.221 -0.437 0 C-N-CA 126.959 2.103 . . . . 1.1799999999999999 115.969 -169.846 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -48.09 -47.33 34.26 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 119.81 1.186 . . . . 0.88 112.387 171.416 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -64.71 -41.32 96.08 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-O 122.477 1.132 . . . . 1.75 109.716 179.838 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -68.88 -45.49 70.82 Favored 'General case' 0 N--CA 1.445 -0.683 0 C-N-CA 124.285 1.034 . . . . 2.3900000000000001 109.384 -172.674 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 32.4 pt -60.93 -37.46 77.02 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.807 0 O-C-N 121.256 -0.902 . . . . 1.0 111.076 175.564 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.85 -43.95 77.58 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 118.68 0.673 . . . . 0.88 110.626 173.52 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.02 -57.12 14.22 Favored 'General case' 0 CA--C 1.534 0.363 0 O-C-N 121.946 -0.471 . . . . 0.78000000000000003 110.524 172.803 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -47.31 -43.57 22.75 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.845 1.258 . . . . 0.77000000000000002 111.222 -179.596 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.62 -36.99 77.43 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 126.16 1.784 . . . . 3.2999999999999998 110.9 -177.614 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -91.38 -42.98 10.02 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 122.818 0.447 . . . . 2.79 110.005 -175.047 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -69.58 -32.9 71.94 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-O 119.792 -0.146 . . . . 3.54 110.973 -176.531 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 62.1 m -109.15 55.83 0.63 Allowed 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.927 0.891 . . . . 1.6000000000000001 108.615 175.312 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.88 -53.67 12.48 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 121.608 0.718 . . . . 5.2300000000000004 109.977 -168.156 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -69.66 140.28 89.32 Favored Pre-proline 0 N--CA 1.445 -0.709 0 CA-C-N 114.266 -1.334 . . . . 3.1800000000000002 107.592 176.934 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -51.16 -70.92 0.05 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.659 0 C-N-CA 124.386 3.391 . . . . 4.1200000000000001 112.089 -164.225 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 12.3 p-10 -77.08 49.35 0.66 Allowed 'General case' 0 CA--C 1.543 0.675 0 O-C-N 121.493 -0.754 . . . . 3.3199999999999998 112.582 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 2.8 m -122.13 27.76 7.85 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 124.367 1.067 . . . . 1.4199999999999999 110.151 174.851 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 12.0 t80 -109.1 135.91 49.46 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 124.695 1.198 . . . . 4.2999999999999998 108.704 -179.869 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 -122.13 142.86 37.61 Favored Pre-proline 0 N--CA 1.451 -0.422 0 N-CA-C 107.696 -1.224 . . . . 3.8199999999999998 107.696 169.639 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -64.86 -59.03 0.18 Allowed 'Trans proline' 0 N--CA 1.452 -0.963 0 C-N-CA 123.601 2.868 . . . . 0.77000000000000002 111.296 -177.054 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -52.44 -50.66 62.18 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.307 0.643 . . . . 2.54 110.818 -179.179 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 12.6 tptp -45.53 -65.14 0.58 Allowed 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.433 1.093 . . . . 2.8599999999999999 108.852 170.105 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -50.49 -44.36 55.86 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 124.879 1.272 . . . . 2.9100000000000001 112.873 -176.957 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 13.5 m-85 -56.35 -46.54 79.92 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-N 120.036 1.289 . . . . 4.6100000000000003 111.006 -178.189 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 -70.32 -46.53 64.03 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 109.454 -0.573 . . . . 2.8900000000000001 109.454 178.019 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -63.8 -33.39 75.56 Favored 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 124.764 1.226 . . . . 0.89000000000000001 113.137 -174.073 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.4 t -85.67 -1.32 57.04 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 125.319 1.448 . . . . 1.4399999999999999 109.669 178.843 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 76.95 -11.83 13.61 Favored Glycine 0 CA--C 1.531 1.054 0 O-C-N 121.396 -0.815 . . . . 0.71999999999999997 112.238 179.309 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 32.6 mt -55.93 -33.84 65.07 Favored 'General case' 0 N--CA 1.444 -0.728 0 C-N-CA 126.518 1.927 . . . . 1.3799999999999999 112.525 -177.654 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 46.9 t -69.23 -32.95 72.52 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 118.803 0.729 . . . . 2.0299999999999998 111.301 173.292 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 10.6 tttt -75.43 -34.79 61.02 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 108.563 -0.903 . . . . 4.2400000000000002 108.563 -179.078 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 36.3 mtt -57.34 124.69 19.75 Favored 'General case' 0 N--CA 1.442 -0.848 0 N-CA-C 109.601 -0.518 . . . . 2.7799999999999998 109.601 171.946 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 6.0 m -63.34 160.48 15.89 Favored 'General case' 0 N--CA 1.452 -0.337 0 O-C-N 121.537 -0.727 . . . . 1.8600000000000001 110.73 176.46 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -41.6 -41.99 2.34 Favored 'General case' 0 C--O 1.224 -0.253 0 C-N-CA 125.005 1.322 . . . . 0.48999999999999999 112.332 176.22 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 75.8 m-20 -48.69 -61.13 2.19 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.223 0.609 . . . . 1.54 109.886 175.514 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 9.0 mm-40 -62.84 -46.43 87.95 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 115.83 -0.623 . . . . 2.6600000000000001 109.682 -178.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 62.6 t -58.82 -39.07 76.19 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 CA-C-N 119.789 1.177 . . . . 0.45000000000000001 110.77 -176.836 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 6.7 ttmt -64.27 -48.43 75.77 Favored 'General case' 0 CA--C 1.536 0.432 0 O-C-N 121.366 -0.834 . . . . 4.5499999999999998 110.707 172.861 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 78.1 m-20 -61.19 -51.1 70.45 Favored 'General case' 0 CA--C 1.535 0.387 0 O-C-N 121.807 -0.558 . . . . 3.4100000000000001 110.06 -176.178 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.521 HG12 HG22 ' A' ' 3' ' ' ILE . 9.0 m -58.8 -46.65 90.8 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.27 0 CA-C-O 118.412 -0.804 . . . . 0.58999999999999997 110.105 174.485 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 11.8 t80 -45.65 -48.71 14.82 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 119.291 0.951 . . . . 4.3600000000000003 111.233 173.257 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 86.3 mtt-85 -61.19 -36.28 79.44 Favored 'General case' 0 CA--C 1.532 0.277 0 O-C-N 121.608 -0.682 . . . . 4.2599999999999998 112.169 176.377 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 25.1 t80 -64.89 -33.76 76.78 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 118.805 0.729 . . . . 3.71 110.071 173.158 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 14.1 mm -67.25 -58.0 7.83 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.284 0 CA-C-O 117.895 -1.05 . . . . 1.55 111.721 176.583 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -73.18 70.97 1.15 Allowed 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 119.21 0.914 . . . . 2.3700000000000001 109.457 -173.663 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 15.5 t30 -59.9 -32.63 70.93 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 125.967 1.707 . . . . 2.0099999999999998 111.887 -170.791 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 17.2 p-10 -74.3 -21.05 59.91 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.473 1.109 . . . . 2.3399999999999999 111.607 174.494 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 8.1 mt-30 49.92 63.07 2.33 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 126.496 1.919 . . . . 3.1499999999999999 111.389 -178.103 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.2 p -93.71 -38.82 11.11 Favored 'General case' 0 CA--C 1.521 -0.149 0 CA-C-N 115.698 -0.683 . . . . 1.3799999999999999 109.978 167.572 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 99.72 18.49 22.82 Favored Glycine 0 CA--C 1.53 0.971 0 CA-C-O 119.71 -0.494 . . . . 1.6000000000000001 111.925 -169.329 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 36.7 m-85 -135.14 137.64 42.96 Favored 'General case' 0 C--O 1.238 0.454 0 N-CA-C 108.717 -0.846 . . . . 2.6099999999999999 108.717 163.991 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -90.91 70.79 6.48 Favored 'General case' 0 C--O 1.231 0.099 0 C-N-CA 126.067 1.747 . . . . 1.73 107.87 168.89 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -63.56 165.64 7.78 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 123.314 0.646 . . . . 1.77 110.59 177.411 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -48.93 -47.38 43.64 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.147 0.979 . . . . 4.3200000000000003 111.601 -176.837 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -73.74 -18.8 60.94 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 115.679 -0.691 . . . . 3.0899999999999999 112.56 -177.03 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -70.51 -48.79 53.88 Favored 'General case' 0 CA--C 1.522 -0.105 0 N-CA-C 108.58 -0.896 . . . . 2.6699999999999999 108.58 165.445 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.622 HD11 HD23 ' A' ' 86' ' ' LEU . 0.2 OUTLIER -49.37 -41.96 40.65 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 115.642 -0.708 . . . . 2.6000000000000001 110.208 176.861 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 30.3 ttpt -55.02 -8.15 0.25 Allowed 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 114.5 1.296 . . . . 2.1600000000000001 114.5 176.636 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 32.2 p90 -136.46 18.94 3.12 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 120.584 1.538 . . . . 5.5999999999999996 113.564 168.37 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 2.7 t80 -42.48 -75.92 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.042 1.337 . . . . 2.52 114.107 -172.562 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.504 HD23 ' CD2' ' A' ' 71' ' ' PHE . 1.5 mt -73.89 -0.2 15.3 Favored 'General case' 0 CA--C 1.532 0.267 0 O-C-N 121.251 -0.905 . . . . 2.23 111.529 178.223 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -72.34 -19.17 61.69 Favored 'General case' 0 CA--C 1.532 0.257 0 O-C-N 120.599 -1.313 . . . . 2.7000000000000002 110.714 -176.552 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.0 -29.6 68.58 Favored 'General case' 0 CA--C 1.534 0.332 0 O-C-N 122.006 -0.434 . . . . 2.8900000000000001 111.321 163.654 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.504 ' CD2' HD23 ' A' ' 68' ' ' LEU . 2.5 m-30 -90.56 -65.02 1.05 Allowed 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 108.576 -0.898 . . . . 3.25 108.576 -176.479 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -117.33 119.47 35.25 Favored 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 107.922 -1.14 . . . . 3.0800000000000001 107.922 -172.79 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 4.2 p -49.22 -34.45 14.91 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 123.73 0.812 . . . . 2.2799999999999998 112.324 179.536 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -111.81 36.69 4.04 Favored Glycine 0 CA--C 1.524 0.643 0 C-N-CA 124.903 1.239 . . . . 1.1000000000000001 110.925 -178.92 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.77 175.68 1.08 Allowed 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 117.617 0.708 . . . . 1.6899999999999999 110.602 169.397 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.63 3.63 28.1 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 114.523 1.305 . . . . 5.1900000000000004 114.523 -164.989 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -55.26 -26.51 40.42 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.092 0.957 . . . . 3.0499999999999998 112.639 -162.702 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.44 HD22 ' H ' ' A' ' 78' ' ' LEU . 0.2 OUTLIER -62.73 -41.81 99.36 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.324 1.45 . . . . 0.88 112.155 173.86 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 53.9 m -64.06 106.29 1.03 Allowed 'General case' 0 C--O 1.236 0.36 0 N-CA-C 108.862 -0.792 . . . . 1.5 108.862 175.059 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -56.54 -37.33 70.35 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-N 115.611 -0.722 . . . . 3.0600000000000001 110.478 174.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -49.85 -69.72 0.11 Allowed 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 119.394 0.997 . . . . 2.1600000000000001 112.153 176.129 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 21.6 mt-10 -53.95 -48.18 70.56 Favored 'General case' 0 C--N 1.343 0.285 0 CA-C-N 119.357 0.981 . . . . 4.6600000000000001 110.611 178.557 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -54.76 -51.82 64.49 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-O 121.658 0.742 . . . . 0.66000000000000003 109.392 -175.036 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.93 -34.64 73.72 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 124.624 1.17 . . . . 5.0199999999999996 110.29 -176.268 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 73.4 m -61.07 -48.73 80.34 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 120.14 1.336 . . . . 1.23 110.82 174.039 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.622 HD23 HD11 ' A' ' 64' ' ' LEU . 6.3 tp -54.02 -59.26 4.88 Favored 'General case' 0 C--N 1.342 0.271 0 N-CA-C 108.254 -1.017 . . . . 3.27 108.254 172.981 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 1.7 ttt -47.99 -50.47 27.39 Favored 'General case' 0 CA--C 1.538 0.501 0 O-C-N 123.771 0.669 . . . . 3.6099999999999999 111.818 -179.014 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -54.92 -51.79 64.98 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 126.141 1.777 . . . . 0.68000000000000005 111.275 -173.031 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -73.58 -49.08 28.1 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 120.112 -0.635 . . . . 0.51000000000000001 110.29 177.43 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -48.99 -33.97 12.11 Favored 'General case' 0 C--N 1.339 0.14 0 C-N-CA 123.537 0.735 . . . . 0.56000000000000005 111.598 -178.781 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 17.3 t0 -79.75 112.13 16.73 Favored 'General case' 0 N--CA 1.439 -0.995 0 C-N-CA 124.41 1.084 . . . . 1.1799999999999999 112.483 -179.574 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 10.0 m120 -80.41 35.4 0.34 Allowed 'General case' 0 CA--C 1.539 0.534 0 O-C-N 120.958 -1.089 . . . . 2.54 112.312 176.85 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -142.92 -55.04 0.41 Allowed 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 119.727 1.148 . . . . 1.9399999999999999 111.783 -174.465 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 88.25 40.4 6.52 Favored Glycine 0 CA--C 1.533 1.206 0 N-CA-C 109.283 -1.527 . . . . 1.4399999999999999 109.283 -152.066 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 20.5 p30 -113.63 -65.03 1.23 Allowed 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 126.087 1.755 . . . . 1.8999999999999999 109.227 169.254 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 129.45 -32.61 3.18 Favored Glycine 0 CA--C 1.524 0.598 0 C-N-CA 124.751 1.167 . . . . 0.83999999999999997 111.001 -177.575 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 19.2 pttm -63.03 121.71 14.25 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 107.549 -1.278 . . . . 5.6500000000000004 107.549 173.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 14.4 mt -123.57 118.56 54.73 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 C-N-CA 124.996 1.318 . . . . 0.70999999999999996 107.726 -172.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -86.31 174.0 46.69 Favored Glycine 0 CA--C 1.531 1.041 0 N-CA-C 110.9 -0.88 . . . . 0.63 110.9 172.607 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -60.51 -42.22 95.94 Favored 'General case' 0 C--O 1.224 -0.271 0 O-C-N 122.222 -0.575 . . . . 0.87 109.643 175.915 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 -57.08 -57.46 12.48 Favored 'General case' 0 N--CA 1.447 -0.575 0 C-N-CA 123.39 0.676 . . . . 2.1899999999999999 109.726 177.031 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 -48.36 -51.25 27.24 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 121.669 0.747 . . . . 1.3100000000000001 110.213 177.017 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 12.5 t80 -61.24 -54.31 45.77 Favored 'General case' 0 CA--C 1.534 0.334 0 O-C-N 121.944 -0.473 . . . . 2.8399999999999999 111.632 -176.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 23.9 tt0 -58.59 -45.27 89.45 Favored 'General case' 0 C--O 1.225 -0.185 0 C-N-CA 125.487 1.515 . . . . 2.6400000000000001 110.885 -178.085 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 55.1 mt-10 -49.2 -54.21 17.64 Favored 'General case' 0 C--N 1.34 0.168 0 CA-C-N 119.219 0.918 . . . . 3.1600000000000001 110.154 175.042 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 2.5 tpp -64.61 -52.84 55.39 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 116.088 -0.506 . . . . 4.5800000000000001 110.117 -177.649 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 50.1 t -53.62 -37.72 32.07 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.225 0 C-N-CA 123.493 0.717 . . . . 1.3700000000000001 111.647 -179.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 10.4 t-80 -63.9 -21.35 66.42 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 124.967 1.307 . . . . 3.3900000000000001 110.487 -178.904 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 18.4 t . . . . . 0 C--O 1.252 1.193 0 N-CA-C 112.564 0.579 . . . . 3.7000000000000002 112.564 -177.96 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 39.6 mtt . . . . . 0 N--CA 1.478 0.947 0 CA-C-O 119.344 -0.36 . . . . 8.0399999999999991 111.246 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 44.0 t -142.98 -150.06 0.3 Allowed 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 105.463 -2.051 . . . . 2.75 105.463 -177.127 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.483 HG22 HG12 ' A' ' 47' ' ' VAL . 0.2 OUTLIER -50.68 -27.46 4.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 C-N-CA 124.285 1.034 . . . . 1.9199999999999999 112.932 178.055 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -56.04 -40.16 73.08 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-O 122.04 0.924 . . . . 2.1299999999999999 108.985 178.49 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 41.9 t0 -89.7 42.46 1.09 Allowed 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 128.04 2.536 . . . . 3.3399999999999999 109.248 -172.793 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 40.3 t -144.94 -63.96 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.341 0.21 0 C-N-CA 125.075 1.35 . . . . 1.53 109.319 -176.926 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 10.8 tp -166.52 -57.16 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.131 0 N-CA-C 107.074 -1.454 . . . . 1.1899999999999999 107.074 -174.858 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 1.6 m -42.01 -29.27 0.21 Allowed 'General case' 0 N--CA 1.446 -0.638 0 C-N-CA 128.553 2.741 . . . . 0.98999999999999999 115.465 -165.3 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -45.89 -49.08 15.94 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.925 0.89 . . . . 0.60999999999999999 112.139 173.798 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -61.52 -45.16 95.38 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 122.419 1.104 . . . . 1.79 109.283 -179.076 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -67.04 -47.28 71.85 Favored 'General case' 0 N--CA 1.445 -0.708 0 C-N-CA 124.608 1.163 . . . . 2.2999999999999998 109.044 -171.768 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 19.2 pt -63.62 -39.59 85.92 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.801 0 O-C-N 121.774 -0.578 . . . . 0.96999999999999997 111.175 176.221 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.44 -46.54 83.48 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 118.733 0.697 . . . . 0.67000000000000004 110.779 173.852 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.59 -53.16 61.5 Favored 'General case' 0 CA--C 1.531 0.232 0 O-C-N 121.752 -0.593 . . . . 0.60999999999999999 110.642 173.744 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.477 ' HB1' ' CZ ' ' A' ' 30' ' ' PHE . . . -51.81 -43.92 63.28 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 124.683 1.193 . . . . 0.56999999999999995 111.172 -178.818 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -54.6 -35.74 63.7 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 124.539 1.136 . . . . 2.8799999999999999 111.079 176.972 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 4.7 mt-30 -86.43 -43.89 12.45 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 118.238 0.472 . . . . 3.0299999999999998 111.383 179.326 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.12 -45.5 92.79 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-O 121.689 0.757 . . . . 3.48 109.608 179.94 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 4.2 t -99.01 36.91 1.61 Allowed 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 126.216 1.806 . . . . 2.5299999999999998 110.035 -175.229 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 57.7 ttp180 -74.14 -45.98 45.39 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 108.895 -0.78 . . . . 5.8200000000000003 108.895 -178.719 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -81.56 147.88 60.68 Favored Pre-proline 0 N--CA 1.446 -0.665 0 N-CA-C 108.008 -1.108 . . . . 2.2799999999999998 108.008 -163.111 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -65.1 146.7 87.63 Favored 'Trans proline' 0 N--CA 1.452 -0.951 0 C-N-CA 121.803 1.669 . . . . 1.27 110.923 -168.053 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 53.02 46.08 27.49 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 126.102 1.761 . . . . 2.6000000000000001 112.203 177.043 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 3.0 m -118.01 6.5 12.14 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.147 1.379 . . . . 0.78000000000000003 112.79 -179.172 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 2.8 t80 -81.7 83.98 6.95 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 119.86 -1.775 . . . . 2.6099999999999999 110.358 -172.748 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -69.77 138.31 88.07 Favored Pre-proline 0 CA--C 1.539 0.522 0 N-CA-C 109.051 -0.722 . . . . 2.71 109.051 166.798 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -64.54 -60.97 0.12 Allowed 'Trans proline' 0 N--CA 1.45 -1.042 0 C-N-CA 122.674 2.249 . . . . 0.59999999999999998 111.21 -179.393 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -59.6 -45.74 91.03 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 122.914 0.486 . . . . 2.1200000000000001 110.456 -177.425 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -49.36 -60.44 2.82 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 109.769 -0.456 . . . . 4.3700000000000001 109.769 174.389 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.477 ' CZ ' ' HB1' ' A' ' 15' ' ' ALA . 7.6 t80 -63.25 -41.53 99.08 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-O 120.783 0.325 . . . . 3.8199999999999998 111.176 -173.068 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -46.0 -54.81 7.75 Favored 'General case' 0 C--O 1.235 0.297 0 C-N-CA 125.243 1.417 . . . . 5.2800000000000002 110.257 173.388 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -72.2 -49.29 36.57 Favored 'General case' 0 N--CA 1.443 -0.811 0 N-CA-C 108.426 -0.953 . . . . 2.4900000000000002 108.426 -173.348 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -54.99 -36.23 65.19 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 124.193 0.997 . . . . 0.67000000000000004 111.164 -179.5 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 22.3 t -85.17 -2.33 57.91 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 123.577 0.751 . . . . 1.5 111.932 -176.143 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 82.79 0.8 90.41 Favored Glycine 0 C--N 1.339 0.736 0 CA-C-N 119.216 0.916 . . . . 0.75 112.253 168.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -59.33 -30.33 68.29 Favored 'General case' 0 CA--C 1.536 0.43 0 O-C-N 121.65 -0.912 . . . . 2.4399999999999999 109.609 175.13 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 28.9 p -52.58 -42.31 64.39 Favored 'General case' 0 CA--C 1.523 -0.085 0 C-N-CA 124.73 1.212 . . . . 3.1800000000000002 112.153 168.217 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 9.5 tttt -91.71 -28.45 17.42 Favored 'General case' 0 N--CA 1.444 -0.736 0 N-CA-C 109.52 -0.548 . . . . 5.8799999999999999 109.52 -168.25 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 8.2 mmt -52.9 -46.5 68.04 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 113.599 0.963 . . . . 3.3700000000000001 113.599 -175.484 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 19.4 m 93.19 147.79 0.03 OUTLIER 'General case' 0 C--N 1.34 0.164 0 C-N-CA 128.323 2.649 . . . . 2.1899999999999999 109.675 -176.958 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -41.21 -36.72 0.8 Allowed 'General case' 0 N--CA 1.463 0.189 0 C-N-CA 125.682 1.593 . . . . 0.79000000000000004 113.233 -174.665 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -67.76 -60.96 2.12 Favored 'General case' 0 N--CA 1.456 -0.136 0 N-CA-C 108.406 -0.961 . . . . 2.0600000000000001 108.406 -174.594 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 23.3 mm100 -53.45 -49.98 66.25 Favored 'General case' 0 C--O 1.22 -0.49 0 CA-C-N 115.349 -0.841 . . . . 2.71 108.85 175.677 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 74.2 t -54.15 -46.93 67.61 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.503 0 CA-C-N 118.404 0.547 . . . . 0.65000000000000002 111.222 -178.066 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 10.2 tmtt? -62.71 -43.14 99.58 Favored 'General case' 0 CA--C 1.535 0.402 0 O-C-N 121.034 -1.041 . . . . 4.1699999999999999 110.801 176.881 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 80.5 m-20 -65.24 -48.13 74.37 Favored 'General case' 0 CA--C 1.537 0.449 0 O-C-N 121.483 -0.761 . . . . 3.7799999999999998 110.297 -179.012 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.483 HG12 HG22 ' A' ' 3' ' ' ILE . 3.4 m -57.01 -43.87 81.76 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.213 0 O-C-N 121.241 -0.912 . . . . 0.67000000000000004 110.31 174.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.414 ' CE2' ' HA ' ' A' ' 100' ' ' ALA . 6.9 t80 -47.87 -52.95 17.23 Favored 'General case' 0 C--N 1.344 0.327 0 N-CA-C 109.358 -0.608 . . . . 4.3099999999999996 109.358 172.652 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 11.8 mtt180 -66.53 -32.72 74.25 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 113.733 1.012 . . . . 5.5 113.733 179.526 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 20.0 m-85 -56.21 -40.0 73.36 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 119.937 1.244 . . . . 4.3700000000000001 110.715 170.451 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.9 mp -78.65 -44.56 25.77 Favored 'Isoleucine or valine' 0 C--O 1.241 0.607 0 O-C-N 121.82 -0.55 . . . . 1.97 111.923 -178.325 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 20.6 t0 -65.61 79.31 0.07 Allowed 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 125.131 1.372 . . . . 1.76 109.106 178.749 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 13.5 t30 -44.78 -56.86 4.12 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 126.516 1.926 . . . . 2.1200000000000001 112.433 -173.474 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -60.94 -15.68 34.01 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.984 1.714 . . . . 2.52 113.421 177.188 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 13.9 mt-30 57.04 29.79 17.09 Favored 'General case' 0 C--O 1.235 0.3 0 C-N-CA 125.092 1.357 . . . . 3.1099999999999999 111.331 -175.374 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.4 p -64.05 -20.77 66.17 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.541 0.737 . . . . 1.5700000000000001 111.636 178.55 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 86.64 15.66 63.24 Favored Glycine 0 CA--C 1.53 0.979 0 N-CA-C 110.38 -1.088 . . . . 1.5800000000000001 110.38 -172.459 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 76.6 m-85 -136.99 124.77 22.5 Favored 'General case' 0 CA--C 1.515 -0.375 0 C-N-CA 124.803 1.241 . . . . 2.8300000000000001 108.612 -175.916 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -73.38 83.63 1.44 Allowed 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 104.064 -2.569 . . . . 2.6200000000000001 104.064 151.972 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -66.75 164.85 16.22 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 107.206 -1.405 . . . . 3.0699999999999998 107.206 166.204 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -42.07 -51.49 4.53 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 124.545 1.138 . . . . 5.9400000000000004 112.347 -176.051 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -68.17 -24.31 64.95 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 113.012 0.745 . . . . 3.3300000000000001 113.012 -173.226 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -57.67 -40.87 80.35 Favored 'General case' 0 C--N 1.341 0.224 0 CA-C-N 120.314 1.415 . . . . 2.3500000000000001 110.218 172.152 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.2 mp -65.64 -17.95 64.97 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 120.191 -0.603 . . . . 2.6400000000000001 111.514 179.858 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 29.5 ttpt -79.1 -14.3 59.21 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 118.956 0.798 . . . . 2.2400000000000002 111.353 172.844 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 68.5 m-85 -145.17 61.34 1.3 Allowed 'General case' 0 C--O 1.241 0.612 0 C-N-CA 124.267 1.027 . . . . 4.8700000000000001 109.996 175.054 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 18.4 t80 -91.84 -80.42 0.36 Allowed 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.974 1.31 . . . . 2.6899999999999999 108.84 -175.3 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 8.2 mp -65.25 -4.79 5.68 Favored 'General case' 0 N--CA 1.465 0.301 0 O-C-N 120.683 -1.26 . . . . 2.1200000000000001 113.379 170.871 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.13 -23.18 66.41 Favored 'General case' 0 N--CA 1.45 -0.466 0 O-C-N 121.262 -0.898 . . . . 2.8300000000000001 111.4 171.213 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 6.8 mptt -91.52 -42.73 10.09 Favored 'General case' 0 C--N 1.342 0.277 0 CA-C-N 119.298 0.954 . . . . 3.6200000000000001 110.886 167.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 45.0 m-85 -55.4 -50.23 70.3 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 118.447 0.567 . . . . 3.8300000000000001 111.462 -177.377 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 25.2 tp10 -110.97 -66.78 1.05 Allowed 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 124.927 1.291 . . . . 3.4700000000000002 108.904 -177.087 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 48.6 m 107.63 113.52 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 128.377 2.671 . . . . 3.1600000000000001 109.026 -165.564 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 74.25 44.74 27.52 Favored Glycine 0 CA--C 1.527 0.842 0 N-CA-C 111.384 -0.686 . . . . 1.3999999999999999 111.384 176.618 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -85.47 -118.59 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.537 0.735 . . . . 1.54 110.13 177.166 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.24 -7.08 12.41 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.242 1.017 . . . . 3.27 113.006 -169.239 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -54.38 -32.86 57.97 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 126.252 1.821 . . . . 2.9300000000000002 112.871 -158.893 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.479 HD22 ' H ' ' A' ' 78' ' ' LEU . 0.5 OUTLIER -57.63 -41.72 81.94 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 124.26 1.024 . . . . 0.95999999999999996 111.596 176.136 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 49.5 m -67.55 104.6 1.62 Allowed 'General case' 0 C--O 1.235 0.295 0 CA-C-N 118.957 0.799 . . . . 0.81000000000000005 110.04 -178.846 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 13.9 mp0 -61.8 -36.5 81.29 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 115.66 -0.7 . . . . 3.4100000000000001 110.508 -177.461 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 22.1 t -54.72 -55.68 27.32 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 118.828 0.74 . . . . 1.8 110.687 177.86 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -63.45 -47.89 79.97 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 123.991 0.917 . . . . 3.1499999999999999 109.124 -178.193 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -52.96 -45.66 67.84 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 115.897 -0.592 . . . . 0.75 110.432 176.534 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 5.1 mmpt? -68.69 -37.74 79.79 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 124.249 1.02 . . . . 4.7199999999999998 110.883 -178.971 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 22.7 t -51.89 -51.43 56.87 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 119.343 0.974 . . . . 1.79 109.129 171.373 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.436 HD22 ' HA ' ' A' ' 86' ' ' LEU . 1.4 tm? -62.85 -54.27 41.38 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 118.98 -0.533 . . . . 2.4700000000000002 110.207 179.19 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 51.4 ttm -46.68 -50.95 17.03 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 118.254 0.479 . . . . 3.2200000000000002 111.408 176.11 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -54.91 -46.66 74.9 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 125.735 1.614 . . . . 0.69999999999999996 111.624 -171.009 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -82.16 -38.26 24.95 Favored 'General case' 0 CA--C 1.529 0.14 0 N-CA-C 111.779 0.289 . . . . 0.60999999999999999 111.779 -179.79 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -63.98 -44.06 93.83 Favored 'General case' 0 N--CA 1.457 -0.115 0 N-CA-C 111.646 0.239 . . . . 0.40999999999999998 111.646 -179.085 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -65.4 119.27 10.68 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 108.875 -0.787 . . . . 1.04 108.875 178.934 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -103.2 12.01 36.21 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 122.501 0.32 . . . . 3.1400000000000001 111.508 -174.473 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 34.2 m-20 -103.45 -43.74 5.32 Favored 'General case' 0 C--N 1.34 0.159 0 C-N-CA 124.035 0.934 . . . . 1.5900000000000001 109.803 179.811 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 90.33 40.17 5.82 Favored Glycine 0 CA--C 1.529 0.968 0 N-CA-C 108.95 -1.66 . . . . 0.84999999999999998 108.95 -156.354 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -118.45 -59.7 1.85 Allowed 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 117.811 0.805 . . . . 2.46 110.322 177.688 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 131.11 -43.2 1.31 Allowed Glycine 0 CA--C 1.528 0.861 0 C-N-CA 123.827 0.727 . . . . 0.56999999999999995 111.432 179.559 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 18.5 mtpt -69.36 123.91 22.47 Favored 'General case' 0 N--CA 1.451 -0.405 0 N-CA-C 108.771 -0.826 . . . . 5.54 108.771 176.892 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 9.7 mt -108.5 110.37 31.76 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.204 0 N-CA-C 109.854 -0.424 . . . . 0.79000000000000004 109.854 -168.412 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -63.62 157.51 41.43 Favored Glycine 0 CA--C 1.532 1.113 0 N-CA-C 111.106 -0.798 . . . . 0.5 111.106 170.655 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . 0.414 ' HA ' ' CE2' ' A' ' 48' ' ' PHE . . . -55.24 -37.75 67.59 Favored 'General case' 0 C--N 1.339 0.137 0 O-C-N 121.936 -0.744 . . . . 0.66000000000000003 109.745 169.798 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -55.48 -60.88 2.81 Favored 'General case' 0 N--CA 1.448 -0.53 0 C-N-CA 124.308 1.043 . . . . 2.8500000000000001 109.672 176.582 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -47.87 -49.21 30.24 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.203 1.001 . . . . 1.3 111.279 176.225 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -61.34 -51.79 67.34 Favored 'General case' 0 N--CA 1.457 -0.117 0 CA-C-O 121.401 0.62 . . . . 3.0800000000000001 110.99 -178.033 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 10.7 tm0? -58.61 -36.5 74.13 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-O 117.74 -1.124 . . . . 2.8199999999999998 110.438 178.573 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -60.11 -61.46 2.59 Favored 'General case' 0 N--CA 1.457 -0.099 0 CA-C-N 120.012 1.278 . . . . 3.3700000000000001 110.761 170.44 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 3.7 ttp -54.31 -38.73 66.28 Favored 'General case' 0 C--N 1.34 0.161 0 CA-C-O 120.881 0.372 . . . . 4.8700000000000001 110.508 -173.569 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 54.6 t -70.56 -76.02 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.446 -0.673 0 C-N-CA 123.388 0.675 . . . . 1.6299999999999999 110.085 174.363 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 52.8 t-80 -50.82 -44.32 59.13 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 123.668 0.787 . . . . 2.8100000000000001 111.211 -167.964 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.251 1.151 0 O-C-N 124.622 1.202 . . . . 5.6399999999999997 109.557 -174.425 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_