data_2rn5_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 2rn5 _Structure_validation_residue.Date_analyzed 2016-10-08 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 13.8 tt . . . . . 0 N--CA 1.483 1.188 0 N-CA-C 115.476 1.658 . . . . 0.0 115.476 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 18.2 t -52.14 -41.76 33.88 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 C-N-CA 124.224 1.009 . . . . 0.0 110.647 169.036 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 -70.74 -5.24 28.45 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 179.617 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 52.6 tt0 -104.3 -63.08 1.24 Allowed 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.007 0.923 . . . . 0.0 108.938 168.014 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 68.7 m -59.1 -33.51 70.92 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 113.674 0.99 . . . . 0.0 113.674 -170.15 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 13.6 t -77.75 -26.92 50.23 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 113.371 0.878 . . . . 0.0 113.371 -172.358 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 28.5 p -116.2 -35.05 4.47 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 125.718 1.607 . . . . 0.0 112.962 -175.611 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 9.0 t -113.95 -169.04 1.44 Allowed 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 126.449 1.9 . . . . 0.0 110.601 174.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 33.8 mm -92.39 145.55 7.45 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 C-N-CA 125.021 1.328 . . . . 0.0 110.456 179.543 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 15.6 p -141.64 176.84 8.58 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.776 1.23 . . . . 0.0 111.234 169.241 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 91.2 p -153.1 164.0 38.82 Favored 'General case' 0 N--CA 1.47 0.549 0 O-C-N 121.075 -1.016 . . . . 0.0 112.918 -169.661 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 21.5 mt -57.18 -37.13 71.68 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 123.945 0.898 . . . . 0.0 112.599 -173.661 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 87.2 t80 -62.05 -28.37 69.55 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.144 0.978 . . . . 0.0 113.475 175.381 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 46.8 mt-30 -87.5 -29.8 21.09 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.398 1.079 . . . . 0.0 111.04 176.141 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 72.5 mt -67.1 -38.17 85.2 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.969 0.908 . . . . 0.0 112.325 170.536 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -52.82 -31.59 39.71 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.743 1.217 . . . . 0.0 113.392 174.297 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -62.97 -19.32 64.19 Favored 'General case' 0 CA--C 1.548 0.886 0 N-CA-C 113.653 0.983 . . . . 0.0 113.653 178.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 95.4 m-85 -107.57 2.94 24.39 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.747 1.619 . . . . 0.0 113.937 -178.184 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 98.7 m -72.0 141.66 49.35 Favored 'General case' 0 CA--C 1.537 0.461 0 O-C-N 121.148 -0.97 . . . . 0.0 113.005 177.029 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 34.5 t30 . . . . . 0 C--O 1.252 1.208 0 C-N-CA 125.458 1.503 . . . . 0.0 111.327 171.566 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 37.9 t80 . . . . . 0 N--CA 1.49 1.573 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 24.3 t 79.27 -51.33 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 C-N-CA 128.404 2.682 . . . . 0.0 112.645 175.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -141.3 111.21 6.61 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 126.738 2.015 . . . . 0.0 107.896 175.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -170.86 174.73 4.73 Favored 'General case' 0 CA--C 1.543 0.695 0 O-C-N 121.496 -0.753 . . . . 0.0 111.949 -166.043 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 94.4 m-70 -81.41 142.2 33.2 Favored 'General case' 0 CA--C 1.55 0.968 0 N-CA-C 107.283 -1.377 . . . . 0.0 107.283 163.767 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 87.4 mt -145.09 135.98 24.66 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 125.819 1.648 . . . . 0.0 110.495 178.327 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.5 t -149.66 145.48 26.75 Favored 'General case' 0 N--CA 1.471 0.608 0 O-C-N 120.865 -1.147 . . . . 0.0 113.235 178.422 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 59.95 -126.68 42.38 Favored Glycine 0 CA--C 1.528 0.862 0 C-N-CA 124.49 1.043 . . . . 0.0 112.77 176.492 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 20.3 p -52.34 -40.79 62.38 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 124.884 1.274 . . . . 0.0 113.021 176.193 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 27.6 m80 -62.93 -42.27 99.75 Favored 'General case' 0 CA--C 1.543 0.687 0 O-C-N 121.206 -0.934 . . . . 0.0 111.66 178.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 48.6 tp -69.03 -41.36 77.81 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 124.085 0.954 . . . . 0.0 111.376 176.654 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 37.8 t -62.15 -44.71 99.38 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 C-N-CA 124.513 1.125 . . . . 0.0 111.267 175.407 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -66.59 -40.07 88.73 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 118.426 0.557 . . . . 0.0 111.977 175.262 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.48 -41.82 99.06 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 119.55 1.068 . . . . 0.0 111.938 174.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 43.2 mt -59.05 -47.17 86.22 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-O 118.818 -0.611 . . . . 0.0 111.046 171.754 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 24.2 m-85 -62.93 -33.89 76.29 Favored 'General case' 0 CA--C 1.545 0.762 0 CA-C-N 120.01 1.277 . . . . 0.0 113.711 175.359 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 70.2 mt -67.24 -42.44 83.96 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 119.395 0.998 . . . . 0.0 112.054 173.051 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 55.5 t -73.52 -46.67 47.95 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 C-N-CA 123.793 0.837 . . . . 0.0 112.097 -179.462 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 33.6 m -85.37 -18.56 33.39 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 113.758 1.022 . . . . 0.0 113.758 -174.064 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 70.55 -155.22 52.88 Favored Glycine 0 CA--C 1.531 1.067 0 C-N-CA 124.709 1.147 . . . . 0.0 112.434 -174.521 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -61.72 -21.12 64.23 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.072 1.349 . . . . 0.0 113.275 -178.733 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 76.9 mtp85 -62.7 -28.18 69.77 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.22 1.008 . . . . 0.0 113.297 175.051 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.86 -166.48 53.27 Favored Glycine 0 CA--C 1.533 1.193 0 C-N-CA 124.942 1.258 . . . . 0.0 113.801 -178.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 44.1 p90 -121.63 148.42 44.58 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 126.025 1.73 . . . . 0.0 111.411 -179.058 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 27.4 p90 -85.83 -13.75 47.11 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 113.299 0.851 . . . . 0.0 113.299 175.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 71.8 t80 -63.98 154.41 34.2 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 126.081 1.752 . . . . 0.0 114.39 -177.622 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 26.3 p -132.63 134.69 25.02 Favored Pre-proline 0 N--CA 1.477 0.914 0 C-N-CA 126.382 1.873 . . . . 0.0 108.31 170.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -63.12 101.42 0.28 Allowed 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 124.371 3.381 . . . . 0.0 112.891 -168.598 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . 0.311 61.5 pttt . . . . . 0 CA--C 1.549 0.94 0 C-N-CA 127.849 2.46 . . . . 0.0 116.83 -174.145 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 20.3 tt . . . . . 0 N--CA 1.488 1.453 0 N-CA-C 115.656 1.725 . . . . 0.0 115.656 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 6.4 p -62.32 -23.46 32.15 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.141 0 C-N-CA 124.124 0.969 . . . . 0.0 112.754 177.226 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -76.04 0.72 17.67 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.224 1.409 . . . . 0.0 112.508 175.336 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 63.4 tp60 -117.93 -54.71 2.31 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 125.042 1.337 . . . . 0.0 109.025 166.868 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 22.8 m -67.72 -26.1 65.99 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 115.419 1.637 . . . . 0.0 115.419 -170.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 37.7 t -103.0 -41.95 5.96 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 119.112 0.869 . . . . 0.0 113.085 -176.547 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 24.1 p -71.42 -33.2 69.22 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 125.986 1.715 . . . . 0.0 112.169 176.359 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.8 t -134.42 -157.81 0.83 Allowed 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.957 1.703 . . . . 0.0 109.606 173.509 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 86.4 mt -100.14 150.11 5.62 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 C-N-CA 125.887 1.675 . . . . 0.0 110.847 -176.003 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.1 p -143.42 -164.02 1.77 Allowed 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 124.148 0.979 . . . . 0.0 112.233 169.387 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 26.5 t -154.84 151.76 28.99 Favored 'General case' 0 N--CA 1.469 0.494 0 O-C-N 120.727 -1.233 . . . . 0.0 111.59 -171.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 62.6 mt -60.77 -28.52 68.8 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.888 0.875 . . . . 0.0 112.22 178.641 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 68.6 t80 -62.15 -31.05 71.49 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.529 1.132 . . . . 0.0 113.049 172.363 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 65.6 mt-30 -81.54 -35.26 30.52 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 123.736 0.814 . . . . 0.0 110.842 175.328 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 17.8 mt -58.71 -41.18 85.71 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 118.924 0.784 . . . . 0.0 111.464 172.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -56.3 -28.46 58.85 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.865 1.666 . . . . 0.0 114.167 176.776 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 15.2 t-20 -66.11 -22.26 66.39 Favored 'General case' 0 CA--C 1.547 0.829 0 O-C-N 121.264 -0.898 . . . . 0.0 112.917 176.658 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 56.7 m-85 -100.88 4.91 43.12 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.404 1.482 . . . . 0.0 113.655 -178.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 77.9 m -73.76 168.35 19.56 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.172 0.989 . . . . 0.0 112.897 171.818 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.248 0.989 0 C-N-CA 125.86 1.664 . . . . 0.0 111.966 -178.863 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 . . . . . 0 N--CA 1.483 1.194 0 CA-C-O 118.313 -0.851 . . . . 0.0 111.078 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 92.5 t -78.72 -39.39 22.61 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.252 0 CA-C-N 120.525 1.511 . . . . 0.0 111.488 -177.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 2.3 t30 59.23 75.05 0.42 Allowed 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 125.564 1.546 . . . . 0.0 112.525 169.145 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -149.51 160.79 43.18 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 124.428 1.091 . . . . 0.0 111.93 -178.146 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 98.0 m-70 -85.02 140.9 30.68 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.494 1.117 . . . . 0.0 111.214 170.833 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 62.0 mt -141.57 137.1 31.71 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 125.941 1.696 . . . . 0.0 110.112 174.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 1.8 t -140.16 143.67 36.27 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 113.132 0.79 . . . . 0.0 113.132 -175.056 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 49.91 -123.03 12.67 Favored Glycine 0 N--CA 1.469 0.896 0 C-N-CA 125.232 1.396 . . . . 0.0 114.175 169.432 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.1 p -56.28 -36.46 68.63 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 124.908 1.283 . . . . 0.0 113.048 177.242 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -73.14 -32.51 64.95 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 120.736 -1.227 . . . . 0.0 112.035 178.235 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 41.9 tp -70.74 -43.3 69.13 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.918 0.887 . . . . 0.0 111.475 172.733 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 39.1 t -59.89 -43.78 92.85 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 C-N-CA 124.497 1.119 . . . . 0.0 110.911 172.524 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -64.08 -43.66 94.76 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.598 0.759 . . . . 0.0 111.088 175.477 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.93 -41.68 99.56 Favored 'General case' 0 CA--C 1.54 0.589 0 O-C-N 121.329 -0.857 . . . . 0.0 112.249 177.009 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 21.6 mt -60.06 -46.38 89.74 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 118.547 0.612 . . . . 0.0 110.662 173.126 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 19.3 m-85 -62.05 -35.72 79.45 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 120.936 -1.102 . . . . 0.0 113.69 173.525 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 62.5 mt -70.24 -41.57 73.37 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 119.49 1.041 . . . . 0.0 111.999 176.091 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 63.0 t -71.7 -42.36 70.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 C-N-CA 123.578 0.751 . . . . 0.0 111.702 179.407 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 36.7 m -86.41 -15.21 41.01 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 114.328 1.233 . . . . 0.0 114.328 -178.144 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 72.9 -162.01 54.61 Favored Glycine 0 CA--C 1.534 1.262 0 C-N-CA 124.963 1.268 . . . . 0.0 112.781 -174.076 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -58.61 -20.72 49.83 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 125.033 1.333 . . . . 0.0 113.354 179.04 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 73.6 mtp85 -61.66 -24.16 66.55 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 125.483 1.513 . . . . 0.0 113.302 175.335 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.42 -178.45 44.76 Favored Glycine 0 CA--C 1.529 0.951 0 C-N-CA 124.74 1.162 . . . . 0.0 113.81 -179.164 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 55.3 p90 -119.01 156.54 29.44 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 125.399 1.48 . . . . 0.0 111.932 -178.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 84.6 t80 -91.38 -40.12 11.63 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.328 1.051 . . . . 0.0 113.042 -177.739 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 8.2 t80 -87.85 112.74 22.81 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 114.162 1.171 . . . . 0.0 114.162 -169.028 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 6.6 t -72.4 144.05 86.21 Favored Pre-proline 0 N--CA 1.476 0.84 0 C-N-CA 124.891 1.276 . . . . 0.0 111.275 179.183 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -73.99 167.03 28.21 Favored 'Trans proline' 0 CA--C 1.537 0.667 0 C-N-CA 123.086 2.524 . . . . 0.0 111.101 169.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 16.1 tptm . . . . . 0 CA--C 1.547 0.865 0 O-C-N 121.217 -0.927 . . . . 0.0 113.093 178.225 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.484 1.228 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 9.5 p -66.0 -36.69 78.08 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 N-CA-C 112.976 0.732 . . . . 0.0 112.976 -179.253 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 46.8 mp0 -68.6 -45.78 71.07 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 119.158 0.89 . . . . 0.0 110.759 169.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 22.5 tt0 -61.18 -49.99 74.96 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.397 1.079 . . . . 0.0 112.165 -172.87 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 1.5 m -68.99 -17.98 64.0 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 113.726 1.01 . . . . 0.0 113.726 176.503 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 48.7 t -98.83 -42.27 7.25 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 119.245 0.929 . . . . 0.0 113.214 -174.667 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 1.9 t -73.6 -26.56 60.86 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 125.352 1.461 . . . . 0.0 112.712 -179.5 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.5 t -137.34 -173.05 3.36 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 125.475 1.51 . . . . 0.0 110.821 174.525 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 63.0 mt -82.44 139.49 17.77 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 C-N-CA 124.748 1.219 . . . . 0.0 110.462 176.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 16.5 p -129.99 158.07 40.58 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.332 1.053 . . . . 0.0 111.558 168.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 22.6 t -108.63 154.96 21.24 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 124.424 1.09 . . . . 0.0 113.904 -169.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -58.52 -31.15 67.64 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.32 1.048 . . . . 0.0 111.462 174.052 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 90.1 t80 -62.1 -33.07 73.74 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.081 0.952 . . . . 0.0 112.98 173.384 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 57.4 mt-30 -76.23 -42.14 46.93 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 123.433 0.693 . . . . 0.0 109.886 174.613 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 81.3 mt -59.14 -41.96 89.52 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 118.455 0.571 . . . . 0.0 111.876 174.668 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 23.5 mt-10 -63.51 -32.53 74.01 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 171.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.4 t-20 -69.95 -23.51 63.2 Favored 'General case' 0 CA--C 1.546 0.819 0 CA-C-N 119.038 0.836 . . . . 0.0 112.772 173.067 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 13.2 m-85 -86.94 -11.04 51.79 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 124.897 1.279 . . . . 0.0 113.614 174.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 61.3 m -63.1 151.35 40.3 Favored 'General case' 0 N--CA 1.47 0.549 0 O-C-N 120.988 -1.07 . . . . 0.0 111.68 169.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 . . . . . 0 C--O 1.252 1.215 0 C-N-CA 125.072 1.349 . . . . 0.0 112.618 179.383 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 77.7 m-85 . . . . . 0 N--CA 1.486 1.349 0 CA-C-O 118.94 -0.553 . . . . 0.0 112.43 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 27.4 m -129.39 -167.48 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.126 0 C-N-CA 125.816 1.646 . . . . 0.0 110.092 -179.024 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 17.8 p-10 -60.82 117.58 5.59 Favored 'General case' 0 CA--C 1.545 0.773 0 O-C-N 121.183 -0.948 . . . . 0.0 110.484 169.755 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 36.9 mt-30 -146.6 174.95 10.96 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.422 1.489 . . . . 0.0 111.333 -167.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 38.4 m-70 -79.51 135.01 36.52 Favored 'General case' 0 CA--C 1.545 0.776 0 O-C-N 121.366 -0.834 . . . . 0.0 109.249 167.373 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 82.7 mt -136.9 121.16 17.98 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 125.931 1.692 . . . . 0.0 109.688 178.215 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 80.9 m -121.19 132.87 55.09 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.772 1.229 . . . . 0.0 111.957 -174.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 50.28 -117.99 5.55 Favored Glycine 0 N--CA 1.476 1.307 0 C-N-CA 125.349 1.452 . . . . 0.0 114.838 168.827 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.1 p -53.85 -39.58 65.75 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 125.221 1.408 . . . . 0.0 112.91 176.678 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -69.67 -34.29 73.76 Favored 'General case' 0 CA--C 1.54 0.586 0 O-C-N 121.098 -1.001 . . . . 0.0 111.826 178.599 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 59.9 tp -68.89 -44.17 73.76 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 123.574 0.75 . . . . 0.0 111.69 172.19 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 47.6 t -60.87 -43.53 95.84 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 C-N-CA 123.948 0.899 . . . . 0.0 110.741 175.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 29.1 mm-40 -64.79 -41.54 95.75 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.434 0.694 . . . . 0.0 112.062 174.083 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.45 -40.75 97.63 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 119.293 0.952 . . . . 0.0 112.047 175.298 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 43.0 mt -61.22 -43.31 99.08 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.568 0.747 . . . . 0.0 111.608 173.84 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 20.1 m-85 -61.49 -42.65 99.11 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 119.635 1.107 . . . . 0.0 112.327 172.44 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 70.4 mt -67.51 -41.57 84.21 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.933 0.893 . . . . 0.0 112.466 179.489 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 51.5 t -73.1 -47.3 48.18 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 C-N-CA 123.962 0.905 . . . . 0.0 111.478 179.441 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 65.7 m -81.67 -30.11 32.83 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 113.621 0.971 . . . . 0.0 113.621 -174.383 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 66.66 -134.43 32.69 Favored Glycine 0 CA--C 1.527 0.814 0 C-N-CA 124.056 0.836 . . . . 0.0 111.127 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 2.5 pm0 -68.24 -13.94 62.62 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 114.229 1.196 . . . . 0.0 114.229 178.08 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 84.3 mtm180 -65.25 -36.2 83.4 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.943 0.897 . . . . 0.0 112.77 179.045 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.83 177.92 40.06 Favored Glycine 0 CA--C 1.535 1.282 0 C-N-CA 124.154 0.883 . . . . 0.0 112.609 -170.573 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 51.6 p90 -153.37 161.93 41.81 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 114.419 1.266 . . . . 0.0 114.419 -171.462 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -96.39 144.04 26.89 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.634 1.574 . . . . 0.0 110.11 168.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 69.6 t80 -161.28 142.67 11.58 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.882 1.273 . . . . 0.0 111.365 -174.526 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 40.4 p -126.59 108.57 23.13 Favored Pre-proline 0 C--O 1.239 0.512 0 C-N-CA 125.118 1.367 . . . . 0.0 110.903 179.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -67.89 106.2 1.27 Allowed 'Trans proline' 0 N--CA 1.457 -0.665 0 C-N-CA 121.82 1.68 . . . . 0.0 108.117 168.161 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 21.6 ttmm . . . . . 0 N--CA 1.472 0.653 0 C-N-CA 129.076 2.95 . . . . 0.0 114.281 -176.531 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 10.4 tp . . . . . 0 N--CA 1.48 1.044 0 CA-C-O 118.898 -0.572 . . . . 0.0 112.485 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 96.0 t -63.11 -51.88 66.02 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 CA-C-N 118.519 0.6 . . . . 0.0 110.541 174.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -53.21 -48.15 68.37 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 123.571 0.748 . . . . 0.0 111.067 173.036 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 42.1 tp60 -65.64 -55.18 18.91 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.886 0.875 . . . . 0.0 111.354 -172.358 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 72.0 m -69.47 -26.45 64.58 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 -178.014 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 84.9 m -71.88 -50.44 29.3 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 119.453 1.024 . . . . 0.0 111.17 171.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -79.93 -19.34 48.29 Favored 'General case' 0 N--CA 1.478 0.965 0 N-CA-C 114.065 1.135 . . . . 0.0 114.065 -172.291 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 95.8 p -149.82 168.93 22.31 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.254 1.022 . . . . 0.0 113.09 -173.406 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 53.2 mt -69.63 125.27 27.34 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 O-C-N 121.244 -0.91 . . . . 0.0 109.504 170.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 15.3 p -117.13 -159.9 0.75 Allowed 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.693 1.197 . . . . 0.0 110.411 170.427 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 6.7 t -157.19 168.76 26.46 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 120.209 -1.557 . . . . 0.0 111.481 175.161 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 52.0 mt -63.28 -27.46 69.35 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.685 1.194 . . . . 0.0 112.839 -174.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.2 t80 -63.73 -32.43 73.93 Favored 'General case' 0 CA--C 1.546 0.79 0 O-C-N 121.282 -0.886 . . . . 0.0 113.081 169.874 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 44.6 mm-40 -75.07 -23.57 58.07 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 123.569 0.748 . . . . 0.0 111.245 175.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 30.5 mt -77.06 -48.29 18.26 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 123.892 0.877 . . . . 0.0 110.817 172.679 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 -63.11 -22.72 67.05 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 113.639 0.977 . . . . 0.0 113.639 178.026 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 16.8 t30 -54.48 -29.4 49.84 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 123.929 0.892 . . . . 0.0 112.856 169.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 97.3 m-85 -100.8 7.45 43.75 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.316 1.446 . . . . 0.0 113.429 176.807 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 22.8 t -89.76 167.78 12.61 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.885 1.274 . . . . 0.0 111.782 170.029 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 21.7 m-80 . . . . . 0 C--O 1.252 1.192 0 C-N-CA 125.136 1.374 . . . . 0.0 112.561 173.253 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 65.6 m-85 . . . . . 0 N--CA 1.487 1.413 0 N-CA-C 110.779 -0.082 . . . . 0.0 110.779 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 76.2 t -68.62 142.31 16.41 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.239 0 C-N-CA 124.438 1.095 . . . . 0.0 110.606 -179.627 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 6.4 t-20 65.08 64.55 0.62 Allowed 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 126.114 1.766 . . . . 0.0 112.679 173.425 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 47.4 mt-30 -143.33 -170.68 3.33 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 126.037 1.735 . . . . 0.0 110.308 -179.139 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 23.6 m-70 -73.7 146.24 44.59 Favored 'General case' 0 CA--C 1.545 0.761 0 O-C-N 120.897 -1.127 . . . . 0.0 109.815 167.025 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 62.9 mt -143.82 125.56 15.1 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 126.001 1.72 . . . . 0.0 109.072 174.713 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 5.6 t -137.99 149.91 46.53 Favored 'General case' 0 CA--C 1.537 0.475 0 O-C-N 121.275 -0.89 . . . . 0.0 112.993 -176.719 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 54.29 -130.46 44.7 Favored Glycine 0 N--CA 1.468 0.827 0 C-N-CA 125.028 1.299 . . . . 0.0 113.572 174.132 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.9 m -56.54 -32.02 64.71 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.306 1.043 . . . . 0.0 113.128 179.141 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -73.07 -35.91 66.76 Favored 'General case' 0 CA--C 1.543 0.696 0 O-C-N 120.862 -1.149 . . . . 0.0 112.024 177.576 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 58.9 tp -67.25 -44.89 78.29 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 123.66 0.784 . . . . 0.0 110.943 172.106 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 58.3 t -61.45 -42.46 93.94 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 123.907 0.883 . . . . 0.0 110.902 176.006 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -62.67 -44.55 95.96 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 123.329 0.652 . . . . 0.0 112.052 173.687 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.33 -40.47 96.47 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 118.784 0.72 . . . . 0.0 112.22 175.757 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 16.0 mt -59.71 -44.5 93.69 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.025 0.93 . . . . 0.0 111.774 172.68 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 20.7 m-85 -62.93 -40.66 98.32 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 119.499 1.045 . . . . 0.0 112.993 173.322 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 78.7 mt -66.92 -41.97 86.18 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.676 0.79 . . . . 0.0 112.556 177.128 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 38.9 t -71.73 -48.44 51.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 C-N-CA 124.482 1.113 . . . . 0.0 111.949 178.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 28.0 t -86.84 -37.24 17.93 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 113.31 0.856 . . . . 0.0 113.31 -170.124 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 69.63 -146.0 42.96 Favored Glycine 0 CA--C 1.533 1.187 0 C-N-CA 124.201 0.905 . . . . 0.0 112.097 -177.264 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -65.44 -15.63 62.82 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 125.136 1.375 . . . . 0.0 113.44 -178.805 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 80.1 mtm180 -60.83 -29.95 69.8 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.886 1.274 . . . . 0.0 113.734 -178.591 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 80.52 138.91 2.19 Favored Glycine 0 N--CA 1.472 1.077 0 C-N-CA 125.249 1.405 . . . . 0.0 113.336 178.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 44.2 p90 -118.75 153.24 34.74 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 125.284 1.434 . . . . 0.0 113.232 -178.057 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 26.3 p90 -120.31 37.96 4.11 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 127.844 2.458 . . . . 0.0 111.227 -177.016 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -49.34 142.16 7.88 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 125.87 1.668 . . . . 0.0 114.231 -178.892 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 11.2 p -93.13 111.09 50.15 Favored Pre-proline 0 N--CA 1.474 0.766 0 C-N-CA 125.233 1.413 . . . . 0.0 112.806 -175.442 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_endo -79.62 161.08 25.01 Favored 'Trans proline' 0 C--N 1.353 0.807 0 C-N-CA 123.758 2.972 . . . . 0.0 110.597 169.35 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 43.5 tptt . . . . . 0 CA--C 1.549 0.908 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 -178.539 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 15.1 tt . . . . . 0 N--CA 1.486 1.366 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 7.1 p -65.56 -23.43 32.69 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.76 0 C-N-CA 124.511 1.124 . . . . 0.0 112.95 -177.661 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 26.0 pm0 -68.96 -11.53 60.8 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.338 1.455 . . . . 0.0 113.951 169.807 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 71.6 tp60 -105.92 -45.96 4.23 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 124.056 0.943 . . . . 0.0 110.542 169.454 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 54.4 m -79.33 -29.25 42.2 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 115.907 1.817 . . . . 0.0 115.907 -171.586 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 42.0 t -98.46 -56.92 2.32 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 119.86 1.209 . . . . 0.0 113.113 -173.436 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 17.0 p -66.47 -46.81 75.12 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.103 1.361 . . . . 0.0 111.074 178.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.9 t -102.15 -161.24 0.84 Allowed 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 124.771 1.228 . . . . 0.0 110.59 168.548 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 49.4 mt -110.01 150.16 12.71 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 C-N-CA 126.59 1.956 . . . . 0.0 110.28 -179.541 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 12.2 p -141.34 158.77 43.43 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 114.571 1.322 . . . . 0.0 114.571 174.153 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 78.6 p -98.3 167.59 10.76 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 126.195 1.798 . . . . 0.0 113.478 175.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 31.4 mt -65.0 -27.63 68.96 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 121.356 -0.84 . . . . 0.0 112.053 173.644 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.5 t80 -67.02 -34.74 78.38 Favored 'General case' 0 CA--C 1.542 0.643 0 O-C-N 121.449 -0.782 . . . . 0.0 112.253 171.456 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 81.7 mt-30 -73.39 -26.5 61.01 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 118.746 -0.645 . . . . 0.0 112.073 172.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 68.7 mt -68.61 -49.45 59.18 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 119.47 1.032 . . . . 0.0 110.523 168.404 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 18.1 mm-40 -56.35 -30.56 62.78 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.71 1.204 . . . . 0.0 113.256 175.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -59.45 -24.19 63.34 Favored 'General case' 0 CA--C 1.55 0.945 0 N-CA-C 113.68 0.993 . . . . 0.0 113.68 178.549 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 78.8 m-85 -100.48 -2.46 33.09 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.224 1.41 . . . . 0.0 114.037 175.462 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 75.1 m -86.99 153.62 21.42 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 121.03 -1.044 . . . . 0.0 113.506 179.395 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 31.6 m120 . . . . . 0 C--O 1.253 1.244 0 C-N-CA 125.277 1.431 . . . . 0.0 113.241 179.46 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 22.8 p90 . . . . . 0 N--CA 1.486 1.339 0 CA-C-O 119.471 -0.3 . . . . 0.0 110.78 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 34.8 m -66.29 -21.36 28.61 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.325 0 N-CA-C 114.757 1.391 . . . . 0.0 114.757 -171.103 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 22.0 t-20 -73.96 111.63 9.31 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 169.358 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -162.97 -179.07 6.48 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 113.158 0.799 . . . . 0.0 113.158 -167.915 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 89.0 m-70 -81.95 136.76 35.26 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 123.502 0.721 . . . . 0.0 110.719 168.588 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 65.7 mt -142.04 135.02 28.79 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 126.411 1.884 . . . . 0.0 108.872 173.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 1.3 t -139.32 145.27 38.87 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 112.878 0.696 . . . . 0.0 112.878 -174.767 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 48.57 -123.34 10.1 Favored Glycine 0 N--CA 1.47 0.948 0 C-N-CA 125.197 1.38 . . . . 0.0 114.146 170.071 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 18.3 m -54.9 -36.74 65.49 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 124.606 1.162 . . . . 0.0 113.393 178.409 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 73.4 m-70 -76.62 -29.41 56.47 Favored 'General case' 0 CA--C 1.538 0.486 0 O-C-N 120.777 -1.202 . . . . 0.0 112.693 177.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 39.4 tp -69.81 -44.59 69.7 Favored 'General case' 0 N--CA 1.468 0.431 0 O-C-N 121.658 -0.651 . . . . 0.0 111.304 170.483 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 42.7 t -60.15 -44.26 94.85 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 125.15 1.38 . . . . 0.0 111.141 173.036 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -59.98 -46.78 88.32 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.993 1.317 . . . . 0.0 111.866 173.305 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.47 -43.03 99.8 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 118.942 0.792 . . . . 0.0 112.093 177.082 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 29.0 mt -58.35 -45.01 89.01 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 123.617 0.767 . . . . 0.0 111.366 174.73 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 11.5 m-85 -61.8 -44.67 96.4 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 123.243 0.617 . . . . 0.0 112.436 173.686 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 73.3 mt -68.14 -41.56 81.46 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 123.852 0.861 . . . . 0.0 112.52 -178.515 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 65.6 t -72.14 -48.79 47.59 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 C-N-CA 123.658 0.783 . . . . 0.0 111.527 -179.461 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 71.3 m -96.97 -17.24 20.2 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 115.013 1.486 . . . . 0.0 115.013 -169.487 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 67.76 -145.48 45.29 Favored Glycine 0 CA--C 1.53 1.017 0 C-N-CA 124.533 1.064 . . . . 0.0 113.834 172.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -61.06 -20.4 62.52 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.363 1.465 . . . . 0.0 113.906 -176.114 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 40.4 mtp180 -56.23 -38.53 71.2 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.032 1.333 . . . . 0.0 112.973 177.262 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.38 175.48 45.42 Favored Glycine 0 CA--C 1.535 1.337 0 C-N-CA 124.729 1.156 . . . . 0.0 113.618 -176.002 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 51.9 p90 -153.1 160.87 42.97 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.315 1.446 . . . . 0.0 113.865 -172.794 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 70.7 t80 -89.06 146.24 24.96 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.607 1.563 . . . . 0.0 110.937 170.038 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 56.4 t80 -155.26 129.36 8.81 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.846 0.858 . . . . 0.0 112.412 -178.482 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 21.3 p -146.49 159.16 45.54 Favored Pre-proline 0 N--CA 1.477 0.899 0 C-N-CA 126.739 2.015 . . . . 0.0 110.343 176.374 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -74.56 -179.83 5.22 Favored 'Trans proline' 0 C--N 1.351 0.699 0 C-N-CA 123.767 2.978 . . . . 0.0 112.202 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 48.5 mtmt . . . . . 0 N--CA 1.477 0.888 0 C-N-CA 124.811 1.244 . . . . 0.0 113.544 -179.367 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 14.1 tt . . . . . 0 N--CA 1.481 1.114 0 N-CA-C 114.072 1.138 . . . . 0.0 114.072 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 50.5 t -62.93 -38.19 81.27 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.32 0 CA-C-N 119.488 1.04 . . . . 0.0 111.184 -175.181 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.1 pm0 -67.22 -7.61 25.28 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 114.105 1.15 . . . . 0.0 114.105 176.641 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 13.2 tp60 -105.6 -56.76 2.13 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.295 1.038 . . . . 0.0 110.224 168.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 19.2 m -77.29 -25.37 51.29 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 115.025 1.491 . . . . 0.0 115.025 -170.559 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 34.2 t -96.31 -42.37 8.18 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 119.569 1.077 . . . . 0.0 111.807 178.043 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 33.7 m -62.74 -37.89 88.36 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 125.263 1.425 . . . . 0.0 112.153 176.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.9 t -138.22 -170.49 2.82 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.587 1.155 . . . . 0.0 110.952 178.54 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 55.2 mt -79.0 139.87 17.73 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 C-N-CA 124.713 1.205 . . . . 0.0 110.089 175.801 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 8.7 p -136.05 157.4 46.93 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 121.907 0.86 . . . . 0.0 113.056 169.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.4 m -104.55 164.3 11.85 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 125.168 1.387 . . . . 0.0 111.749 -173.062 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 45.3 mt -56.27 -32.03 64.16 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 121.458 -0.776 . . . . 0.0 112.235 172.177 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.7 t80 -61.58 -29.78 70.24 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 124.113 0.965 . . . . 0.0 113.4 174.221 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 61.6 mm-40 -78.87 -36.43 42.23 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.317 0.647 . . . . 0.0 110.484 175.652 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 87.2 mt -64.13 -43.52 95.03 Favored 'General case' 0 CA--C 1.539 0.546 0 O-C-N 121.813 -0.554 . . . . 0.0 111.467 171.716 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -59.39 -24.19 63.24 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.601 1.56 . . . . 0.0 114.172 173.765 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.4 t30 -77.3 -29.49 53.7 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 123.951 0.901 . . . . 0.0 112.702 176.247 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 27.0 m-85 -86.23 -1.3 57.34 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 124.625 1.17 . . . . 0.0 113.884 175.16 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 57.2 m -73.5 132.2 42.62 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 123.405 0.682 . . . . 0.0 110.36 168.593 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.251 1.161 0 C-N-CA 127.168 2.187 . . . . 0.0 112.765 -172.31 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 12.5 t80 . . . . . 0 N--CA 1.489 1.478 0 CA-C-O 118.757 -0.639 . . . . 0.0 110.301 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 92.1 t -61.67 122.48 12.39 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 CA-C-N 120.224 1.375 . . . . 0.0 111.457 -174.212 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 47.4 t30 -168.27 103.0 0.44 Allowed 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 126.351 1.861 . . . . 0.0 109.312 -174.063 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 3.0 mm-40 -164.21 179.51 6.82 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.802 1.241 . . . . 0.0 111.563 -168.817 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 40.9 m-70 -72.73 138.54 46.61 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 123.775 0.83 . . . . 0.0 110.37 168.173 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 72.6 mt -140.39 126.79 20.03 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 126.925 2.09 . . . . 0.0 109.045 175.613 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 87.4 m -128.0 141.92 51.38 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.61 1.164 . . . . 0.0 112.614 -172.382 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 47.94 -121.04 6.66 Favored Glycine 0 C--N 1.343 0.941 0 C-N-CA 125.273 1.416 . . . . 0.0 114.552 169.11 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 18.1 m -54.65 -37.69 65.99 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.835 1.254 . . . . 0.0 113.105 178.382 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 77.2 m-70 -75.07 -28.52 60.39 Favored 'General case' 0 CA--C 1.543 0.68 0 O-C-N 120.958 -1.089 . . . . 0.0 112.759 176.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 28.5 tp -70.08 -43.54 70.94 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 121.353 -0.842 . . . . 0.0 111.371 170.051 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 60.8 t -61.75 -41.8 91.94 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.094 0 C-N-CA 124.348 1.059 . . . . 0.0 110.891 173.009 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -58.35 -49.87 75.69 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.894 1.277 . . . . 0.0 111.49 173.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.41 -42.4 96.08 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.532 0.733 . . . . 0.0 111.645 179.454 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 47.0 mt -56.69 -51.11 70.04 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-O 118.661 -0.685 . . . . 0.0 111.349 173.685 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -66.47 -35.18 79.65 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 119.897 1.226 . . . . 0.0 112.271 -178.193 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 83.8 mt -68.95 -41.14 78.44 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 123.611 0.765 . . . . 0.0 112.525 176.422 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 41.9 t -71.5 -46.58 62.82 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.984 0 C-N-CA 123.66 0.784 . . . . 0.0 112.002 177.389 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 72.0 m -78.13 -38.34 44.1 Favored 'General case' 0 N--CA 1.466 0.334 0 N-CA-C 113.306 0.854 . . . . 0.0 113.306 -173.072 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 56.36 -123.71 32.34 Favored Glycine 0 CA--C 1.53 1.013 0 C-N-CA 123.659 0.647 . . . . 0.0 111.912 -179.602 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 3.2 pm0 -67.01 -15.45 63.74 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.671 1.588 . . . . 0.0 114.705 178.374 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 81.8 mtp180 -67.99 -26.22 65.81 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 119.106 0.866 . . . . 0.0 112.732 178.607 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.42 168.69 20.11 Favored Glycine 0 CA--C 1.534 1.229 0 C-N-CA 124.616 1.103 . . . . 0.0 112.245 -169.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 34.3 p90 -152.96 165.68 34.78 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 125.026 1.33 . . . . 0.0 112.821 -178.423 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -132.11 104.81 7.0 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 123.933 0.893 . . . . 0.0 110.49 171.141 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 83.7 t80 -73.4 148.98 42.83 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 123.97 0.908 . . . . 0.0 111.394 171.139 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -158.02 115.51 1.81 Allowed Pre-proline 0 N--CA 1.472 0.657 0 C-N-CA 124.997 1.319 . . . . 0.0 109.659 178.694 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_endo -79.71 177.38 8.49 Favored 'Trans proline' 0 CA--C 1.534 0.508 0 C-N-CA 123.982 3.121 . . . . 0.0 112.686 -172.607 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt . . . . . 0 CA--C 1.548 0.901 0 C-N-CA 125.036 1.334 . . . . 0.0 112.605 176.034 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 14.2 tt . . . . . 0 N--CA 1.484 1.252 0 CA-C-O 119.991 -0.052 . . . . 0.0 110.96 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 2.7 t -65.73 -33.11 61.41 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.127 0 C-N-CA 123.556 0.743 . . . . 0.0 111.184 -171.655 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.5 pm0 -68.67 -8.96 47.2 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.961 1.305 . . . . 0.0 113.879 175.318 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 72.0 tp60 -103.72 -58.42 1.88 Allowed 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.108 0.963 . . . . 0.0 108.951 168.208 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 41.8 m -65.86 -31.17 71.97 Favored 'General case' 0 N--CA 1.469 0.486 0 N-CA-C 115.159 1.54 . . . . 0.0 115.159 -170.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 48.5 t -96.97 -47.34 5.85 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 119.09 0.859 . . . . 0.0 112.167 -178.398 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 32.1 m -69.95 -31.52 69.29 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 125.496 1.518 . . . . 0.0 111.887 -179.504 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.4 t -133.36 -152.87 0.51 Allowed 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.34 1.456 . . . . 0.0 109.974 172.503 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 78.5 mt -101.34 147.55 8.17 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 C-N-CA 126.522 1.929 . . . . 0.0 109.76 179.283 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.0 p -138.5 160.97 38.21 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 113.103 0.779 . . . . 0.0 113.103 169.252 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 76.6 p -105.74 163.01 13.04 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 125.46 1.504 . . . . 0.0 113.626 -174.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 81.6 mt -60.51 -33.24 72.34 Favored 'General case' 0 N--CA 1.471 0.581 0 O-C-N 121.47 -0.769 . . . . 0.0 111.984 170.18 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 91.6 t80 -65.25 -36.17 83.29 Favored 'General case' 0 N--CA 1.47 0.544 0 O-C-N 121.604 -0.685 . . . . 0.0 112.327 174.271 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 87.8 mt-30 -70.18 -40.15 74.81 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 118.563 -0.732 . . . . 0.0 111.054 172.177 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 73.0 mt -58.77 -41.52 86.78 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 119.549 1.068 . . . . 0.0 111.979 172.07 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 18.3 mt-10 -63.21 -35.68 81.13 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 113.527 0.936 . . . . 0.0 113.527 171.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 26.9 t30 -65.37 -24.07 67.14 Favored 'General case' 0 CA--C 1.547 0.837 0 O-C-N 120.94 -1.1 . . . . 0.0 112.429 174.355 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 47.6 m-85 -90.99 0.71 57.47 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 125.163 1.385 . . . . 0.0 114.056 173.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 67.2 m -71.74 149.59 45.25 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 120.93 -1.106 . . . . 0.0 111.307 169.172 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 . . . . . 0 C--O 1.251 1.184 0 C-N-CA 125.342 1.457 . . . . 0.0 112.999 -179.569 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 82.0 m-85 . . . . . 0 N--CA 1.486 1.326 0 CA-C-O 119.34 -0.362 . . . . 0.0 111.359 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 22.8 t 73.83 -50.28 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 C-N-CA 128.252 2.621 . . . . 0.0 113.21 172.633 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 3.6 m120 -99.79 134.03 43.28 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.236 1.415 . . . . 0.0 111.362 -178.671 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 2.4 mm-40 -159.75 169.94 22.57 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.977 1.311 . . . . 0.0 112.508 -178.065 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 97.0 m-70 -88.98 135.29 33.63 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.784 1.233 . . . . 0.0 109.372 167.191 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 77.5 mt -143.81 119.46 10.44 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 125.592 1.557 . . . . 0.0 109.521 -177.555 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 86.4 m -123.78 130.79 53.17 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.818 1.247 . . . . 0.0 112.543 -176.468 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 58.83 -121.12 25.54 Favored Glycine 0 N--CA 1.472 1.063 0 C-N-CA 124.815 1.198 . . . . 0.0 113.998 169.243 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 24.1 p -53.47 -43.15 67.92 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 124.437 1.095 . . . . 0.0 112.501 177.182 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 27.4 m80 -61.08 -40.74 94.84 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.313 1.045 . . . . 0.0 112.031 177.428 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 47.3 tp -66.72 -45.91 77.18 Favored 'General case' 0 C--O 1.223 -0.323 0 C-N-CA 124.117 0.967 . . . . 0.0 111.363 174.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 68.6 t -62.89 -42.16 95.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 C-N-CA 123.903 0.881 . . . . 0.0 111.241 178.339 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.7 mm-40 -59.01 -52.04 67.48 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.677 0.791 . . . . 0.0 111.216 173.436 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.79 -44.74 89.01 Favored 'General case' 0 CA--C 1.538 0.518 0 O-C-N 121.681 -0.637 . . . . 0.0 111.905 -177.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 62.5 tp -58.66 -50.03 75.38 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 125.023 1.329 . . . . 0.0 111.217 178.513 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -68.01 -35.83 78.96 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 119.437 1.017 . . . . 0.0 112.291 179.258 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 78.4 mt -67.47 -36.33 80.93 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 118.864 0.757 . . . . 0.0 112.195 176.129 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 33.4 t -67.04 -45.66 86.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 CA-C-N 118.906 0.776 . . . . 0.0 111.482 171.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 72.2 m -73.6 -34.54 65.11 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 113.655 0.983 . . . . 0.0 113.655 -176.763 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 64.49 -130.93 37.84 Favored Glycine 0 CA--C 1.529 0.931 0 C-N-CA 124.142 0.877 . . . . 0.0 111.041 -177.698 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -65.91 -15.25 62.78 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 114.47 1.285 . . . . 0.0 114.47 178.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 83.4 mtm180 -66.89 -32.75 74.21 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.21 1.004 . . . . 0.0 113.564 -176.641 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.09 176.63 44.36 Favored Glycine 0 CA--C 1.533 1.204 0 C-N-CA 123.867 0.746 . . . . 0.0 112.212 -169.587 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 45.3 p90 -149.14 159.62 44.08 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 114.881 1.437 . . . . 0.0 114.881 -168.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 76.8 t80 -100.35 136.44 40.24 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 126.601 1.961 . . . . 0.0 109.691 169.255 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 64.1 t80 -153.94 122.34 6.18 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.775 0.83 . . . . 0.0 112.283 -179.7 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 9.3 t 170.87 136.17 0.07 OUTLIER Pre-proline 0 N--CA 1.479 1.007 0 C-N-CA 129.316 3.046 . . . . 0.0 109.544 170.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -85.24 166.71 10.85 Favored 'Trans proline' 0 CA--C 1.536 0.624 0 C-N-CA 123.628 2.885 . . . . 0.0 112.07 174.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 94.0 mttt . . . . . 0 CA--C 1.542 0.651 0 N-CA-C 112.807 0.669 . . . . 0.0 112.807 169.408 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 17.8 tt . . . . . 0 N--CA 1.484 1.256 0 N-CA-C 114.026 1.121 . . . . 0.0 114.026 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 41.9 t -66.77 -32.55 58.53 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.99 0 C-N-CA 123.556 0.742 . . . . 0.0 111.745 -178.342 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -69.25 -48.07 62.89 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.398 0.679 . . . . 0.0 110.498 169.799 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 31.7 tt0 -69.1 -45.63 69.76 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 124.005 0.922 . . . . 0.0 111.979 -169.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 61.0 m -64.05 -24.49 67.72 Favored 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 113.617 0.969 . . . . 0.0 113.617 175.475 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 37.3 t -92.95 -42.6 9.38 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 118.746 0.703 . . . . 0.0 112.158 -177.714 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 69.6 p -79.67 -21.95 44.09 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 124.981 1.313 . . . . 0.0 113.64 179.361 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 9.0 t -142.14 -166.89 2.34 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.327 1.451 . . . . 0.0 111.099 175.326 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 71.0 mt -97.76 112.23 29.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 O-C-N 120.57 -1.331 . . . . 0.0 108.172 170.889 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 31.6 p -83.58 156.62 22.66 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 123.694 0.798 . . . . 0.0 111.298 171.036 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 48.7 m -83.59 149.64 26.43 Favored 'General case' 0 N--CA 1.471 0.613 0 O-C-N 120.747 -1.221 . . . . 0.0 111.72 -178.118 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 74.2 mt -60.81 -26.71 67.5 Favored 'General case' 0 CA--C 1.546 0.801 0 O-C-N 121.048 -1.032 . . . . 0.0 111.556 171.008 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 82.7 t80 -65.12 -28.53 69.49 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 124.885 1.274 . . . . 0.0 113.808 169.807 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 94.5 mt-30 -79.56 -36.15 38.72 Favored 'General case' 0 N--CA 1.472 0.628 0 O-C-N 121.048 -1.033 . . . . 0.0 110.279 174.59 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 82.1 mt -61.26 -42.99 99.57 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 118.598 0.635 . . . . 0.0 111.419 169.082 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 45.8 mm-40 -60.75 -34.3 74.23 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.561 1.144 . . . . 0.0 113.312 170.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 17.0 t30 -64.63 -28.65 69.76 Favored 'General case' 0 CA--C 1.546 0.817 0 O-C-N 121.021 -1.049 . . . . 0.0 112.703 179.2 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 23.8 m-85 -87.79 -12.22 45.7 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 124.547 1.139 . . . . 0.0 113.394 173.727 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 35.1 t -80.53 174.01 12.03 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.416 1.486 . . . . 0.0 111.525 168.784 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 12.6 m-80 . . . . . 0 C--O 1.251 1.146 0 C-N-CA 125.126 1.37 . . . . 0.0 112.672 171.336 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 71.1 m-85 . . . . . 0 N--CA 1.489 1.489 0 N-CA-C 111.466 0.173 . . . . 0.0 111.466 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 8.5 p -63.36 150.0 9.94 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.125 0 C-N-CA 124.734 1.214 . . . . 0.0 112.435 178.337 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 43.4 t30 81.24 178.96 0.08 Allowed 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 127.628 2.371 . . . . 0.0 113.421 172.262 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 38.0 mt-30 -134.99 -179.97 5.95 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 127.091 2.156 . . . . 0.0 110.218 -176.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 27.0 m-70 -69.68 135.67 50.13 Favored 'General case' 0 CA--C 1.546 0.821 0 O-C-N 121.202 -0.936 . . . . 0.0 110.246 168.691 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 87.7 mt -137.34 118.59 14.57 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 126.803 2.041 . . . . 0.0 109.601 -176.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 85.9 m -123.7 139.6 53.83 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.213 1.405 . . . . 0.0 111.307 -178.268 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 50.84 -123.88 18.31 Favored Glycine 0 N--CA 1.473 1.14 0 C-N-CA 124.693 1.14 . . . . 0.0 114.582 169.518 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 18.5 m -56.02 -32.74 64.28 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.542 1.137 . . . . 0.0 113.389 178.63 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 1.4 t-80 -72.72 -35.04 67.49 Favored 'General case' 0 CA--C 1.54 0.585 0 O-C-N 120.825 -1.172 . . . . 0.0 111.537 176.711 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 49.8 tp -68.43 -42.1 79.38 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 123.66 0.784 . . . . 0.0 111.474 171.446 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 65.3 t -59.94 -44.07 93.67 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 C-N-CA 123.577 0.751 . . . . 0.0 110.566 173.707 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -63.12 -44.24 96.16 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.52 0.728 . . . . 0.0 112.215 174.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.47 -39.87 94.82 Favored 'General case' 0 CA--C 1.537 0.479 0 O-C-N 121.221 -0.924 . . . . 0.0 112.179 175.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 37.0 mt -62.71 -41.7 99.28 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 123.612 0.765 . . . . 0.0 111.455 173.748 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 19.7 m-85 -61.42 -40.99 96.42 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-N 119.915 1.234 . . . . 0.0 112.376 171.601 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 77.8 mt -68.22 -42.59 79.59 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.772 0.829 . . . . 0.0 112.816 178.188 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 46.8 t -72.71 -47.43 50.23 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 124.005 0.922 . . . . 0.0 111.608 178.512 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 33.9 t -83.35 -41.37 18.29 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 113.432 0.901 . . . . 0.0 113.432 -170.393 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 70.62 -143.07 36.27 Favored Glycine 0 CA--C 1.53 1.025 0 C-N-CA 124.217 0.913 . . . . 0.0 112.514 -176.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -64.67 -18.58 65.09 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 125.234 1.414 . . . . 0.0 113.518 -178.161 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 71.0 mtm180 -60.84 -30.67 70.25 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.664 1.185 . . . . 0.0 114.084 -177.236 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 80.46 142.23 2.98 Favored Glycine 0 CA--C 1.534 1.237 0 C-N-CA 125.57 1.557 . . . . 0.0 113.352 179.628 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 52.7 p90 -129.41 155.85 45.01 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 125.199 1.4 . . . . 0.0 112.579 -177.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -85.83 143.67 28.14 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.485 1.114 . . . . 0.0 110.571 171.248 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 65.0 t80 -158.84 130.61 6.52 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.242 1.017 . . . . 0.0 112.732 -179.775 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 98.6 m -144.25 121.95 6.69 Favored Pre-proline 0 N--CA 1.475 0.803 0 C-N-CA 126.302 1.841 . . . . 0.0 108.065 170.09 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_endo -80.83 153.01 19.52 Favored 'Trans proline' 0 N--CA 1.458 -0.617 0 C-N-CA 123.053 2.502 . . . . 0.0 110.548 177.215 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 5.2 tmtt? . . . . . 0 CA--C 1.547 0.865 0 N-CA-C 114.081 1.141 . . . . 0.0 114.081 -178.079 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 9.2 tp . . . . . 0 N--CA 1.486 1.335 0 N-CA-C 114.544 1.313 . . . . 0.0 114.544 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 16.4 t -62.78 -33.25 59.09 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.888 0 C-N-CA 124.467 1.107 . . . . 0.0 111.72 -178.139 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -70.05 -21.53 63.16 Favored 'General case' 0 CA--C 1.544 0.72 0 O-C-N 121.508 -0.745 . . . . 0.0 112.485 176.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 72.0 tp60 -87.56 -59.34 2.28 Favored 'General case' 0 CA--C 1.535 0.375 0 O-C-N 121.516 -0.74 . . . . 0.0 110.025 170.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 63.0 m -70.52 -32.37 69.81 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 114.75 1.389 . . . . 0.0 114.75 -169.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 16.5 t -82.91 -53.62 5.71 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 119.523 1.056 . . . . 0.0 110.936 -176.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 17.7 m -77.95 -24.39 48.2 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 126.278 1.831 . . . . 0.0 112.655 -174.008 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.4 t -137.77 -167.28 2.11 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.085 1.354 . . . . 0.0 111.364 176.308 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 69.9 mt -86.04 145.26 8.01 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 C-N-CA 124.699 1.199 . . . . 0.0 109.946 175.694 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.0 p -137.83 159.27 42.46 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 114.146 1.165 . . . . 0.0 114.146 171.583 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 87.9 p -117.57 168.31 10.52 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.63 1.572 . . . . 0.0 113.394 -176.452 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 79.0 mt -57.11 -34.03 67.95 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 124.214 1.006 . . . . 0.0 112.78 177.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 89.3 t80 -61.43 -32.76 72.73 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.235 1.014 . . . . 0.0 112.583 175.189 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 90.9 mt-30 -82.75 -31.28 28.44 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.815 0.846 . . . . 0.0 111.107 177.699 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 76.1 mt -65.92 -41.35 91.52 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 118.725 0.693 . . . . 0.0 111.55 169.722 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 45.7 mm-40 -60.27 -37.51 80.65 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.911 1.285 . . . . 0.0 112.705 169.724 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.8 t-20 -61.97 -26.22 68.08 Favored 'General case' 0 CA--C 1.55 0.97 0 O-C-N 121.085 -1.009 . . . . 0.0 113.542 -175.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 51.5 m-85 -97.26 -2.0 43.6 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 125.267 1.427 . . . . 0.0 113.874 175.561 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 18.7 t -79.72 172.03 14.34 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.861 1.265 . . . . 0.0 111.394 168.826 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 9.1 m-80 . . . . . 0 C--O 1.256 1.407 0 C-N-CA 124.497 1.119 . . . . 0.0 112.494 171.723 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.48 0 CA-C-O 119.17 -0.443 . . . . 0.0 111.367 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 92.3 t -87.43 110.06 20.15 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 CA-C-N 119.513 1.051 . . . . 0.0 109.273 177.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 37.3 t30 -162.53 98.66 1.01 Allowed 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 127.312 2.245 . . . . 0.0 107.615 -179.279 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 6.1 tt0 -161.04 170.28 20.83 Favored 'General case' 0 N--CA 1.476 0.826 0 O-C-N 121.542 -0.724 . . . . 0.0 112.119 -166.264 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 31.6 m-70 -73.77 141.93 46.25 Favored 'General case' 0 CA--C 1.549 0.906 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 164.268 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 76.5 mt -145.21 133.55 21.78 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 126.884 2.073 . . . . 0.0 108.733 175.569 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.7 t -146.69 154.52 41.53 Favored 'General case' 0 N--CA 1.471 0.62 0 O-C-N 121.363 -0.836 . . . . 0.0 113.209 -178.814 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 54.99 -133.98 48.18 Favored Glycine 0 N--CA 1.471 0.989 0 C-N-CA 124.436 1.017 . . . . 0.0 113.021 176.612 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 18.4 m -54.36 -36.55 63.97 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.207 1.003 . . . . 0.0 113.028 177.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 17.5 t-160 -67.76 -39.05 84.18 Favored 'General case' 0 CA--C 1.544 0.733 0 O-C-N 120.942 -1.099 . . . . 0.0 111.721 179.598 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 39.8 tp -67.62 -42.75 81.87 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 123.569 0.747 . . . . 0.0 111.882 172.017 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 54.2 t -59.99 -43.41 92.41 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 C-N-CA 123.361 0.665 . . . . 0.0 110.867 175.244 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -64.86 -42.42 94.87 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 123.624 0.77 . . . . 0.0 112.4 174.339 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.28 -42.33 98.46 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 119.443 1.02 . . . . 0.0 112.106 174.459 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 51.0 mt -61.91 -43.08 99.57 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.688 0.795 . . . . 0.0 111.489 174.408 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 13.6 m-85 -59.79 -44.09 94.1 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 119.885 1.221 . . . . 0.0 112.329 172.224 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 74.5 mt -66.67 -42.03 87.21 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.829 0.852 . . . . 0.0 112.437 179.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 60.1 t -76.24 -49.38 25.27 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 123.359 0.664 . . . . 0.0 111.977 179.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 48.5 t -79.13 -39.62 33.11 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 113.014 0.746 . . . . 0.0 113.014 -172.209 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 69.39 -142.03 36.51 Favored Glycine 0 CA--C 1.53 1.016 0 C-N-CA 124.326 0.965 . . . . 0.0 112.296 -179.348 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -64.26 -19.08 65.15 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 125.221 1.408 . . . . 0.0 113.637 -176.658 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 80.3 mtm180 -60.73 -32.87 72.12 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.899 1.28 . . . . 0.0 113.797 -178.368 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 80.52 142.79 3.16 Favored Glycine 0 CA--C 1.534 1.263 0 C-N-CA 125.212 1.387 . . . . 0.0 113.419 -178.491 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 50.8 p90 -129.11 158.43 38.98 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.653 1.581 . . . . 0.0 112.766 -175.518 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 81.7 t80 -83.41 140.75 32.19 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.862 0.865 . . . . 0.0 110.893 169.625 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 65.1 t80 -149.46 142.47 24.86 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.714 1.206 . . . . 0.0 111.723 173.52 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 3.5 m -162.42 131.4 3.05 Favored Pre-proline 0 N--CA 1.478 0.938 0 C-N-CA 127.65 2.38 . . . . 0.0 107.325 173.077 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -72.07 113.09 3.58 Favored 'Trans proline' 0 C--N 1.35 0.656 0 C-N-CA 122.712 2.275 . . . . 0.0 110.239 178.376 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 28.4 tptp . . . . . 0 N--CA 1.47 0.567 0 C-N-CA 123.765 0.826 . . . . 0.0 111.574 -179.539 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 9.5 tt . . . . . 0 N--CA 1.484 1.255 0 N-CA-C 111.623 0.231 . . . . 0.0 111.623 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 8.4 p -67.56 -21.92 28.03 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 124.256 1.022 . . . . 0.0 112.445 -174.515 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -64.1 -10.19 20.99 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 125.882 1.673 . . . . 0.0 113.173 171.625 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 11.6 tt0 -113.06 -50.98 2.85 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 126.137 1.775 . . . . 0.0 109.452 168.368 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 61.0 m -67.49 -22.46 65.46 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 115.404 1.631 . . . . 0.0 115.404 -171.249 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 37.2 t -102.58 -33.76 9.35 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 119.398 0.999 . . . . 0.0 113.0 177.436 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 44.5 p -72.35 -34.53 68.08 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 125.211 1.404 . . . . 0.0 111.969 178.694 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 9.1 t -134.05 -161.32 1.13 Allowed 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 126.453 1.901 . . . . 0.0 110.031 172.844 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 66.9 mt -101.86 116.61 45.8 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 C-N-CA 124.628 1.171 . . . . 0.0 108.148 171.223 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 21.7 p -89.58 152.69 21.27 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.294 0.637 . . . . 0.0 111.111 169.777 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 36.9 t -80.61 151.32 29.1 Favored 'General case' 0 N--CA 1.47 0.561 0 O-C-N 120.902 -1.124 . . . . 0.0 112.089 -176.449 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 80.0 mt -57.96 -32.78 68.16 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 121.402 -0.811 . . . . 0.0 111.217 170.268 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 83.4 t80 -64.35 -27.43 69.01 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.053 0.941 . . . . 0.0 113.071 173.654 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 80.2 mt-30 -80.79 -39.0 27.5 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 123.399 0.68 . . . . 0.0 110.551 173.445 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 58.6 mt -57.24 -42.31 81.23 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 119.275 0.943 . . . . 0.0 111.783 172.045 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -60.54 -17.51 46.33 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 114.74 1.385 . . . . 0.0 114.74 174.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 14.6 t-20 -70.04 -24.06 63.2 Favored 'General case' 0 CA--C 1.547 0.843 0 CA-C-N 119.878 1.217 . . . . 0.0 112.963 176.014 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 88.4 m-85 -94.01 -2.06 53.59 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.118 1.367 . . . . 0.0 113.805 -177.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 82.9 m -70.03 132.2 45.52 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.61 1.164 . . . . 0.0 112.112 177.445 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.253 1.261 0 C-N-CA 128.229 2.611 . . . . 0.0 112.313 -172.447 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 72.1 m-85 . . . . . 0 N--CA 1.486 1.366 0 CA-C-O 119.439 -0.315 . . . . 0.0 110.541 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 7.6 p -161.5 144.99 4.23 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 C-N-CA 124.576 1.15 . . . . 0.0 111.245 -178.726 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 53.1 t30 -85.82 -157.8 0.35 Allowed 'General case' 0 CA--C 1.557 1.224 0 C-N-CA 125.423 1.489 . . . . 0.0 111.029 174.483 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 45.8 mm-40 -135.31 173.08 12.11 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 126.083 1.753 . . . . 0.0 110.792 175.247 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 32.4 m-70 -69.0 133.43 48.13 Favored 'General case' 0 CA--C 1.544 0.72 0 O-C-N 121.647 -0.658 . . . . 0.0 109.988 169.469 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 87.2 mt -133.84 120.47 20.49 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 125.871 1.669 . . . . 0.0 109.843 -176.244 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -121.5 140.04 52.71 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 125.05 1.34 . . . . 0.0 111.988 -179.321 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 52.94 -126.46 33.03 Favored Glycine 0 CA--C 1.53 1.006 0 C-N-CA 124.79 1.186 . . . . 0.0 114.484 169.867 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 20.6 m -56.41 -29.59 61.75 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 124.533 1.133 . . . . 0.0 113.325 178.499 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 29.6 m80 -69.47 -40.68 76.95 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 120.877 -1.139 . . . . 0.0 111.335 176.541 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 49.5 tp -65.9 -43.14 89.1 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.307 1.043 . . . . 0.0 111.153 173.657 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 41.5 t -59.87 -46.24 94.06 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 124.469 1.108 . . . . 0.0 111.188 174.364 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -64.24 -44.0 93.18 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 123.502 0.721 . . . . 0.0 111.404 177.151 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.41 -44.12 92.91 Favored 'General case' 0 CA--C 1.539 0.521 0 O-C-N 121.557 -0.715 . . . . 0.0 111.253 175.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 18.1 mt -60.31 -45.34 93.72 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.899 0.879 . . . . 0.0 111.878 175.538 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -57.51 -44.75 85.27 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 119.439 1.018 . . . . 0.0 112.759 174.236 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 10.0 mp -69.69 -41.18 75.78 Favored 'General case' 0 N--CA 1.471 0.575 0 C-N-CA 123.432 0.693 . . . . 0.0 112.454 178.888 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 29.9 t -66.46 -43.53 90.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 124.388 1.075 . . . . 0.0 111.485 178.629 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 71.2 m -72.94 -45.37 58.45 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 118.795 0.725 . . . . 0.0 112.763 -178.586 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.4 -129.68 40.21 Favored Glycine 0 CA--C 1.533 1.198 0 C-N-CA 124.269 0.938 . . . . 0.0 112.0 179.308 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -59.84 -21.16 60.55 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 125.081 1.352 . . . . 0.0 113.557 -179.514 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 83.5 mtm180 -67.94 -16.37 64.03 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.548 1.139 . . . . 0.0 113.841 177.226 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.87 159.93 25.4 Favored Glycine 0 CA--C 1.53 1.006 0 C-N-CA 125.35 1.452 . . . . 0.0 113.35 -179.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 68.8 t80 -159.15 148.27 18.48 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.482 1.113 . . . . 0.0 112.346 178.114 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 90.2 t80 -174.82 114.8 0.16 Allowed 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 127.778 2.431 . . . . 0.0 109.624 168.318 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 35.5 t80 -167.84 143.28 3.84 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 126.004 1.722 . . . . 0.0 110.439 178.558 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 10.3 p -103.4 129.21 25.89 Favored Pre-proline 0 N--CA 1.475 0.817 0 C-N-CA 124.825 1.25 . . . . 0.0 112.15 -169.71 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -85.82 150.11 9.81 Favored 'Trans proline' 0 C--N 1.352 0.734 0 C-N-CA 123.762 2.974 . . . . 0.0 111.403 176.178 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 81.7 tttt . . . . . 0 CA--C 1.549 0.928 0 C-N-CA 124.833 1.253 . . . . 0.0 113.867 -179.914 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 15.1 tt . . . . . 0 N--CA 1.481 1.092 0 N-CA-C 115.537 1.68 . . . . 0.0 115.537 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 4.7 p -59.64 -34.01 53.79 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.248 0 CA-C-N 119.87 1.214 . . . . 0.0 112.562 176.585 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -69.61 -14.71 62.97 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 123.982 0.913 . . . . 0.0 112.648 178.625 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 27.6 tt0 -99.89 -55.69 2.57 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.816 0.846 . . . . 0.0 111.098 171.683 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 59.6 m -59.08 -27.77 65.85 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 114.578 1.325 . . . . 0.0 114.578 -171.78 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 68.2 m -70.44 -29.86 66.56 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 113.641 0.978 . . . . 0.0 113.641 -179.086 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 33.5 p -122.66 -37.57 2.75 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 125.003 1.321 . . . . 0.0 112.781 -170.124 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 50.8 m -100.46 163.99 12.12 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.319 1.447 . . . . 0.0 110.992 171.072 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 16.0 tt -81.46 132.07 32.39 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 O-C-N 121.542 -0.724 . . . . 0.0 109.534 174.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 13.9 p -128.2 165.92 19.52 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.6 1.16 . . . . 0.0 111.975 -176.764 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 38.1 t -116.03 151.39 35.6 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 -169.456 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 9.6 mp -58.26 -28.89 65.34 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 123.707 0.803 . . . . 0.0 111.742 169.817 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 87.7 t80 -60.36 -32.37 71.22 Favored 'General case' 0 CA--C 1.541 0.622 0 O-C-N 121.623 -0.673 . . . . 0.0 112.567 171.583 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 56.9 mt-30 -80.49 -35.24 35.01 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 123.953 0.901 . . . . 0.0 111.017 176.676 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 82.4 mt -59.27 -43.12 92.52 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-N 118.459 0.572 . . . . 0.0 111.189 171.294 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -68.5 -33.68 74.57 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 123.675 0.79 . . . . 0.0 112.972 172.779 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 22.7 t-20 -66.22 -33.19 75.2 Favored 'General case' 0 CA--C 1.546 0.801 0 O-C-N 120.606 -1.309 . . . . 0.0 112.356 176.287 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 19.2 m-85 -82.59 -1.46 50.9 Favored 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 125.513 1.525 . . . . 0.0 113.658 171.161 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 10.6 t -86.78 179.5 6.74 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 124.844 1.257 . . . . 0.0 112.17 170.02 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 . . . . . 0 C--O 1.253 1.244 0 C-N-CA 125.578 1.551 . . . . 0.0 113.235 179.776 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 34.0 t80 . . . . . 0 N--CA 1.49 1.557 0 CA-C-O 119.435 -0.317 . . . . 0.0 110.829 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 7.0 p -60.76 -23.96 30.75 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 C-N-CA 124.731 1.212 . . . . 0.0 114.054 -173.742 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 2.9 p30 -137.99 136.65 37.13 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.949 1.3 . . . . 0.0 109.646 167.718 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 5.0 tt0 -169.23 169.31 9.32 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.163 0.985 . . . . 0.0 111.246 -167.336 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 99.6 m-70 -85.12 142.77 29.28 Favored 'General case' 0 CA--C 1.543 0.703 0 O-C-N 121.381 -0.825 . . . . 0.0 108.782 165.5 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 86.0 mt -148.66 132.15 16.7 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 125.827 1.651 . . . . 0.0 109.65 -179.039 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.7 t -145.16 136.09 24.68 Favored 'General case' 0 N--CA 1.469 0.522 0 O-C-N 121.346 -0.846 . . . . 0.0 113.068 -178.348 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 58.56 -122.8 31.2 Favored Glycine 0 N--CA 1.469 0.862 0 C-N-CA 124.564 1.078 . . . . 0.0 112.962 174.795 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 25.8 p -54.36 -34.77 61.83 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.767 1.227 . . . . 0.0 113.281 176.8 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 35.1 m80 -68.49 -40.77 80.78 Favored 'General case' 0 CA--C 1.543 0.708 0 O-C-N 120.909 -1.12 . . . . 0.0 111.599 177.311 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 63.4 tp -67.92 -43.43 79.21 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 123.807 0.843 . . . . 0.0 110.999 175.06 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 44.9 t -59.49 -46.02 93.26 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 124.131 0.973 . . . . 0.0 110.647 174.625 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -63.37 -43.31 97.99 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.524 0.729 . . . . 0.0 111.65 176.179 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.65 -42.89 97.91 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 118.911 0.778 . . . . 0.0 112.192 174.679 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 49.0 mt -62.16 -39.54 92.98 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 118.718 0.69 . . . . 0.0 111.879 175.474 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 30.4 m-85 -67.58 -38.32 83.87 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 119.407 1.003 . . . . 0.0 113.104 172.665 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 75.4 mt -69.33 -44.28 71.99 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 119.295 0.952 . . . . 0.0 112.079 176.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 73.9 t -77.54 -41.05 29.02 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 C-N-CA 124.49 1.116 . . . . 0.0 112.171 -177.297 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -139.43 8.77 2.44 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 115.925 1.824 . . . . 0.0 115.925 -168.75 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -61.95 -31.04 77.1 Favored Glycine 0 N--CA 1.476 1.359 0 CA-C-N 120.135 1.334 . . . . 0.0 114.725 -171.654 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -78.48 -33.96 47.88 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 118.198 0.999 . . . . 0.0 112.623 176.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 81.2 mtm180 -72.71 -29.01 63.02 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 124.079 0.952 . . . . 0.0 111.806 170.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 83.19 109.03 0.5 Allowed Glycine 0 CA--C 1.529 0.911 0 C-N-CA 126.549 2.023 . . . . 0.0 111.196 -179.262 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 50.6 p90 -86.83 145.27 26.67 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.44 0.696 . . . . 0.0 112.209 175.526 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -82.74 -28.57 30.33 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.205 1.002 . . . . 0.0 112.643 -177.176 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 49.6 t80 -66.04 151.63 46.42 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 114.822 1.416 . . . . 0.0 114.822 -171.49 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 49.0 m -138.45 122.48 11.5 Favored Pre-proline 0 CA--C 1.539 0.531 0 C-N-CA 125.957 1.703 . . . . 0.0 107.687 169.029 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 78.3 Cg_exo -56.58 156.92 20.49 Favored 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 123.729 2.953 . . . . 0.0 113.778 177.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 58.3 tptt . . . . . 0 CA--C 1.549 0.92 0 N-CA-C 113.032 0.753 . . . . 0.0 113.032 173.211 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 12.3 tt . . . . . 0 N--CA 1.482 1.132 0 N-CA-C 114.056 1.132 . . . . 0.0 114.056 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 9.3 p -63.83 -35.62 73.82 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.265 0 CA-C-N 120.458 1.481 . . . . 0.0 112.566 -177.847 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -72.04 -8.9 57.2 Favored 'General case' 0 CA--C 1.547 0.835 0 N-CA-C 113.471 0.915 . . . . 0.0 113.471 176.262 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 21.7 tt0 -93.73 -58.51 2.24 Favored 'General case' 0 N--CA 1.464 0.246 0 C-N-CA 124.788 1.235 . . . . 0.0 109.083 168.607 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 71.4 m -72.33 -22.3 61.2 Favored 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 114.555 1.317 . . . . 0.0 114.555 -169.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 4.7 t -77.51 -18.25 57.21 Favored 'General case' 0 N--CA 1.473 0.72 0 O-C-N 121.453 -0.779 . . . . 0.0 112.471 171.853 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 31.7 m -103.78 -42.56 5.58 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 126.663 1.985 . . . . 0.0 111.463 -173.216 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 67.3 m -124.54 168.7 12.75 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 126.795 2.038 . . . . 0.0 111.856 -179.478 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 31.8 mm -66.54 133.73 30.87 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 O-C-N 120.749 -1.219 . . . . 0.0 109.638 171.224 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.7 m -116.32 158.78 22.88 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 122.645 1.212 . . . . 0.0 113.534 175.614 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 20.9 t -122.43 162.29 21.94 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 126.443 1.897 . . . . 0.0 112.443 -176.244 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.4 mp -64.12 -32.96 74.71 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 124.707 1.203 . . . . 0.0 111.923 -176.414 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 82.3 t80 -61.67 -30.79 70.96 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 123.701 0.8 . . . . 0.0 112.773 175.828 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 -78.21 -33.92 49.69 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.817 0.847 . . . . 0.0 110.667 176.766 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 90.2 mt -66.49 -46.49 76.11 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 118.644 0.656 . . . . 0.0 111.678 171.47 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 -64.11 -20.87 66.27 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 113.803 1.038 . . . . 0.0 113.803 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.7 t30 -57.01 -28.26 62.31 Favored 'General case' 0 CA--C 1.548 0.878 0 CA-C-N 119.356 0.98 . . . . 0.0 112.978 172.676 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 98.0 m-85 -98.61 -2.78 37.69 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.395 1.478 . . . . 0.0 113.487 178.547 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 12.3 t -84.65 -149.56 0.11 Allowed 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 125.989 1.716 . . . . 0.0 111.025 173.71 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 41.1 m-80 . . . . . 0 C--O 1.255 1.364 0 C-N-CA 127.045 2.138 . . . . 0.0 112.177 176.758 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 50.9 t80 . . . . . 0 N--CA 1.484 1.262 0 CA-C-O 119.627 -0.225 . . . . 0.0 111.019 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 7.1 p -70.18 -38.21 74.02 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.3 0 C-N-CA 124.023 0.929 . . . . 0.0 113.37 -173.541 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -74.23 111.68 9.64 Favored 'General case' 0 CA--C 1.544 0.718 0 N-CA-C 108.218 -1.03 . . . . 0.0 108.218 169.186 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 -170.64 172.34 5.89 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 123.932 0.893 . . . . 0.0 110.965 -165.219 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 95.1 m-70 -68.29 138.83 55.81 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 107.261 -1.385 . . . . 0.0 107.261 163.277 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 92.7 mt -138.2 126.39 22.95 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 125.177 1.391 . . . . 0.0 109.204 -178.334 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 6.3 t -146.42 145.11 30.13 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 123.312 0.645 . . . . 0.0 111.665 -174.651 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 51.92 -128.13 32.97 Favored Glycine 0 N--CA 1.472 1.091 0 C-N-CA 124.457 1.027 . . . . 0.0 112.75 175.822 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 36.2 m -58.73 -31.42 68.27 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 113.275 0.843 . . . . 0.0 113.275 179.277 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -72.05 -36.82 69.71 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 119.16 0.891 . . . . 0.0 111.641 176.571 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 57.5 tp -65.95 -47.29 75.14 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 118.591 0.632 . . . . 0.0 110.74 171.336 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 54.1 t -60.99 -43.76 96.76 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 C-N-CA 123.525 0.73 . . . . 0.0 110.618 -179.724 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -64.4 -46.25 84.11 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.602 0.761 . . . . 0.0 112.056 175.153 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.4 -42.3 99.32 Favored 'General case' 0 CA--C 1.539 0.548 0 O-C-N 121.408 -0.808 . . . . 0.0 111.857 177.5 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 46.0 tp -63.5 -41.22 98.55 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.652 1.181 . . . . 0.0 111.252 177.238 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 7.2 m-85 -60.41 -45.9 91.95 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 119.253 0.933 . . . . 0.0 112.435 169.831 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 72.2 mt -65.94 -43.5 87.86 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 123.305 0.642 . . . . 0.0 112.377 -179.378 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 53.2 t -76.97 -37.77 27.29 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 123.877 0.871 . . . . 0.0 112.327 -177.723 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 44.1 t -77.2 -41.82 39.92 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 118.779 0.718 . . . . 0.0 112.569 177.72 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 73.07 -148.21 40.8 Favored Glycine 0 CA--C 1.529 0.951 0 C-N-CA 124.646 1.117 . . . . 0.0 112.744 179.587 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -62.49 -19.98 64.13 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.257 1.423 . . . . 0.0 113.733 -177.522 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 86.9 mtm180 -57.32 -35.1 69.44 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 125.237 1.415 . . . . 0.0 114.043 179.153 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.07 144.9 2.42 Favored Glycine 0 CA--C 1.532 1.123 0 C-N-CA 125.272 1.415 . . . . 0.0 113.4 -178.148 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 48.0 p90 -113.23 151.2 31.34 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.186 1.395 . . . . 0.0 112.007 177.886 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 37.9 p90 -93.43 -10.09 36.32 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 114.34 1.237 . . . . 0.0 114.34 -178.646 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 74.7 t80 -70.2 148.25 48.84 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.934 1.294 . . . . 0.0 114.283 -177.761 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 85.7 m -127.47 131.2 23.71 Favored Pre-proline 0 N--CA 1.478 0.938 0 C-N-CA 126.389 1.876 . . . . 0.0 107.862 170.231 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -67.2 133.04 29.4 Favored 'Trans proline' 0 C--N 1.351 0.677 0 C-N-CA 122.888 2.392 . . . . 0.0 112.337 -173.14 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 84.0 tttt . . . . . 0 CA--C 1.546 0.816 0 C-N-CA 124.163 0.985 . . . . 0.0 112.971 177.875 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 8.7 tp . . . . . 0 N--CA 1.483 1.202 0 N-CA-C 114.114 1.153 . . . . 0.0 114.114 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 5.7 p -62.58 -29.67 47.44 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 C-N-CA 123.556 0.742 . . . . 0.0 112.89 -179.522 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -76.86 -8.24 56.97 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 119.566 1.075 . . . . 0.0 112.855 179.188 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 79.7 mm-40 -97.19 -59.95 1.68 Allowed 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.985 0.914 . . . . 0.0 108.869 169.039 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 94.5 m -69.09 -29.03 67.04 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 114.923 1.453 . . . . 0.0 114.923 -170.538 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 7.9 t -80.65 -43.26 20.73 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 119.392 0.996 . . . . 0.0 111.03 176.847 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 23.2 m -68.97 -38.14 79.19 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 127.011 2.124 . . . . 0.0 112.917 -175.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.4 t -146.79 -172.04 3.89 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.949 1.299 . . . . 0.0 111.146 179.459 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 50.1 mt -76.64 124.0 34.11 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 O-C-N 120.893 -1.129 . . . . 0.0 109.0 170.72 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 23.8 p -103.25 157.76 16.79 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.062 0.945 . . . . 0.0 111.453 170.635 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 34.4 t -92.8 156.21 17.14 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.57 0.748 . . . . 0.0 111.847 179.687 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 59.2 mt -58.4 -29.36 66.01 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 123.398 0.679 . . . . 0.0 111.719 172.684 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.3 t80 -62.84 -33.04 74.41 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 113.16 0.8 . . . . 0.0 113.16 172.289 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 60.6 mm-40 -77.02 -34.55 57.33 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 123.281 0.633 . . . . 0.0 110.721 175.919 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 95.6 mt -65.1 -44.37 89.05 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 118.552 0.614 . . . . 0.0 111.186 171.772 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.427 ' HA ' ' SG ' ' A' ' 20' ' ' CYS . 24.6 mt-10 -63.85 -25.5 68.19 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 113.907 1.077 . . . . 0.0 113.907 175.929 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 -63.05 -21.25 66.04 Favored 'General case' 0 CA--C 1.547 0.832 0 CA-C-N 119.14 0.882 . . . . 0.0 112.87 175.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 73.7 m-85 -102.01 -0.21 34.02 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.161 1.384 . . . . 0.0 114.389 177.024 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.427 ' SG ' ' HA ' ' A' ' 17' ' ' GLU . 67.4 m -65.31 144.75 56.93 Favored 'General case' 0 CA--C 1.544 0.746 0 CA-C-N 119.373 0.988 . . . . 0.0 110.473 169.132 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 21.4 t-20 . . . . . 0 C--O 1.255 1.347 0 C-N-CA 124.867 1.267 . . . . 0.0 113.105 -175.643 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 68.5 t80 . . . . . 0 N--CA 1.484 1.23 0 CA-C-O 119.931 -0.081 . . . . 0.0 110.898 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 16.9 m -67.66 148.82 11.78 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.025 0 C-N-CA 124.181 0.993 . . . . 0.0 112.566 -178.422 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 42.9 54.9 4.6 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 126.123 1.769 . . . . 0.0 114.483 174.696 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 3.1 mm-40 -145.54 -177.21 5.45 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.963 1.705 . . . . 0.0 110.832 -175.258 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 27.6 m-70 -64.48 131.21 46.47 Favored 'General case' 0 CA--C 1.546 0.809 0 O-C-N 121.312 -0.868 . . . . 0.0 109.836 168.238 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 78.4 mt -141.77 127.02 18.6 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 126.2 1.8 . . . . 0.0 109.07 -177.79 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.7 t -145.14 143.43 30.35 Favored 'General case' 0 N--CA 1.472 0.653 0 O-C-N 121.357 -0.839 . . . . 0.0 112.327 -175.322 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 56.68 -127.43 44.24 Favored Glycine 0 CA--C 1.531 1.081 0 C-N-CA 124.165 0.888 . . . . 0.0 113.252 175.293 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 31.6 p -56.82 -33.7 67.0 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.731 1.213 . . . . 0.0 113.706 177.277 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 19.1 t-160 -70.89 -37.32 73.01 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 121.119 -0.988 . . . . 0.0 111.576 176.377 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 43.1 tp -69.97 -41.68 74.14 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 123.78 0.832 . . . . 0.0 111.747 172.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 37.8 t -58.16 -46.14 88.52 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 C-N-CA 124.152 0.981 . . . . 0.0 110.472 172.812 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -64.48 -42.61 95.79 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.829 0.852 . . . . 0.0 112.219 176.517 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.35 -40.69 95.2 Favored 'General case' 0 CA--C 1.538 0.516 0 O-C-N 121.347 -0.846 . . . . 0.0 112.14 174.477 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 47.8 mt -65.16 -39.06 92.43 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.522 -0.736 . . . . 0.0 112.047 174.896 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 15.7 m-85 -59.56 -44.3 93.33 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 119.568 1.076 . . . . 0.0 112.037 170.052 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 80.8 mt -68.9 -43.2 75.73 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.95 0.9 . . . . 0.0 112.62 179.615 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 42.2 t -72.29 -48.23 49.38 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 124.204 1.002 . . . . 0.0 111.821 -179.048 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 84.6 m -77.54 -34.39 53.91 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 121.432 -0.793 . . . . 0.0 113.0 -177.344 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 65.02 -132.26 36.57 Favored Glycine 0 CA--C 1.527 0.821 0 C-N-CA 124.06 0.838 . . . . 0.0 111.748 179.079 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -63.12 -20.16 65.11 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 124.533 1.133 . . . . 0.0 113.257 178.874 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 85.3 mtm180 -63.83 -35.32 80.23 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.795 0.838 . . . . 0.0 113.022 179.127 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.53 179.14 34.37 Favored Glycine 0 CA--C 1.537 1.452 0 C-N-CA 124.488 1.042 . . . . 0.0 112.9 -169.868 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 46.6 p90 -158.29 169.47 24.41 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 125.416 1.486 . . . . 0.0 113.658 -172.572 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 69.6 t80 -121.85 112.95 18.97 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.302 1.441 . . . . 0.0 110.252 173.093 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 45.7 t80 -74.93 138.22 42.21 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 123.552 0.741 . . . . 0.0 111.739 177.814 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 23.2 p -128.09 108.03 19.87 Favored Pre-proline 0 N--CA 1.478 0.957 0 C-N-CA 124.375 1.07 . . . . 0.0 111.825 179.507 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 31.0 Cg_exo -66.85 171.06 11.6 Favored 'Trans proline' 0 CA--C 1.538 0.681 0 C-N-CA 124.237 3.291 . . . . 0.0 112.072 168.853 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 60.4 tttp . . . . . 0 CA--C 1.546 0.81 0 N-CA-C 112.847 0.684 . . . . 0.0 112.847 169.635 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 10.8 tp . . . . . 0 N--CA 1.483 1.214 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 58.2 t -68.64 -23.89 28.41 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 C-N-CA 123.71 0.804 . . . . 0.0 112.241 179.064 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -80.74 -46.47 15.42 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.639 -0.663 . . . . 0.0 110.063 168.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 13.2 tp60 -68.31 -46.69 69.57 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.191 0.996 . . . . 0.0 112.853 -169.509 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 61.5 m -72.15 -21.13 61.5 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 113.12 0.785 . . . . 0.0 113.12 176.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 10.8 t -88.11 -48.62 7.6 Favored 'General case' 0 N--CA 1.467 0.395 0 O-C-N 121.407 -0.808 . . . . 0.0 111.632 -176.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 68.2 p -75.75 -22.44 56.5 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 125.03 1.332 . . . . 0.0 113.558 -178.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.3 t -150.24 -175.28 5.01 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.652 1.181 . . . . 0.0 111.743 178.19 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 62.4 mt -76.79 134.53 28.6 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 C-N-CA 124.551 1.141 . . . . 0.0 110.019 176.248 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.9 p -126.31 160.63 29.82 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.964 1.306 . . . . 0.0 110.973 170.271 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 90.3 p -110.82 165.36 11.91 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.44 1.096 . . . . 0.0 112.714 -179.103 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 10.2 mp -58.29 -28.34 64.91 Favored 'General case' 0 N--CA 1.473 0.681 0 O-C-N 121.609 -0.682 . . . . 0.0 112.515 173.602 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 78.3 t80 -64.31 -33.92 76.95 Favored 'General case' 0 CA--C 1.542 0.666 0 O-C-N 121.59 -0.694 . . . . 0.0 112.857 172.521 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 65.7 mm-40 -75.66 -24.24 56.36 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.623 0.769 . . . . 0.0 111.984 173.209 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 81.2 mt -75.93 -47.24 26.02 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 119.238 0.926 . . . . 0.0 111.447 172.268 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -65.29 -20.42 66.4 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 113.192 0.812 . . . . 0.0 113.192 177.146 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.5 t30 -54.79 -30.29 56.52 Favored 'General case' 0 CA--C 1.549 0.92 0 CA-C-N 119.144 0.884 . . . . 0.0 113.235 171.732 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 98.2 m-85 -98.18 -2.06 40.72 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.583 1.553 . . . . 0.0 113.646 178.567 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 11.3 t -78.31 169.5 18.16 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.465 1.506 . . . . 0.0 111.533 171.192 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 9.9 m-80 . . . . . 0 C--O 1.252 1.233 0 C-N-CA 124.857 1.263 . . . . 0.0 112.409 173.943 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 67.6 t80 . . . . . 0 N--CA 1.486 1.347 0 CA-C-O 119.681 -0.2 . . . . 0.0 110.697 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 13.0 m -80.71 68.56 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 C-N-CA 125.042 1.337 . . . . 0.0 111.144 177.149 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 39.7 p-10 -156.2 147.9 22.86 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.47 1.508 . . . . 0.0 113.426 -174.49 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 1.6 mm-40 -176.44 177.26 1.49 Allowed 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 126.982 2.113 . . . . 0.0 110.569 -177.551 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 27.0 m-70 -77.44 141.45 39.72 Favored 'General case' 0 CA--C 1.548 0.885 0 O-C-N 120.948 -1.095 . . . . 0.0 109.603 166.458 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 69.8 mt -144.12 135.56 25.77 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 126.521 1.928 . . . . 0.0 109.119 174.141 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 5.5 t -149.33 142.7 25.23 Favored 'General case' 0 N--CA 1.473 0.676 0 O-C-N 121.138 -0.976 . . . . 0.0 112.944 -177.464 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 62.57 -131.1 43.87 Favored Glycine 0 CA--C 1.529 0.941 0 C-N-CA 124.613 1.102 . . . . 0.0 113.321 175.46 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 26.1 p -56.02 -35.26 66.66 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 124.734 1.214 . . . . 0.0 113.026 177.6 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 23.6 m80 -64.48 -42.15 96.06 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.193 0.997 . . . . 0.0 111.613 176.541 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 48.0 tp -70.41 -42.51 71.56 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 123.928 0.891 . . . . 0.0 111.68 176.583 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 55.9 t -60.37 -44.28 95.68 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 123.293 0.637 . . . . 0.0 110.694 174.829 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -64.45 -43.09 95.35 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.819 0.848 . . . . 0.0 111.999 175.343 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.37 -44.01 96.02 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 118.609 0.64 . . . . 0.0 111.684 174.449 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 31.8 mt -59.9 -43.67 94.68 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 118.87 0.759 . . . . 0.0 111.345 175.606 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 20.8 m-85 -60.59 -44.87 95.76 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 119.131 0.878 . . . . 0.0 112.624 173.546 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 81.3 mt -69.36 -43.92 72.62 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 123.694 0.797 . . . . 0.0 112.493 -179.502 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 69.6 t -78.03 -40.92 26.9 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 124.766 1.226 . . . . 0.0 111.796 -174.074 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 48.7 t -78.19 -41.43 34.58 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 118.781 0.718 . . . . 0.0 112.282 176.459 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 72.25 -146.83 39.96 Favored Glycine 0 CA--C 1.531 1.064 0 C-N-CA 124.325 0.964 . . . . 0.0 112.741 178.524 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -60.79 -21.1 62.75 Favored 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 125.465 1.506 . . . . 0.0 113.561 -176.663 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 89.1 mtm180 -56.8 -36.12 69.53 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.968 1.307 . . . . 0.0 113.029 175.889 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 80.07 140.71 2.41 Favored Glycine 0 CA--C 1.534 1.273 0 C-N-CA 125.352 1.453 . . . . 0.0 112.935 -178.482 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 38.7 p90 -119.04 162.91 17.78 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.819 1.248 . . . . 0.0 112.258 179.857 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 4.1 t80 -145.31 85.1 1.71 Allowed 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.891 1.276 . . . . 0.0 109.452 175.373 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -78.4 169.4 18.31 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 115.614 1.709 . . . . 0.0 115.614 -173.089 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 87.7 m -106.31 100.92 32.18 Favored Pre-proline 0 N--CA 1.476 0.857 0 C-N-CA 125.572 1.549 . . . . 0.0 109.53 173.824 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -92.55 143.55 2.44 Favored 'Trans proline' 0 C--N 1.35 0.647 0 C-N-CA 123.406 2.738 . . . . 0.0 113.162 -177.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt . . . . . 0 N--CA 1.478 0.948 0 C-N-CA 128.801 2.84 . . . . 0.0 115.761 168.607 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 11.2 tp . . . . . 0 N--CA 1.482 1.174 0 N-CA-C 114.25 1.204 . . . . 0.0 114.25 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 47.9 t -62.24 -35.66 70.31 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.134 0 CA-C-N 118.624 0.647 . . . . 0.0 111.334 176.267 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -76.67 -7.66 55.73 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.463 1.105 . . . . 0.0 112.91 -179.454 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 35.9 tp60 -103.01 -57.52 2.03 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.935 1.294 . . . . 0.0 109.861 173.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 83.4 m -74.34 -25.55 59.61 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 115.16 1.541 . . . . 0.0 115.16 -169.522 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 72.3 m -77.24 -23.31 51.32 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 119.373 0.988 . . . . 0.0 113.019 -179.692 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 18.0 p -114.09 -48.13 2.91 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 125.966 1.707 . . . . 0.0 111.747 -171.315 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 73.2 m -96.67 169.91 9.56 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.505 1.522 . . . . 0.0 111.437 172.087 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 61.8 mt -77.69 130.1 36.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 O-C-N 120.939 -1.101 . . . . 0.0 109.034 172.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.3 m -97.56 155.81 16.79 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 122.343 1.068 . . . . 0.0 112.756 173.223 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 90.5 p -118.33 162.76 17.76 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 126.665 1.986 . . . . 0.0 110.996 177.504 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 58.3 mt -62.55 -28.13 69.65 Favored 'General case' 0 CA--C 1.536 0.437 0 O-C-N 121.884 -0.51 . . . . 0.0 111.797 175.484 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 89.4 t80 -65.01 -38.87 92.34 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 123.795 0.838 . . . . 0.0 112.766 172.204 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -72.74 -28.37 62.59 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 123.074 0.55 . . . . 0.0 112.011 175.631 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 86.3 mt -72.39 -44.63 62.22 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-N 118.531 0.605 . . . . 0.0 111.971 169.89 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.0 mm-40 -55.38 -38.4 68.82 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.041 1.336 . . . . 0.0 112.569 172.394 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 -60.09 -22.55 62.9 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 113.554 0.946 . . . . 0.0 113.554 177.351 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 18.7 m-85 -103.39 1.69 32.93 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.672 1.589 . . . . 0.0 114.288 175.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 86.4 m -71.97 154.22 41.32 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 120.566 -1.334 . . . . 0.0 111.765 169.07 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 21.4 t-20 . . . . . 0 C--O 1.254 1.313 0 C-N-CA 124.496 1.118 . . . . 0.0 112.933 176.98 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . 0.251 23.4 p90 . . . . . 0 N--CA 1.488 1.448 0 CA-C-O 118.249 -0.881 . . . . 0.0 111.209 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 18.6 m -69.7 161.62 4.33 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.281 0 CA-C-N 120.569 1.532 . . . . 0.0 111.98 170.66 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 8.5 p-10 -55.46 135.85 50.2 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.735 1.214 . . . . 0.0 112.401 171.837 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -166.73 163.23 16.57 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 124.991 1.316 . . . . 0.0 110.979 -169.344 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 98.4 m-70 -69.77 136.47 50.92 Favored 'General case' 0 CA--C 1.545 0.778 0 O-C-N 121.224 -0.922 . . . . 0.0 110.385 168.663 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 72.4 mt -140.67 131.45 25.8 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 124.808 1.243 . . . . 0.0 109.518 -177.472 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.6 t -145.6 147.18 31.78 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -176.71 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 56.1 -123.52 31.33 Favored Glycine 0 CA--C 1.528 0.873 0 C-N-CA 124.742 1.163 . . . . 0.0 113.174 172.441 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 23.8 p -55.85 -41.38 74.24 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.299 1.04 . . . . 0.0 112.986 176.263 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 14.7 m-70 -70.28 -32.21 69.91 Favored 'General case' 0 CA--C 1.541 0.63 0 O-C-N 120.682 -1.261 . . . . 0.0 112.575 178.619 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 46.5 tp -68.14 -41.18 82.04 Favored 'General case' 0 N--CA 1.471 0.59 0 O-C-N 121.581 -0.699 . . . . 0.0 111.003 171.221 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 25.5 t -61.57 -45.74 98.01 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 C-N-CA 124.23 1.012 . . . . 0.0 110.774 173.321 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -59.59 -46.29 89.37 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 123.97 0.908 . . . . 0.0 111.652 174.299 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.89 -41.32 99.38 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 121.505 -0.747 . . . . 0.0 112.215 178.372 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 73.6 mt -64.18 -41.25 97.18 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 118.768 -0.634 . . . . 0.0 111.521 174.542 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 -59.31 -44.55 92.55 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-N 119.798 1.181 . . . . 0.0 112.286 171.0 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 67.8 mt -67.16 -42.28 84.59 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.172 0.989 . . . . 0.0 112.965 -179.636 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 53.8 t -74.93 -49.39 29.03 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 123.419 0.688 . . . . 0.0 111.659 178.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 58.1 m -78.03 -33.46 51.06 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 113.267 0.84 . . . . 0.0 113.267 -172.352 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 64.8 -135.33 38.02 Favored Glycine 0 CA--C 1.53 1.006 0 C-N-CA 124.024 0.821 . . . . 0.0 112.125 179.095 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -62.05 -23.21 66.34 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 124.539 1.136 . . . . 0.0 113.554 -178.423 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 88.2 mtm180 -59.79 -38.29 81.48 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.087 0.955 . . . . 0.0 112.876 176.893 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 76.78 178.22 46.12 Favored Glycine 0 CA--C 1.533 1.215 0 C-N-CA 124.12 0.867 . . . . 0.0 112.117 -168.606 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 54.4 p90 -141.41 157.46 45.15 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 113.898 1.073 . . . . 0.0 113.898 -171.612 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -96.42 158.36 15.47 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 126.304 1.841 . . . . 0.0 108.943 167.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 26.2 t80 -148.1 143.77 27.38 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 121.403 -0.811 . . . . 0.0 111.906 -173.861 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 18.6 m -141.33 115.54 7.0 Favored Pre-proline 0 N--CA 1.475 0.82 0 C-N-CA 124.725 1.21 . . . . 0.0 109.676 179.592 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -83.55 166.06 13.88 Favored 'Trans proline' 0 CA--C 1.538 0.701 0 C-N-CA 124.316 3.344 . . . . 0.0 111.97 179.496 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 40.6 ttpt . . . . . 0 CA--C 1.545 0.78 0 C-N-CA 123.692 0.797 . . . . 0.0 112.667 170.628 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 8.3 tt . . . . . 0 N--CA 1.482 1.141 0 N-CA-C 113.63 0.974 . . . . 0.0 113.63 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 55.6 t -62.52 -30.51 49.33 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 CA-C-N 119.069 0.85 . . . . 0.0 111.176 178.862 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -69.5 -36.89 76.9 Favored 'General case' 0 CA--C 1.541 0.608 0 O-C-N 120.813 -1.18 . . . . 0.0 111.009 174.94 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 19.8 tp60 -77.73 -36.47 50.85 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.757 0.823 . . . . 0.0 112.219 -179.754 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 56.2 m -97.47 -27.26 14.52 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 115.069 1.507 . . . . 0.0 115.069 -175.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 22.8 t -102.01 -58.0 1.96 Allowed 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 120.006 1.275 . . . . 0.0 111.964 -176.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 15.5 m -65.8 -55.62 16.21 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 124.413 1.085 . . . . 0.0 109.498 177.32 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 74.8 m -89.89 176.0 6.99 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 124.112 0.965 . . . . 0.0 111.035 167.329 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 11.3 tt -92.65 147.09 5.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 124.033 0.933 . . . . 0.0 110.466 171.453 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.6 p -130.3 154.73 47.32 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 114.034 1.124 . . . . 0.0 114.034 176.643 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 47.0 t -92.95 153.94 18.47 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.698 1.599 . . . . 0.0 112.824 178.59 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 10.8 mp -59.36 -28.49 66.91 Favored 'General case' 0 N--CA 1.47 0.548 0 O-C-N 121.321 -0.862 . . . . 0.0 111.824 172.214 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.8 t80 -60.85 -36.22 78.57 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 121.466 -0.772 . . . . 0.0 112.529 170.647 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -76.22 -37.5 57.66 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 123.809 0.844 . . . . 0.0 110.392 177.637 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 93.7 mt -59.48 -43.13 93.35 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 123.288 0.635 . . . . 0.0 111.539 172.708 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -67.64 -33.05 74.19 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 113.412 0.894 . . . . 0.0 113.412 172.578 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 -70.59 -27.48 64.14 Favored 'General case' 0 CA--C 1.544 0.749 0 CA-C-N 119.652 1.115 . . . . 0.0 113.504 177.04 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 17.2 m-85 -79.0 -5.38 53.77 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 124.069 0.948 . . . . 0.0 113.482 169.351 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 2.8 t -82.04 168.35 17.89 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.785 1.234 . . . . 0.0 112.367 171.065 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.251 1.177 0 C-N-CA 125.34 1.456 . . . . 0.0 113.0 -174.303 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 65.6 m-85 . . . . . 0 N--CA 1.487 1.416 0 CA-C-O 119.642 -0.218 . . . . 0.0 110.525 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 26.8 t -84.97 115.76 27.37 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 N-CA-C 106.742 -1.577 . . . . 0.0 106.742 168.689 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -154.89 146.25 22.98 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.352 1.061 . . . . 0.0 112.92 -169.554 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 29.3 tt0 -158.62 160.36 36.45 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.13 0.972 . . . . 0.0 111.144 -169.831 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 70.7 m-70 -86.56 128.74 35.0 Favored 'General case' 0 CA--C 1.545 0.762 0 O-C-N 121.509 -0.745 . . . . 0.0 110.578 168.89 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 66.3 mt -143.03 133.91 25.44 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 126.604 1.962 . . . . 0.0 109.582 -173.224 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -137.76 140.08 40.44 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 123.89 0.876 . . . . 0.0 112.24 -172.074 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 52.94 -123.35 24.07 Favored Glycine 0 N--CA 1.474 1.171 0 C-N-CA 124.387 0.994 . . . . 0.0 114.39 169.536 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 25.2 p -58.64 -36.38 74.01 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.174 0.989 . . . . 0.0 113.119 177.109 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 93.3 m-70 -66.87 -36.83 83.2 Favored 'General case' 0 CA--C 1.54 0.559 0 O-C-N 120.739 -1.225 . . . . 0.0 111.791 175.001 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 40.2 tp -67.97 -41.75 81.9 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 123.721 0.808 . . . . 0.0 111.753 173.506 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 50.9 t -59.44 -47.67 89.88 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.137 0 C-N-CA 124.329 1.051 . . . . 0.0 111.038 172.808 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -63.57 -40.45 97.0 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 123.116 0.567 . . . . 0.0 112.042 176.336 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.1 -42.65 99.64 Favored 'General case' 0 CA--C 1.534 0.342 0 O-C-N 121.273 -0.892 . . . . 0.0 112.292 174.807 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 49.2 mt -58.94 -43.1 91.15 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 118.887 0.767 . . . . 0.0 111.566 174.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 23.7 m-85 -61.19 -47.29 86.81 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 118.479 0.581 . . . . 0.0 112.319 172.641 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 72.3 mt -68.85 -42.29 77.3 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.587 0.755 . . . . 0.0 112.807 -177.713 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 74.0 t -79.17 -41.79 23.21 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 C-N-CA 124.403 1.081 . . . . 0.0 111.821 -173.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 21.7 t -85.8 -33.2 21.43 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 113.809 1.04 . . . . 0.0 113.809 178.607 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 83.84 -153.78 30.08 Favored Glycine 0 CA--C 1.53 1.023 0 C-N-CA 124.468 1.032 . . . . 0.0 112.464 -174.768 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -68.56 -7.34 31.76 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 115.296 1.591 . . . . 0.0 115.296 -172.815 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 85.0 mtm180 -58.96 -36.58 75.05 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 124.906 1.282 . . . . 0.0 113.29 -178.579 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 86.48 147.16 10.5 Favored Glycine 0 CA--C 1.534 1.273 0 C-N-CA 125.2 1.381 . . . . 0.0 113.748 175.085 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 54.0 p90 -138.72 175.2 9.76 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.96 1.704 . . . . 0.0 112.594 -170.714 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -136.65 109.71 7.72 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.12 1.368 . . . . 0.0 109.236 169.46 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -88.68 149.72 23.36 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 113.215 0.82 . . . . 0.0 113.215 -179.292 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 19.0 p -120.39 73.25 21.15 Favored Pre-proline 0 N--CA 1.475 0.79 0 C-N-CA 125.868 1.667 . . . . 0.0 112.543 -172.356 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_endo -72.12 144.84 43.03 Favored 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 123.338 2.692 . . . . 0.0 110.789 169.48 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 70.3 tttt . . . . . 0 CA--C 1.551 1.01 0 C-N-CA 124.046 0.938 . . . . 0.0 113.517 -175.883 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 16.6 tt . . . . . 0 N--CA 1.48 1.045 0 N-CA-C 113.954 1.094 . . . . 0.0 113.954 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 23.5 t -61.08 -39.97 84.13 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.062 0 CA-C-N 118.924 0.784 . . . . 0.0 110.408 -177.962 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -64.7 -16.62 63.15 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 126.07 1.748 . . . . 0.0 113.138 176.551 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 40.2 tt0 -90.68 -59.58 2.14 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 123.535 0.734 . . . . 0.0 109.247 168.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 76.0 m -55.91 -35.39 66.52 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 114.612 1.338 . . . . 0.0 114.612 -171.379 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 74.1 m -81.29 -20.8 40.07 Favored 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 113.885 1.068 . . . . 0.0 113.885 -178.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 38.3 m -114.83 -36.9 4.34 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 124.886 1.275 . . . . 0.0 112.534 -168.406 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 7.6 t -125.61 -164.91 1.35 Allowed 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 126.207 1.803 . . . . 0.0 109.911 171.343 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 13.9 tt -86.36 145.9 7.12 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.676 0 C-N-CA 124.387 1.075 . . . . 0.0 110.79 174.528 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 13.7 p -137.08 156.1 48.82 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.144 0.978 . . . . 0.0 112.334 174.389 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 14.5 m -107.24 149.21 28.0 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 113.953 1.094 . . . . 0.0 113.953 -167.749 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 27.4 mt -61.45 -29.93 70.26 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 121.272 -0.892 . . . . 0.0 111.696 174.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 91.7 t80 -59.95 -30.87 69.37 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.304 1.441 . . . . 0.0 113.05 170.693 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 59.1 mt-30 -80.88 -36.26 31.54 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 123.617 0.767 . . . . 0.0 110.921 174.731 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 59.7 mt -62.69 -40.54 97.46 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 118.656 0.662 . . . . 0.0 112.354 173.478 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 26.8 mt-10 -60.29 -20.38 58.86 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 114.814 1.413 . . . . 0.0 114.814 175.204 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 26.6 t30 -59.69 -27.39 66.38 Favored 'General case' 0 CA--C 1.546 0.813 0 CA-C-N 119.579 1.081 . . . . 0.0 112.723 174.343 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 76.9 m-85 -100.8 -0.06 37.78 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.331 1.452 . . . . 0.0 114.293 -174.495 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 65.8 m -75.18 126.59 31.33 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.431 0.692 . . . . 0.0 111.822 176.503 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.252 1.228 0 C-N-CA 129.169 2.988 . . . . 0.0 112.154 -171.925 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 5.9 p90 . . . . . 0 N--CA 1.483 1.221 0 N-CA-C 111.587 0.217 . . . . 0.0 111.587 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 72.3 t -90.26 146.51 6.1 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.222 0 C-N-CA 124.874 1.27 . . . . 0.0 109.503 171.333 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 53.1 p-10 -149.89 151.32 33.24 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 124.761 1.224 . . . . 0.0 113.568 -178.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 2.9 mm-40 -163.71 172.23 14.49 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.359 1.464 . . . . 0.0 111.944 -170.075 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 99.8 m-70 -90.62 135.05 33.95 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.615 1.166 . . . . 0.0 109.905 168.523 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 78.6 mt -149.41 139.44 22.06 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 124.775 1.23 . . . . 0.0 110.359 -174.607 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 2.4 t -151.57 152.36 32.8 Favored 'General case' 0 C--O 1.237 0.402 0 O-C-N 121.072 -1.018 . . . . 0.0 113.405 177.029 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 56.31 -128.1 45.22 Favored Glycine 0 CA--C 1.53 0.988 0 C-N-CA 124.738 1.161 . . . . 0.0 113.743 171.602 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 29.6 p -57.29 -37.53 72.57 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 124.36 1.064 . . . . 0.0 112.91 177.38 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 66.9 m-70 -72.31 -29.03 63.47 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 119.589 1.086 . . . . 0.0 113.027 176.665 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 50.8 tp -72.08 -45.27 61.35 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 119.035 0.834 . . . . 0.0 110.926 170.51 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 45.1 t -58.59 -40.91 80.55 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.159 0 C-N-CA 124.205 1.002 . . . . 0.0 111.231 174.184 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . 0.415 ' HA ' ' CE2' ' B' ' 16' ' ' TYR . 39.9 tt0 -61.25 -46.38 90.6 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 125.234 1.414 . . . . 0.0 112.036 171.092 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.23 -41.36 96.73 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 121.55 -0.719 . . . . 0.0 111.799 176.637 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -55.96 -51.98 65.79 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 119.138 0.881 . . . . 0.0 110.728 172.011 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . 0.415 ' CE2' ' HA ' ' B' ' 13' ' ' GLU 0.265 1.0 OUTLIER -69.47 -29.41 67.06 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 113.819 1.044 . . . . 0.0 113.819 -177.718 . . . . . . . . 4 4 . 1 . 017 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 82.4 mt -74.33 -41.74 60.6 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.161 0.984 . . . . 0.0 112.551 173.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 38.8 t -67.84 -47.91 77.56 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 C-N-CA 123.698 0.799 . . . . 0.0 110.786 177.81 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 86.2 m -73.75 -39.12 64.45 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 112.682 0.623 . . . . 0.0 112.682 -177.619 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.25 -129.0 40.06 Favored Glycine 0 CA--C 1.528 0.876 0 C-N-CA 123.913 0.768 . . . . 0.0 111.687 -179.624 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -60.37 -23.97 64.73 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.905 1.282 . . . . 0.0 113.182 177.527 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 85.3 mtm180 -65.39 -30.15 70.94 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.042 0.937 . . . . 0.0 113.248 178.738 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.89 175.99 11.76 Favored Glycine 0 CA--C 1.536 1.372 0 C-N-CA 124.889 1.233 . . . . 0.0 113.164 -173.766 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 15.9 p90 -143.15 161.12 39.05 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.759 1.224 . . . . 0.0 111.669 174.448 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 9.0 t80 -127.78 -13.7 5.23 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 113.822 1.045 . . . . 0.0 113.822 -176.115 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 88.3 t80 -61.18 127.12 29.99 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 124.198 0.999 . . . . 0.0 113.622 -179.569 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 12.2 p -92.49 128.71 43.39 Favored Pre-proline 0 CA--C 1.54 0.569 0 C-N-CA 125.466 1.507 . . . . 0.0 110.212 174.539 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_endo -67.38 131.47 24.91 Favored 'Trans proline' 0 C--N 1.35 0.655 0 C-N-CA 123.273 2.649 . . . . 0.0 111.421 -169.94 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 96.8 mttt . . . . . 0 N--CA 1.482 1.134 0 C-N-CA 126.787 2.035 . . . . 0.0 114.281 -179.028 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 44.6 pt . . . . . 0 N--CA 1.48 1.061 0 N-CA-C 115.5 1.667 . . . . 0.0 115.5 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 75.2 t -56.07 -35.98 43.44 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.313 0 CA-C-N 120.462 1.483 . . . . 0.0 111.193 178.23 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 18.4 tt0 -70.81 -17.92 62.75 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 123.735 0.814 . . . . 0.0 112.769 179.102 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 37.5 tt0 -88.69 -51.76 5.5 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 124.816 1.246 . . . . 0.0 109.434 168.826 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 88.5 m -55.92 -38.77 70.72 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.444 1.098 . . . . 0.0 112.747 -176.231 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 96.0 m -76.14 -27.87 57.19 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 113.74 1.015 . . . . 0.0 113.74 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 82.0 p -102.95 -22.85 13.77 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 124.829 1.252 . . . . 0.0 113.161 -172.783 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 10.6 t -151.2 -166.2 2.46 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.289 1.836 . . . . 0.0 110.371 -174.868 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 56.7 mt -81.1 139.36 18.17 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 O-C-N 120.448 -1.407 . . . . 0.0 110.594 174.658 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 11.8 p -133.81 161.08 35.72 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 124.532 1.133 . . . . 0.0 111.207 168.628 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 24.2 p -103.1 159.28 15.67 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 113.669 0.989 . . . . 0.0 113.669 -171.552 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 56.4 mt -68.04 -27.46 66.55 Favored 'General case' 0 CA--C 1.537 0.451 0 O-C-N 121.193 -0.942 . . . . 0.0 111.86 174.805 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.9 t80 -66.05 -34.03 77.14 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 123.595 0.758 . . . . 0.0 112.766 171.471 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 70.1 mt-30 -67.12 -43.29 82.81 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 118.834 -0.603 . . . . 0.0 110.804 170.704 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 36.9 mt -58.65 -45.9 88.3 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 118.932 0.787 . . . . 0.0 111.852 175.502 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 11.3 tt0 -65.47 -23.01 66.81 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 113.78 1.03 . . . . 0.0 113.78 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 13.8 t-20 -62.55 -22.4 66.3 Favored 'General case' 0 CA--C 1.549 0.91 0 O-C-N 120.983 -1.073 . . . . 0.0 113.089 176.8 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -98.55 2.86 47.88 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 125.626 1.571 . . . . 0.0 113.794 175.57 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 11.5 t -76.64 169.93 17.36 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.627 1.171 . . . . 0.0 111.46 169.534 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 8.2 m-80 . . . . . 0 C--O 1.251 1.165 0 C-N-CA 124.036 0.934 . . . . 0.0 112.109 172.343 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 44.0 t80 . . . . . 0 N--CA 1.484 1.225 0 CA-C-O 119.784 -0.15 . . . . 0.0 110.876 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 13.8 p -66.54 150.55 10.95 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 C-N-CA 124.539 1.136 . . . . 0.0 111.708 175.337 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . 0.269 0.8 OUTLIER 47.98 59.03 4.5 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 126.244 1.818 . . . . 0.0 113.861 -179.998 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 -129.85 162.44 28.53 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.327 1.451 . . . . 0.0 111.028 -172.744 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 15.8 m-70 -76.44 135.41 39.41 Favored 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 164.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 82.3 mt -141.76 126.83 18.4 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 124.993 1.317 . . . . 0.0 109.856 -176.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 3.7 t -144.89 151.2 38.34 Favored 'General case' 0 N--CA 1.468 0.456 0 O-C-N 121.383 -0.823 . . . . 0.0 112.851 176.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.13 -124.93 34.36 Favored Glycine 0 CA--C 1.53 0.973 0 C-N-CA 125.018 1.294 . . . . 0.0 112.847 172.025 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 11.4 p -50.16 -48.64 53.74 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 125.361 1.464 . . . . 0.0 112.981 175.69 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -67.07 -34.56 77.93 Favored 'General case' 0 CA--C 1.541 0.63 0 O-C-N 121.171 -0.956 . . . . 0.0 112.216 -178.261 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 52.2 tp -70.91 -42.57 69.77 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.623 0.769 . . . . 0.0 111.723 175.007 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 50.9 t -62.1 -43.09 97.3 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.858 0 C-N-CA 124.063 0.945 . . . . 0.0 110.547 174.531 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 27.1 mm-40 -63.82 -42.07 97.74 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 123.25 0.62 . . . . 0.0 112.175 173.573 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.03 -41.68 99.59 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 119.512 1.051 . . . . 0.0 111.811 175.571 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 28.0 mt -58.67 -44.54 90.21 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.822 0.849 . . . . 0.0 111.438 172.804 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 20.0 m-85 -63.01 -41.74 99.65 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 119.243 0.929 . . . . 0.0 112.952 173.268 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 64.7 mt -67.52 -41.09 84.97 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 123.919 0.887 . . . . 0.0 112.274 179.268 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 41.8 t -72.25 -48.56 48.09 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 C-N-CA 124.05 0.94 . . . . 0.0 111.934 177.583 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 48.6 t -81.62 -37.31 27.76 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 112.887 0.699 . . . . 0.0 112.887 -171.839 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 69.65 -144.27 40.02 Favored Glycine 0 CA--C 1.529 0.964 0 C-N-CA 124.111 0.862 . . . . 0.0 112.567 178.364 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -62.59 -21.52 65.68 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 125.091 1.356 . . . . 0.0 113.384 -177.211 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 90.4 mtm180 -58.76 -35.96 73.6 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.866 1.266 . . . . 0.0 113.262 178.82 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.12 142.42 1.92 Allowed Glycine 0 CA--C 1.535 1.313 0 C-N-CA 125.519 1.533 . . . . 0.0 113.517 -178.937 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 52.8 p90 -113.36 147.54 37.49 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.102 1.361 . . . . 0.0 111.077 176.397 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 45.4 p90 -94.97 -14.83 24.04 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.378 1.071 . . . . 0.0 113.709 -176.105 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 25.4 t80 -87.26 107.07 18.33 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.139 1.376 . . . . 0.0 113.506 -169.627 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 20.8 p -76.38 145.63 76.34 Favored Pre-proline 0 N--CA 1.475 0.802 0 C-N-CA 124.657 1.183 . . . . 0.0 110.064 168.831 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -72.6 151.84 53.05 Favored 'Trans proline' 0 CA--C 1.537 0.651 0 C-N-CA 122.612 2.208 . . . . 0.0 112.59 -172.406 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 22.2 tptm . . . . . 0 CA--C 1.548 0.89 0 C-N-CA 123.956 0.903 . . . . 0.0 112.26 171.584 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 10.8 tp . . . . . 0 N--CA 1.479 0.988 0 N-CA-C 114.179 1.177 . . . . 0.0 114.179 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 5.4 p -66.32 -44.25 91.08 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.102 0 CA-C-N 120.394 1.452 . . . . 0.0 112.621 -172.7 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -75.06 -32.96 61.65 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 118.778 0.717 . . . . 0.0 111.468 174.826 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -65.96 -29.93 70.41 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 124.424 1.09 . . . . 0.0 112.35 -179.858 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 65.6 m -100.6 -26.53 13.79 Favored 'General case' 0 CA--C 1.543 0.703 0 N-CA-C 114.987 1.477 . . . . 0.0 114.987 174.141 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 15.1 t -96.14 -43.97 7.51 Favored 'General case' 0 N--CA 1.479 1.021 0 CA-C-N 120.021 1.282 . . . . 0.0 112.814 -174.974 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 25.5 m -86.18 -44.81 11.9 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 124.652 1.181 . . . . 0.0 110.167 176.898 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 75.4 m -101.36 175.4 5.59 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.976 1.31 . . . . 0.0 111.801 170.109 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 7.7 mt -96.98 141.88 14.94 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 C-N-CA 125.157 1.383 . . . . 0.0 109.468 -179.409 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 12.8 p -136.6 156.29 48.76 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 115.155 1.539 . . . . 0.0 115.155 -177.913 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 34.4 t -101.09 160.85 14.04 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 127.121 2.168 . . . . 0.0 111.334 173.916 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 54.9 mt -58.06 -27.5 63.68 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 123.844 0.858 . . . . 0.0 112.094 171.484 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 86.6 t80 -61.53 -32.11 72.16 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.292 1.037 . . . . 0.0 113.465 172.354 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 37.4 mt-30 -80.31 -33.29 37.7 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 123.901 0.88 . . . . 0.0 110.958 176.625 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 55.5 mt -61.3 -43.94 98.04 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.143 0.577 . . . . 0.0 111.679 169.469 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.3 tt0 -55.58 -28.75 56.81 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.721 1.608 . . . . 0.0 113.849 179.918 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 -63.04 -20.99 65.85 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 113.551 0.945 . . . . 0.0 113.551 178.213 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 73.3 m-85 -102.8 -1.23 30.18 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 125.527 1.531 . . . . 0.0 113.449 -179.165 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 72.0 m -69.47 148.9 48.9 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.162 0.985 . . . . 0.0 113.162 174.443 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 28.4 m120 . . . . . 0 C--O 1.251 1.176 0 C-N-CA 125.024 1.33 . . . . 0.0 112.35 169.325 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 54.8 p90 . . . . . 0 N--CA 1.482 1.168 0 CA-C-O 119.761 -0.161 . . . . 0.0 110.867 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 13.4 p -70.61 122.17 21.9 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.975 0 C-N-CA 123.585 0.754 . . . . 0.0 111.582 -178.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 55.7 t30 -169.49 118.21 0.63 Allowed 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.876 1.67 . . . . 0.0 109.901 -177.33 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 2.7 mm-40 -161.25 171.62 18.07 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.816 1.246 . . . . 0.0 111.301 -171.065 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 82.4 m-70 -83.19 141.32 32.0 Favored 'General case' 0 CA--C 1.545 0.782 0 O-C-N 121.51 -0.744 . . . . 0.0 110.829 169.054 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 72.6 mt -141.88 138.88 32.41 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 126.349 1.859 . . . . 0.0 109.049 174.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 2.7 t -151.77 148.0 27.34 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 123.176 0.59 . . . . 0.0 112.232 -175.786 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.19 -130.63 47.69 Favored Glycine 0 N--CA 1.472 1.043 0 C-N-CA 124.501 1.048 . . . . 0.0 113.128 174.43 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 18.6 m -53.93 -37.11 63.51 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 124.829 1.252 . . . . 0.0 113.121 177.838 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 88.9 m-70 -68.57 -39.29 81.06 Favored 'General case' 0 CA--C 1.543 0.687 0 O-C-N 121.116 -0.99 . . . . 0.0 111.685 178.612 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 58.3 tp -65.96 -44.5 84.78 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 123.645 0.778 . . . . 0.0 111.462 173.365 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 50.2 t -60.48 -44.89 97.36 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 C-N-CA 124.178 0.991 . . . . 0.0 111.141 176.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 27.3 mm-40 -65.28 -42.72 92.87 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.161 0.584 . . . . 0.0 111.943 175.003 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.58 -40.16 96.24 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 119.401 1.0 . . . . 0.0 112.295 177.19 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 32.1 mt -58.46 -50.53 73.4 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 123.217 0.607 . . . . 0.0 110.422 171.671 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 23.5 m-85 -61.86 -33.47 74.24 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 119.637 1.108 . . . . 0.0 113.453 176.52 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 69.4 mt -69.05 -41.9 77.02 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 119.174 0.897 . . . . 0.0 112.419 173.866 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 56.0 t -70.66 -44.36 76.67 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 CA-C-N 118.781 0.719 . . . . 0.0 111.872 177.951 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 34.9 m -81.32 -18.77 44.6 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 114.094 1.146 . . . . 0.0 114.094 -176.281 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 66.99 -146.78 48.64 Favored Glycine 0 CA--C 1.531 1.042 0 C-N-CA 124.229 0.919 . . . . 0.0 111.703 -174.247 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 2.5 pm0 -67.22 -15.51 63.74 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.926 1.291 . . . . 0.0 113.95 179.659 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 76.9 mtp85 -68.71 -31.43 70.51 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.848 0.859 . . . . 0.0 112.52 177.216 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.61 -177.03 49.96 Favored Glycine 0 CA--C 1.533 1.206 0 C-N-CA 125.191 1.377 . . . . 0.0 113.831 -179.156 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 42.4 p90 -123.22 161.95 23.53 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.058 1.343 . . . . 0.0 111.861 178.348 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 82.7 t80 -128.08 115.34 18.29 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.194 0.998 . . . . 0.0 110.056 172.925 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 49.0 t80 -169.28 153.52 5.4 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 125.478 1.511 . . . . 0.0 112.635 -175.089 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 17.4 p -128.29 106.94 19.46 Favored Pre-proline 0 N--CA 1.473 0.714 0 C-N-CA 126.424 1.889 . . . . 0.0 109.933 173.845 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -56.4 142.81 88.54 Favored 'Trans proline' 0 C--N 1.351 0.71 0 C-N-CA 124.255 3.303 . . . . 0.0 112.75 173.451 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 62.1 pttt . . . . . 0 N--CA 1.476 0.859 0 N-CA-C 114.852 1.427 . . . . 0.0 114.852 -175.82 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.068 0 N-CA-C 114.477 1.288 . . . . 0.0 114.477 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 84.2 t -65.76 -52.91 44.32 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 CA-C-N 118.75 0.705 . . . . 0.0 110.452 -175.328 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -64.25 -36.95 85.74 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 117.842 0.292 . . . . 0.0 111.131 178.156 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 52.5 tt0 -62.85 -53.97 45.99 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.812 1.245 . . . . 0.0 111.671 -179.199 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 51.9 m -70.24 -26.52 63.88 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 113.13 0.789 . . . . 0.0 113.13 178.008 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 89.8 m -71.14 -53.29 15.07 Favored 'General case' 0 N--CA 1.472 0.662 0 O-C-N 120.965 -1.085 . . . . 0.0 111.274 173.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 82.4 p -83.97 -16.92 42.3 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 124.599 1.16 . . . . 0.0 114.11 -171.308 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 77.6 p -143.48 168.33 20.1 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.904 0.882 . . . . 0.0 112.677 -179.011 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 20.4 mt -68.2 131.57 33.32 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 O-C-N 121.265 -0.897 . . . . 0.0 110.038 172.555 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 13.6 p -126.23 179.12 5.41 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.505 1.122 . . . . 0.0 111.914 171.789 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 88.2 p -139.78 165.14 28.08 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 125.258 1.423 . . . . 0.0 111.759 -171.547 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 11.2 mp -61.5 -29.42 69.97 Favored 'General case' 0 CA--C 1.54 0.562 0 O-C-N 121.29 -0.881 . . . . 0.0 112.306 -179.409 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 81.9 t80 -63.51 -37.48 87.47 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 112.872 0.693 . . . . 0.0 112.872 170.92 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 60.1 mt-30 -74.43 -33.74 63.04 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 124.063 0.945 . . . . 0.0 111.403 175.45 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 89.2 mt -63.28 -51.5 65.83 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 118.604 0.638 . . . . 0.0 110.988 171.601 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 25.0 mt-10 -66.28 -27.94 68.32 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 113.483 0.92 . . . . 0.0 113.483 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 16.1 t30 -58.84 -28.72 66.34 Favored 'General case' 0 CA--C 1.546 0.822 0 CA-C-N 119.317 0.962 . . . . 0.0 112.84 176.9 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 52.0 m-85 -98.09 5.69 48.38 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.615 1.566 . . . . 0.0 113.308 176.606 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 81.1 m -98.7 163.84 12.47 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.837 1.255 . . . . 0.0 112.62 170.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 73.4 m-80 . . . . . 0 C--O 1.251 1.17 0 CA-C-O 117.935 -1.031 . . . . 0.0 112.779 177.223 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 26.6 t80 . . . . . 0 N--CA 1.487 1.383 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 4.3 p -60.89 148.75 8.64 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 CA-C-N 120.409 1.459 . . . . 0.0 112.482 -178.803 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 1.9 t30 65.45 52.63 1.36 Allowed 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 125.319 1.447 . . . . 0.0 111.586 172.562 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 2.9 mm-40 -149.21 167.6 25.55 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.32 1.048 . . . . 0.0 111.7 -177.725 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 28.0 m-70 -78.55 143.84 36.15 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 123.35 0.66 . . . . 0.0 109.382 167.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 60.8 mt -140.86 126.25 18.74 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 125.596 1.558 . . . . 0.0 109.483 174.425 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 5.2 t -142.53 149.62 39.36 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 121.598 -0.689 . . . . 0.0 112.414 -175.687 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 59.5 -132.06 51.49 Favored Glycine 0 CA--C 1.529 0.955 0 C-N-CA 124.392 0.996 . . . . 0.0 113.488 172.362 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 24.4 p -57.15 -36.22 70.47 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.81 1.244 . . . . 0.0 113.11 177.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 67.5 m-70 -71.97 -29.65 64.47 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 119.665 1.12 . . . . 0.0 113.001 175.643 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 58.3 tp -70.75 -42.75 70.06 Favored 'General case' 0 N--CA 1.471 0.581 0 O-C-N 121.287 -0.883 . . . . 0.0 111.403 170.367 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 43.5 t -58.95 -48.39 86.65 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 124.415 1.086 . . . . 0.0 110.533 173.909 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -55.96 -49.7 72.83 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.354 1.462 . . . . 0.0 111.692 173.611 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.27 -47.91 83.86 Favored 'General case' 0 CA--C 1.534 0.359 0 O-C-N 121.618 -0.676 . . . . 0.0 111.937 178.487 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 50.4 mt -60.23 -40.9 91.83 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 118.884 0.765 . . . . 0.0 111.524 178.568 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 11.8 m-85 -63.63 -47.13 82.63 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-N 119.139 0.881 . . . . 0.0 112.716 173.575 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 9.2 mp -69.7 -38.23 76.9 Favored 'General case' 0 N--CA 1.472 0.632 0 O-C-N 121.614 -0.679 . . . . 0.0 112.463 -178.373 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 73.8 t -76.08 -43.76 37.94 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 C-N-CA 124.391 1.077 . . . . 0.0 111.633 -177.559 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 64.5 m -96.71 -20.62 18.12 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 114.763 1.394 . . . . 0.0 114.763 -173.81 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 71.68 -143.56 35.47 Favored Glycine 0 CA--C 1.533 1.2 0 C-N-CA 124.584 1.087 . . . . 0.0 112.466 179.243 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -63.67 -17.7 63.22 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 125.012 1.325 . . . . 0.0 113.65 -178.531 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 61.6 mtm180 -61.23 -31.2 70.99 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.354 1.062 . . . . 0.0 113.729 -179.516 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.18 171.81 29.66 Favored Glycine 0 CA--C 1.533 1.173 0 C-N-CA 124.192 0.901 . . . . 0.0 113.872 178.634 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 51.7 p90 -137.67 155.98 48.54 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 125.682 1.593 . . . . 0.0 113.333 -169.793 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 2.8 t80 -100.43 114.17 27.52 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.548 1.539 . . . . 0.0 108.944 169.108 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 15.6 t80 -85.36 57.2 4.32 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 124.953 1.301 . . . . 0.0 112.245 -173.285 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 2.7 m -65.89 122.69 82.18 Favored Pre-proline 0 N--CA 1.476 0.869 0 C-N-CA 125.255 1.422 . . . . 0.0 112.413 -169.598 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -80.01 -171.84 1.36 Allowed 'Trans proline' 0 CA--C 1.537 0.655 0 C-N-CA 124.165 3.244 . . . . 0.0 111.305 175.151 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 61.4 tttm . . . . . 0 CA--C 1.547 0.842 0 O-C-N 121.273 -0.892 . . . . 0.0 113.284 174.025 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 18.1 tt . . . . . 0 N--CA 1.482 1.144 0 N-CA-C 115.921 1.823 . . . . 0.0 115.921 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 5.4 p -62.24 -27.21 42.14 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 O-C-N 121.294 -0.879 . . . . 0.0 112.492 176.105 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -73.71 -1.25 18.35 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 124.808 1.243 . . . . 0.0 112.862 174.821 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 12.2 tt0 -111.3 -57.46 2.24 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.046 1.338 . . . . 0.0 108.978 168.129 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 67.2 m -67.0 -27.61 67.58 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 114.802 1.408 . . . . 0.0 114.802 -170.604 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 11.9 t -92.64 -30.65 15.48 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.459 0.703 . . . . 0.0 112.819 -177.592 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 37.8 p -87.85 -31.65 19.42 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 126.344 1.857 . . . . 0.0 112.251 -178.965 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 9.1 t -142.59 -164.81 1.9 Allowed 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 126.268 1.827 . . . . 0.0 109.997 179.798 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 23.1 mm -86.52 144.66 8.94 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 C-N-CA 125.28 1.432 . . . . 0.0 110.469 177.057 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 15.0 p -137.29 172.81 12.43 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.119 1.368 . . . . 0.0 111.337 169.087 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 46.3 t -120.1 151.32 39.22 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 124.249 1.019 . . . . 0.0 112.354 -175.846 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 26.1 mt -60.77 -27.38 67.94 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.76 0.824 . . . . 0.0 112.116 175.431 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 87.1 t80 -60.87 -32.29 71.73 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 123.885 0.874 . . . . 0.0 113.178 170.262 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 68.6 mt-30 -77.73 -31.77 52.42 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.785 0.834 . . . . 0.0 110.934 176.989 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 41.2 mt -59.96 -50.37 74.0 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 122.95 0.5 . . . . 0.0 110.309 169.707 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -60.96 -28.92 69.34 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 113.294 0.85 . . . . 0.0 113.294 175.333 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 31.6 t30 -73.28 -33.88 65.46 Favored 'General case' 0 CA--C 1.545 0.778 0 CA-C-N 118.859 0.754 . . . . 0.0 112.415 176.674 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -70.81 -48.59 53.36 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.972 0.909 . . . . 0.0 112.09 171.937 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 85.0 m -54.13 134.61 44.23 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.067 1.347 . . . . 0.0 113.244 179.399 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 5.4 p30 . . . . . 0 C--O 1.252 1.189 0 C-N-CA 126.13 1.772 . . . . 0.0 113.518 -174.999 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 60.5 t80 . . . . . 0 N--CA 1.486 1.361 0 CA-C-O 119.618 -0.23 . . . . 0.0 110.527 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 10.3 t 78.37 -34.65 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 C-N-CA 128.346 2.658 . . . . 0.0 111.336 -175.99 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 11.4 p-10 -71.19 135.08 47.38 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 125.863 1.665 . . . . 0.0 112.459 169.594 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 3.3 tt0 -167.85 169.88 11.16 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.881 1.272 . . . . 0.0 111.701 179.705 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 98.5 m-70 -86.75 147.48 25.83 Favored 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 165.02 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 64.5 mt -149.22 141.26 23.86 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.784 1.634 . . . . 0.0 109.632 174.91 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.7 t -147.88 144.35 28.04 Favored 'General case' 0 N--CA 1.474 0.75 0 O-C-N 120.97 -1.081 . . . . 0.0 112.997 -178.076 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 50.04 -125.23 19.24 Favored Glycine 0 N--CA 1.471 1.003 0 C-N-CA 125.123 1.344 . . . . 0.0 113.841 171.496 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 20.0 m -56.83 -33.15 66.47 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.568 1.147 . . . . 0.0 113.248 178.492 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -73.25 -36.27 66.36 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.075 -1.016 . . . . 0.0 111.802 176.727 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 26.8 tp -68.49 -43.41 76.95 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 123.889 0.876 . . . . 0.0 111.041 173.253 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 50.4 t -60.45 -44.25 95.87 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.984 0 C-N-CA 124.731 1.212 . . . . 0.0 111.253 173.277 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -64.56 -43.88 92.52 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 123.446 0.698 . . . . 0.0 111.537 175.68 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.07 -45.18 94.65 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 123.33 0.652 . . . . 0.0 111.677 176.594 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 18.9 mt -53.66 -51.0 64.56 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.196 0.999 . . . . 0.0 111.118 172.869 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 21.1 m-85 -60.46 -46.52 89.77 Favored 'General case' 0 CA--C 1.542 0.662 0 O-C-N 121.479 -0.763 . . . . 0.0 113.025 177.207 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 84.4 mt -67.72 -40.72 84.22 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 123.672 0.789 . . . . 0.0 112.907 -178.998 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 49.5 t -75.21 -44.56 43.0 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 C-N-CA 123.826 0.85 . . . . 0.0 111.598 -178.599 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 78.3 m -87.53 -23.79 24.27 Favored 'General case' 0 N--CA 1.466 0.348 0 N-CA-C 114.413 1.264 . . . . 0.0 114.413 -171.619 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 52.35 -103.88 0.14 Allowed Glycine 0 CA--C 1.533 1.18 0 C-N-CA 124.428 1.013 . . . . 0.0 114.04 169.43 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -80.1 -16.11 55.7 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 126.181 1.792 . . . . 0.0 114.729 -177.468 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -70.76 -31.05 67.72 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 119.077 0.853 . . . . 0.0 112.385 175.753 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 82.64 142.16 4.26 Favored Glycine 0 CA--C 1.535 1.314 0 C-N-CA 125.027 1.299 . . . . 0.0 112.213 -173.913 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -80.62 173.39 12.65 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 114.197 1.184 . . . . 0.0 114.197 -175.387 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 19.3 t80 -156.37 39.82 0.35 Allowed 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.444 1.097 . . . . 0.0 112.033 -174.388 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 60.3 t80 -54.66 140.56 35.08 Favored 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 113.74 1.015 . . . . 0.0 113.74 -177.861 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 38.6 m -140.02 117.79 8.39 Favored Pre-proline 0 N--CA 1.474 0.765 0 C-N-CA 125.119 1.368 . . . . 0.0 109.651 177.688 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_exo -56.36 -178.71 0.08 OUTLIER 'Trans proline' 0 C--N 1.353 0.8 1 C-N-CA 125.668 4.245 . . . . 0.0 115.427 170.136 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 45.1 mttm . . . . . 0 N--CA 1.474 0.733 0 C-N-CA 125.373 1.469 . . . . 0.0 113.387 -179.038 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.483 1.214 0 N-CA-C 114.875 1.435 . . . . 0.0 114.875 . . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 23.2 t -59.45 -41.58 85.03 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.171 0 CA-C-N 119.879 1.218 . . . . 0.0 110.618 -174.248 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -70.3 -9.2 55.37 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.93 1.692 . . . . 0.0 113.472 -179.569 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 54.8 tt0 -103.54 -62.98 1.23 Allowed 'General case' 0 C--O 1.226 -0.178 0 C-N-CA 124.38 1.072 . . . . 0.0 109.24 169.815 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 86.8 m -55.48 -32.67 63.01 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 114.656 1.354 . . . . 0.0 114.656 -169.547 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 84.1 m -76.0 -20.59 57.72 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 113.889 1.07 . . . . 0.0 113.889 -176.456 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 39.5 p -126.09 -43.49 1.81 Allowed 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 125.564 1.545 . . . . 0.0 112.251 -171.053 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 67.5 m -102.84 176.51 5.13 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 127.136 2.174 . . . . 0.0 110.963 171.527 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 69.1 mt -82.24 145.57 8.44 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 O-C-N 120.619 -1.3 . . . . 0.0 110.077 173.781 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 15.0 p -136.57 -179.9 5.97 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.113 1.365 . . . . 0.0 111.432 170.492 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 93.4 p -138.49 159.86 41.02 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 121.149 -0.969 . . . . 0.0 112.02 -171.798 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 39.7 mt -62.42 -30.94 71.59 Favored 'General case' 0 CA--C 1.541 0.597 0 O-C-N 122.043 -0.411 . . . . 0.0 111.516 174.956 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.3 t80 -63.93 -34.15 77.32 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 123.784 0.833 . . . . 0.0 113.17 172.168 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 36.1 mt-30 -76.82 -26.59 54.54 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 123.639 0.776 . . . . 0.0 111.914 172.888 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 38.0 mt -71.05 -41.67 70.46 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 119.427 1.012 . . . . 0.0 111.901 169.673 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -53.55 -33.1 53.46 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.401 1.08 . . . . 0.0 113.182 175.055 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.0 t-20 -60.08 -22.44 62.73 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 178.075 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 70.1 m-85 -107.91 9.26 28.75 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.718 1.607 . . . . 0.0 114.184 177.357 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 75.9 m -83.39 147.31 27.96 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 121.113 -0.992 . . . . 0.0 111.795 169.545 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 83.4 m-20 . . . . . 0 C--O 1.254 1.3 0 CA-C-O 117.774 -1.107 . . . . 0.0 112.074 173.086 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . 0.277 8.8 p90 . . . . . 0 N--CA 1.496 1.83 0 CA-C-O 117.978 -1.011 . . . . 0.0 108.984 . . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 48.8 t -140.76 91.46 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 C-N-CA 126.33 1.852 . . . . 0.0 106.718 169.523 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 -162.36 152.1 16.15 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.617 1.167 . . . . 0.0 113.088 -167.836 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -174.98 177.68 1.92 Allowed 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 126.646 1.978 . . . . 0.0 110.688 -174.977 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -83.19 145.25 29.28 Favored 'General case' 0 CA--C 1.546 0.794 0 O-C-N 120.983 -1.073 . . . . 0.0 109.692 167.454 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 77.2 mt -147.99 138.43 22.93 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 125.892 1.677 . . . . 0.0 110.106 177.261 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 3.6 t -148.0 155.45 41.53 Favored 'General case' 0 CA--C 1.535 0.401 0 O-C-N 120.977 -1.077 . . . . 0.0 113.117 175.342 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 53.93 -130.6 43.69 Favored Glycine 0 N--CA 1.469 0.894 0 C-N-CA 124.874 1.226 . . . . 0.0 113.402 171.791 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.8 m -52.3 -39.35 60.42 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 124.529 1.132 . . . . 0.0 112.768 178.667 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 12.9 t60 -76.19 -30.67 58.12 Favored 'General case' 0 CA--C 1.541 0.626 0 O-C-N 121.097 -1.002 . . . . 0.0 112.578 -177.209 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 50.2 tp -67.94 -41.2 82.87 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 121.54 -0.725 . . . . 0.0 110.899 169.091 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 53.8 t -63.43 -43.1 98.31 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 C-N-CA 124.267 1.027 . . . . 0.0 111.389 174.64 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 57.0 mt-10 -56.88 -50.33 72.83 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.64 0.776 . . . . 0.0 111.341 170.58 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.63 -43.69 93.72 Favored 'General case' 0 CA--C 1.539 0.546 0 O-C-N 121.693 -0.629 . . . . 0.0 111.715 179.628 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 31.3 mt -59.02 -45.11 91.53 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.656 0.782 . . . . 0.0 111.842 173.682 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 18.4 m-85 -62.01 -42.33 99.04 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-N 119.585 1.084 . . . . 0.0 112.918 174.328 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 8.9 mp -68.41 -40.88 81.12 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 118.673 0.67 . . . . 0.0 112.029 178.472 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 54.7 t -70.7 -45.37 74.19 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 123.78 0.832 . . . . 0.0 111.852 179.46 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 57.2 m -80.38 -27.86 38.08 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 113.632 0.975 . . . . 0.0 113.632 -177.859 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 67.42 -138.94 34.7 Favored Glycine 0 CA--C 1.53 0.992 0 C-N-CA 123.891 0.758 . . . . 0.0 111.711 -176.426 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 2.4 pm0 -69.37 -15.49 63.32 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.786 1.234 . . . . 0.0 113.757 178.104 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 54.6 mtm180 -69.06 -34.36 75.04 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.296 1.039 . . . . 0.0 112.646 179.706 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.09 177.64 36.97 Favored Glycine 0 CA--C 1.533 1.175 0 C-N-CA 124.453 1.025 . . . . 0.0 113.711 -175.415 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 7.3 p90 -117.26 166.44 12.28 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 126.485 1.914 . . . . 0.0 112.922 -176.529 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 47.0 p90 -128.7 8.99 5.87 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.276 1.43 . . . . 0.0 113.731 175.145 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 5.2 p90 -55.13 147.43 16.15 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 115.167 1.543 . . . . 0.0 115.167 -171.951 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 23.6 p -89.25 134.75 32.37 Favored Pre-proline 0 N--CA 1.47 0.529 0 C-N-CA 124.596 1.158 . . . . 0.0 110.041 170.015 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -80.06 177.54 8.18 Favored 'Trans proline' 0 CA--C 1.538 0.712 0 C-N-CA 123.145 2.564 . . . . 0.0 111.397 176.859 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 40.6 ttpt . . . . . 0 N--CA 1.474 0.736 0 C-N-CA 123.751 0.82 . . . . 0.0 113.06 177.156 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 10.2 tt . . . . . 0 N--CA 1.479 0.997 0 N-CA-C 112.902 0.705 . . . . 0.0 112.902 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 87.4 t -65.83 -46.19 89.43 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 CA-C-N 119.418 1.008 . . . . 0.0 112.151 -169.244 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -73.69 -29.59 62.38 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 119.235 0.925 . . . . 0.0 112.084 174.474 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 -67.95 -35.77 78.95 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.586 1.155 . . . . 0.0 112.219 179.398 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 14.8 m -97.48 -25.57 15.13 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 114.992 1.479 . . . . 0.0 114.992 176.842 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 27.8 t -95.06 -59.18 1.96 Allowed 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 120.014 1.279 . . . . 0.0 112.157 -176.305 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 20.9 m -71.26 -50.48 32.34 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.39 1.076 . . . . 0.0 109.847 179.265 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 75.2 m -91.22 171.16 9.43 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 124.203 1.001 . . . . 0.0 111.129 168.623 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 12.3 tt -91.87 147.38 5.34 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 124.124 0.97 . . . . 0.0 110.893 175.411 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 18.9 p -135.71 150.98 49.72 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 113.568 0.951 . . . . 0.0 113.568 177.325 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 13.2 t -106.53 164.14 12.31 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 125.262 1.425 . . . . 0.0 111.206 176.092 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 78.0 mt -59.39 -25.88 64.65 Favored 'General case' 0 CA--C 1.541 0.617 0 O-C-N 121.355 -0.841 . . . . 0.0 113.037 -177.755 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.8 t80 -60.01 -32.53 70.96 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 123.832 0.853 . . . . 0.0 113.224 170.397 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -81.08 -30.51 34.7 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.452 1.101 . . . . 0.0 110.927 176.181 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -64.89 -44.49 89.44 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 119.546 1.066 . . . . 0.0 110.626 169.238 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -59.84 -28.59 67.63 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 124.449 1.1 . . . . 0.0 113.822 176.421 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 22.4 t30 -59.36 -28.24 66.68 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 123.764 0.825 . . . . 0.0 113.095 177.446 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 97.6 m-85 -99.99 2.2 43.27 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.848 1.259 . . . . 0.0 113.899 -179.292 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 64.8 m -72.28 170.08 14.88 Favored 'General case' 0 CA--C 1.549 0.907 0 O-C-N 120.959 -1.088 . . . . 0.0 111.951 169.642 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.253 1.261 0 C-N-CA 125.374 1.469 . . . . 0.0 112.678 176.402 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 64.2 m-85 . . . . . 0 N--CA 1.488 1.469 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 8.0 t -85.92 57.48 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.369 0 CA-C-N 120.228 1.376 . . . . 0.0 109.223 174.456 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -97.32 130.36 44.5 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.535 1.534 . . . . 0.0 113.027 -170.749 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 41.1 mt-30 -148.01 163.77 35.85 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.872 1.669 . . . . 0.0 111.124 -174.903 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 57.5 m-70 -94.44 129.55 41.14 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 167.439 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 69.8 mt -137.06 135.1 37.21 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 126.184 1.794 . . . . 0.0 109.03 -176.36 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 1.4 t -143.02 142.95 31.72 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.256 0.622 . . . . 0.0 111.87 -171.918 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 51.17 -121.6 12.12 Favored Glycine 0 CA--C 1.53 0.973 0 C-N-CA 124.567 1.08 . . . . 0.0 113.957 170.439 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 16.3 t -55.51 -39.82 70.98 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.13 0.972 . . . . 0.0 112.701 178.199 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 72.6 m-70 -73.56 -27.93 61.59 Favored 'General case' 0 CA--C 1.542 0.661 0 O-C-N 120.455 -1.403 . . . . 0.0 113.348 178.013 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 41.8 tp -72.86 -41.79 64.39 Favored 'General case' 0 N--CA 1.467 0.415 0 O-C-N 121.437 -0.789 . . . . 0.0 111.654 170.836 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 24.9 t -60.67 -43.31 94.66 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.851 0 C-N-CA 124.495 1.118 . . . . 0.0 111.0 172.084 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -60.34 -46.8 88.65 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.312 1.445 . . . . 0.0 111.68 173.011 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.15 -40.99 95.91 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 121.461 -0.774 . . . . 0.0 112.23 175.907 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 59.6 mt -63.14 -42.18 99.42 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 118.915 0.779 . . . . 0.0 111.846 174.51 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 21.7 m-85 -61.58 -40.04 93.34 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 119.269 0.94 . . . . 0.0 112.521 172.309 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 79.0 mt -69.46 -44.51 71.07 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 123.824 0.849 . . . . 0.0 112.28 177.997 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 79.3 t -74.66 -44.46 46.56 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 C-N-CA 123.921 0.888 . . . . 0.0 112.095 -177.63 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 40.5 m -87.55 -26.61 23.05 Favored 'General case' 0 N--CA 1.474 0.772 0 N-CA-C 113.599 0.963 . . . . 0.0 113.599 -176.159 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 73.48 -153.09 47.29 Favored Glycine 0 CA--C 1.531 1.069 0 C-N-CA 125.188 1.375 . . . . 0.0 112.998 -179.698 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -59.14 -22.12 60.4 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.372 1.469 . . . . 0.0 113.867 -176.741 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.97 -26.98 68.82 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.759 1.223 . . . . 0.0 113.087 178.009 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 79.09 -172.62 55.27 Favored Glycine 0 CA--C 1.53 0.969 0 C-N-CA 124.543 1.068 . . . . 0.0 113.657 -176.098 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 40.4 p90 -148.92 161.02 42.7 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.011 1.324 . . . . 0.0 113.658 -169.321 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 57.3 m-85 -88.48 149.19 23.78 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 125.35 1.46 . . . . 0.0 109.364 167.89 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 48.4 t80 -138.5 130.36 28.08 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 121.455 -0.778 . . . . 0.0 112.864 -176.097 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 78.5 m -141.13 108.18 6.27 Favored Pre-proline 0 N--CA 1.472 0.666 0 C-N-CA 124.688 1.195 . . . . 0.0 110.267 -179.348 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_endo -80.88 168.65 17.25 Favored 'Trans proline' 0 N--CA 1.455 -0.756 0 C-N-CA 123.528 2.819 . . . . 0.0 110.908 169.487 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 39.7 ttpt . . . . . 0 CA--C 1.546 0.807 0 C-N-CA 123.351 0.66 . . . . 0.0 112.291 172.009 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 9.8 tt . . . . . 0 N--CA 1.484 1.251 0 N-CA-C 114.332 1.234 . . . . 0.0 114.332 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 9.0 p -58.9 -35.67 57.63 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 O-C-N 121.106 -0.996 . . . . 0.0 113.636 -169.809 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 55.1 mt-10 -73.13 -10.46 59.8 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 119.178 0.899 . . . . 0.0 113.325 175.864 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 -93.26 -60.34 1.81 Allowed 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 108.565 -0.902 . . . . 0.0 108.565 169.053 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 56.1 m -62.83 -29.97 71.13 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 115.304 1.594 . . . . 0.0 115.304 -173.461 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 13.9 t -89.7 -29.0 19.05 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.581 0.752 . . . . 0.0 112.802 -175.847 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 28.1 m -97.07 -39.09 9.49 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 125.835 1.654 . . . . 0.0 111.502 -176.171 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 70.2 m -124.96 -173.21 2.75 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.247 1.819 . . . . 0.0 110.017 176.062 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 11.6 tt -88.41 143.47 11.15 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 O-C-N 120.336 -1.478 . . . . 0.0 110.577 176.281 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 18.9 p -130.92 166.08 21.69 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.438 1.095 . . . . 0.0 111.754 175.677 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 44.9 p -108.08 159.98 16.15 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 113.718 1.007 . . . . 0.0 113.718 -174.199 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 77.0 mt -64.53 -30.83 71.86 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 121.332 -0.855 . . . . 0.0 111.433 172.369 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 87.6 t80 -65.63 -34.67 78.76 Favored 'General case' 0 CA--C 1.542 0.645 0 O-C-N 121.481 -0.762 . . . . 0.0 112.816 174.153 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -71.46 -26.53 62.75 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 123.6 0.76 . . . . 0.0 112.07 172.837 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 98.5 mt -74.49 -41.82 60.05 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 119.143 0.883 . . . . 0.0 112.01 169.769 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -55.97 -29.07 59.66 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 124.21 1.004 . . . . 0.0 113.237 176.735 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 17.8 t30 -52.88 -32.04 42.92 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.729 1.211 . . . . 0.0 113.511 174.376 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 87.4 m-85 -97.69 2.03 49.26 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 125.398 1.479 . . . . 0.0 114.695 -175.766 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 73.0 m -78.43 150.83 32.99 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.005 0.922 . . . . 0.0 113.239 178.575 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 . . . . . 0 C--O 1.25 1.101 0 C-N-CA 124.31 1.044 . . . . 0.0 112.243 170.535 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 52.8 p90 . . . . . 0 N--CA 1.485 1.288 0 CA-C-O 118.832 -0.604 . . . . 0.0 110.721 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . 0.3 24.0 m 58.59 -37.3 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 C-N-CA 130.39 3.476 . . . . 0.0 116.44 -173.809 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 17.6 m120 -126.95 138.53 53.29 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 127.329 2.251 . . . . 0.0 109.209 169.011 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 33.0 tp60 -158.95 160.43 36.02 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 123.51 0.724 . . . . 0.0 111.483 -169.365 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 95.9 m-70 -98.13 133.03 43.14 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 123.881 0.872 . . . . 0.0 109.017 167.724 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 88.5 mt -146.57 141.88 27.42 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 124.986 1.314 . . . . 0.0 110.383 -171.799 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 2.0 t -153.25 146.26 24.55 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.157 0.583 . . . . 0.0 111.823 -177.247 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 52.3 -126.47 30.93 Favored Glycine 0 N--CA 1.475 1.263 0 C-N-CA 124.766 1.174 . . . . 0.0 114.086 171.952 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 31.4 p -58.97 -33.87 71.15 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.628 1.171 . . . . 0.0 113.142 178.301 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 22.4 t-160 -71.55 -37.22 71.13 Favored 'General case' 0 CA--C 1.544 0.731 0 O-C-N 121.036 -1.04 . . . . 0.0 111.57 176.497 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 64.0 tp -65.15 -44.99 86.8 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 123.587 0.755 . . . . 0.0 111.525 171.689 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 40.4 t -60.82 -43.85 96.32 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 C-N-CA 124.286 1.034 . . . . 0.0 111.177 175.414 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -64.42 -42.75 95.88 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 123.59 0.756 . . . . 0.0 111.725 175.628 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.37 -41.61 98.76 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 121.677 -0.639 . . . . 0.0 111.885 175.782 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 36.6 mt -58.78 -47.84 83.34 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 118.46 0.573 . . . . 0.0 110.852 172.906 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 26.2 m-85 -59.47 -41.54 89.98 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 119.679 1.127 . . . . 0.0 112.876 175.252 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 77.6 mt -67.0 -41.32 86.94 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.998 0.919 . . . . 0.0 112.424 177.511 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 44.3 t -69.86 -42.37 79.88 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 C-N-CA 124.239 1.016 . . . . 0.0 111.798 178.62 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 61.4 m -81.6 -32.0 32.23 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 113.837 1.051 . . . . 0.0 113.837 -176.003 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 82.04 -148.21 26.84 Favored Glycine 0 CA--C 1.53 1.01 0 C-N-CA 124.616 1.103 . . . . 0.0 112.686 -177.832 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 3.8 pm0 -62.88 -23.43 67.33 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 126.292 1.837 . . . . 0.0 115.494 -169.032 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 18.1 mtm-85 -83.7 -20.18 33.96 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 124.663 1.185 . . . . 0.0 113.221 -177.951 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.9 -161.63 54.3 Favored Glycine 0 CA--C 1.532 1.155 0 C-N-CA 124.611 1.101 . . . . 0.0 113.38 -174.96 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 9.9 p90 -125.73 164.83 19.8 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 126.252 1.821 . . . . 0.0 112.993 -172.947 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 43.0 p90 -101.58 3.71 40.26 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 124.793 1.237 . . . . 0.0 112.394 168.301 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 79.8 t80 -48.86 141.91 6.99 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 126.623 1.969 . . . . 0.0 115.438 -177.166 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 24.1 p -136.77 137.2 22.86 Favored Pre-proline 0 N--CA 1.472 0.659 0 C-N-CA 126.084 1.753 . . . . 0.0 109.247 168.322 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -77.06 162.47 31.77 Favored 'Trans proline' 0 N--CA 1.459 -0.531 0 C-N-CA 123.358 2.705 . . . . 0.0 110.915 173.989 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 52.3 mtpt . . . . . 0 CA--C 1.547 0.858 0 N-CA-C 114.057 1.132 . . . . 0.0 114.057 -177.779 . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 10.0 tp . . . . . 0 N--CA 1.478 0.96 0 N-CA-C 113.265 0.839 . . . . 0.0 113.265 . . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 10.6 p -69.53 -38.76 77.46 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 C-N-CA 123.534 0.734 . . . . 0.0 112.503 -171.185 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 21.3 pm0 -72.51 -2.51 19.95 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 123.964 0.906 . . . . 0.0 113.333 174.855 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -105.17 -57.46 2.03 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.77 1.228 . . . . 0.0 110.417 172.23 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 21.4 m -68.22 -28.33 67.15 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 114.58 1.326 . . . . 0.0 114.58 -175.462 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 73.5 m -73.62 -47.15 42.43 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-N 119.644 1.111 . . . . 0.0 111.078 170.941 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 27.4 m -71.3 -37.17 71.84 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 126.538 1.935 . . . . 0.0 112.291 -170.737 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 48.2 m -137.2 167.7 21.05 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 125.326 1.45 . . . . 0.0 111.572 -176.313 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 39.2 mt -63.31 132.88 29.29 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 O-C-N 121.289 -0.882 . . . . 0.0 109.958 170.774 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 7.1 p -135.12 156.63 48.67 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.179 0.992 . . . . 0.0 112.635 176.254 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 34.2 t -108.79 160.83 15.66 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 126.138 1.775 . . . . 0.0 111.558 -175.229 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 23.7 mt -57.46 -28.01 62.98 Favored 'General case' 0 N--CA 1.469 0.504 0 O-C-N 121.62 -0.675 . . . . 0.0 111.838 173.17 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 85.9 t80 -61.85 -31.16 71.4 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 124.237 1.015 . . . . 0.0 113.665 173.06 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 34.5 mt-30 -79.16 -32.0 44.17 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.725 0.81 . . . . 0.0 111.015 174.381 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 55.0 mt -67.58 -41.14 84.62 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.36 0.664 . . . . 0.0 112.255 171.578 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -55.31 -33.15 63.06 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 124.866 1.266 . . . . 0.0 113.099 175.184 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 17.3 t30 -61.27 -26.5 67.81 Favored 'General case' 0 CA--C 1.547 0.839 0 N-CA-C 113.141 0.793 . . . . 0.0 113.141 176.811 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 49.2 m-85 -99.6 -1.77 37.31 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.409 1.484 . . . . 0.0 114.168 -179.293 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 73.5 m -67.26 151.03 48.23 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 120.867 -1.146 . . . . 0.0 112.957 173.202 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 90.0 m-20 . . . . . 0 C--O 1.252 1.208 0 C-N-CA 124.376 1.07 . . . . 0.0 111.95 169.754 . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 43.8 p90 . . . . . 0 N--CA 1.487 1.378 0 CA-C-O 119.11 -0.471 . . . . 0.0 110.7 . . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 15.4 m -77.78 63.94 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.444 0 C-N-CA 125.513 1.525 . . . . 0.0 112.914 -173.17 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 38.8 t30 -157.87 109.7 2.31 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.917 1.687 . . . . 0.0 109.654 -175.35 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 2.6 mm-40 -168.09 175.65 6.51 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 125.291 1.436 . . . . 0.0 110.713 -169.626 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 49.0 m-70 -68.22 134.73 50.91 Favored 'General case' 0 CA--C 1.544 0.728 0 O-C-N 120.7 -1.25 . . . . 0.0 109.485 168.017 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 76.4 mt -135.31 126.89 28.87 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 125.631 1.572 . . . . 0.0 109.119 176.083 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.7 t -143.76 150.16 38.19 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 113.093 0.775 . . . . 0.0 113.093 -174.041 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 54.98 -128.27 43.14 Favored Glycine 0 N--CA 1.469 0.86 0 C-N-CA 124.68 1.133 . . . . 0.0 113.059 173.755 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 15.8 m -54.78 -36.17 64.61 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.518 1.127 . . . . 0.0 113.282 177.832 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 73.9 m-70 -76.76 -29.21 56.02 Favored 'General case' 0 CA--C 1.539 0.526 0 O-C-N 120.895 -1.128 . . . . 0.0 113.036 178.061 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 56.3 tp -69.54 -44.75 70.3 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 118.888 0.767 . . . . 0.0 110.689 169.908 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 25.3 t -60.22 -43.72 93.93 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.981 0 C-N-CA 124.904 1.282 . . . . 0.0 111.017 175.027 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -59.45 -50.44 73.92 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 125.142 1.377 . . . . 0.0 111.45 172.317 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.59 -40.75 97.91 Favored 'General case' 0 CA--C 1.537 0.466 0 O-C-N 121.397 -0.815 . . . . 0.0 111.978 179.683 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 40.0 mt -61.27 -42.66 99.02 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 123.661 0.784 . . . . 0.0 111.683 173.771 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 19.3 m-85 -61.97 -42.0 98.63 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-N 119.885 1.221 . . . . 0.0 112.678 172.702 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 9.0 mp -68.3 -42.39 79.5 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 118.613 0.642 . . . . 0.0 112.145 178.676 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 54.5 t -71.19 -45.31 71.7 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 C-N-CA 123.622 0.769 . . . . 0.0 111.809 -179.806 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 43.9 m -89.33 -20.01 24.57 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 114.027 1.121 . . . . 0.0 114.027 -173.023 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 66.91 -149.52 51.35 Favored Glycine 0 CA--C 1.532 1.132 0 C-N-CA 124.544 1.068 . . . . 0.0 113.078 177.956 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -61.26 -23.3 65.56 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 125.248 1.419 . . . . 0.0 113.531 -177.062 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 78.2 mtp85 -64.14 -29.44 70.56 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.34 1.056 . . . . 0.0 112.921 177.441 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.42 -169.69 54.64 Favored Glycine 0 CA--C 1.531 1.093 0 C-N-CA 124.464 1.031 . . . . 0.0 113.14 -175.238 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 54.9 p90 -147.07 157.71 43.7 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.503 1.121 . . . . 0.0 113.684 -171.164 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 60.1 t80 -88.77 147.36 24.49 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.89 1.676 . . . . 0.0 109.869 169.192 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 65.1 t80 -151.02 139.92 20.92 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.816 0.846 . . . . 0.0 111.997 -175.975 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 15.4 t -168.12 141.51 2.65 Favored Pre-proline 0 N--CA 1.472 0.65 0 C-N-CA 126.421 1.889 . . . . 0.0 109.681 -178.318 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -87.8 -163.69 0.17 Allowed 'Trans proline' 0 CA--C 1.54 0.819 0 C-N-CA 124.15 3.234 . . . . 0.0 111.821 178.099 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 39.8 ttmt . . . . . 0 CA--C 1.544 0.734 0 C-N-CA 124.861 1.264 . . . . 0.0 113.924 -175.407 . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 12.4 tt . . . . . 0 N--CA 1.482 1.174 0 N-CA-C 113.687 0.995 . . . . 0.0 113.687 . . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 5.4 p -63.11 -27.92 44.08 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 O-C-N 121.518 -0.738 . . . . 0.0 112.92 178.901 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -72.14 -11.97 60.98 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 123.633 0.773 . . . . 0.0 112.833 176.27 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 22.6 tt0 -95.16 -66.49 0.91 Allowed 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 123.855 0.862 . . . . 0.0 109.144 169.165 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 57.0 m -68.94 -26.73 65.22 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 115.797 1.777 . . . . 0.0 115.797 -168.803 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 15.4 t -84.14 -43.26 15.18 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 119.631 1.105 . . . . 0.0 111.179 176.696 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 24.2 m -69.4 -32.33 71.27 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 126.116 1.766 . . . . 0.0 112.609 -179.245 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 91.8 p -147.26 169.12 20.07 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.946 1.298 . . . . 0.0 112.498 -174.967 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 38.7 mt -64.73 134.14 29.58 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.864 0 O-C-N 120.935 -1.103 . . . . 0.0 110.52 174.144 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 9.7 p -133.34 177.37 7.74 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 125.079 1.351 . . . . 0.0 111.195 169.907 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.4 t -139.69 167.33 22.35 Favored 'General case' 0 N--CA 1.466 0.366 0 O-C-N 120.927 -1.108 . . . . 0.0 112.786 179.433 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 46.8 mt -62.59 -30.11 71.09 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.445 1.098 . . . . 0.0 112.71 -169.658 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 83.3 t80 -63.61 -28.14 69.72 Favored 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 172.918 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 60.9 mt-30 -82.83 -23.18 33.86 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 123.84 0.856 . . . . 0.0 111.674 175.804 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 47.7 mt -67.83 -43.57 79.27 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 118.905 0.775 . . . . 0.0 110.742 171.661 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -56.13 -24.99 44.36 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 113.894 1.072 . . . . 0.0 113.894 175.707 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 29.4 t30 -60.47 -27.83 67.86 Favored 'General case' 0 CA--C 1.548 0.871 0 CA-C-N 119.628 1.104 . . . . 0.0 113.072 175.242 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 89.1 m-85 -96.71 2.33 51.92 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.505 1.522 . . . . 0.0 112.874 177.865 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 70.4 m -98.55 161.03 13.89 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.973 1.309 . . . . 0.0 112.535 177.357 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 75.7 m-20 . . . . . 0 C--O 1.25 1.126 0 C-N-CA 123.629 0.772 . . . . 0.0 112.355 175.911 . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 55.0 t80 . . . . . 0 N--CA 1.491 1.609 0 N-CA-C 110.077 -0.342 . . . . 0.0 110.077 . . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 15.4 m -64.27 144.61 14.55 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 O-C-N 121.05 -1.031 . . . . 0.0 111.864 176.303 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 5.3 t30 54.49 60.29 3.64 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 125.517 1.527 . . . . 0.0 113.268 174.419 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 29.8 mm-40 -145.69 171.05 15.3 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 125.853 1.661 . . . . 0.0 111.601 -178.852 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 25.3 m-70 -81.02 143.19 32.68 Favored 'General case' 0 CA--C 1.545 0.776 0 O-C-N 120.956 -1.09 . . . . 0.0 109.607 167.356 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 67.0 mt -140.73 130.45 24.26 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 126.123 1.769 . . . . 0.0 109.148 175.26 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.6 t -135.68 144.31 45.9 Favored 'General case' 0 N--CA 1.472 0.645 0 O-C-N 121.53 -0.731 . . . . 0.0 112.784 -174.826 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 49.78 -123.33 13.11 Favored Glycine 0 N--CA 1.471 1.0 0 C-N-CA 125.287 1.423 . . . . 0.0 114.043 170.955 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 20.2 m -55.12 -38.25 67.94 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.322 1.049 . . . . 0.0 112.55 177.92 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 1.4 t-80 -70.04 -34.2 72.94 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 120.881 -1.137 . . . . 0.0 111.748 179.023 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 43.2 tp -69.99 -41.43 74.4 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 123.889 0.876 . . . . 0.0 111.507 173.653 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 55.0 t -62.15 -42.69 96.08 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 124.755 1.222 . . . . 0.0 110.91 173.313 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -64.39 -41.22 96.78 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.596 0.759 . . . . 0.0 112.233 173.071 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.1 -42.84 99.62 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 119.661 1.119 . . . . 0.0 111.792 174.977 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 26.2 mt -59.36 -44.75 92.67 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 123.362 0.665 . . . . 0.0 111.893 173.166 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 6.1 m-85 -57.76 -48.32 79.99 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.605 0.762 . . . . 0.0 112.208 172.999 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 7.9 mp -67.87 -41.27 83.11 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 123.704 0.801 . . . . 0.0 112.321 -178.077 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 61.5 t -74.33 -46.77 42.95 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.693 0 CA-C-N 118.188 0.449 . . . . 0.0 111.774 -177.061 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 86.3 m -99.96 -25.95 14.15 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 114.178 1.177 . . . . 0.0 114.178 -169.931 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 55.05 -121.64 22.79 Favored Glycine 0 CA--C 1.531 1.051 0 C-N-CA 124.386 0.993 . . . . 0.0 113.477 169.85 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -62.18 -22.9 66.28 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.721 1.608 . . . . 0.0 113.365 -177.073 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 24.6 mmm180 -62.31 -37.34 85.2 Favored 'General case' 0 N--CA 1.472 0.674 0 O-C-N 121.438 -0.788 . . . . 0.0 112.255 175.848 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.2 164.91 9.04 Favored Glycine 0 CA--C 1.535 1.296 0 C-N-CA 124.462 1.029 . . . . 0.0 112.911 -171.105 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 54.7 p90 -146.99 155.09 41.98 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.467 1.107 . . . . 0.0 113.689 -172.483 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 53.7 t80 -105.38 84.17 2.06 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.659 1.584 . . . . 0.0 109.672 175.197 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 66.5 t80 -68.12 140.18 56.19 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.675 -0.641 . . . . 0.0 111.11 172.632 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 15.7 p -133.29 119.22 15.31 Favored Pre-proline 0 CA--C 1.539 0.543 0 C-N-CA 125.132 1.373 . . . . 0.0 110.647 179.583 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -77.58 -179.13 5.14 Favored 'Trans proline' 0 CA--C 1.538 0.7 0 C-N-CA 123.287 2.658 . . . . 0.0 111.023 173.944 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 28.9 ttpp . . . . . 0 CA--C 1.548 0.882 0 C-N-CA 124.258 1.023 . . . . 0.0 112.804 170.725 . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 7.8 tp . . . . . 0 N--CA 1.48 1.069 0 N-CA-C 113.039 0.755 . . . . 0.0 113.039 . . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 10.0 p -66.85 -34.9 72.99 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.19 0 CA-C-N 119.873 1.215 . . . . 0.0 111.297 179.962 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -69.38 -11.46 60.84 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.941 1.296 . . . . 0.0 113.535 172.103 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 27.2 tt0 -91.07 -61.18 1.72 Allowed 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 123.681 0.792 . . . . 0.0 108.973 168.751 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 59.9 m -66.31 -21.5 66.27 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 114.647 1.351 . . . . 0.0 114.647 -169.961 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 7.6 t -86.87 -19.1 29.41 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 124.592 1.157 . . . . 0.0 113.008 176.232 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 34.4 m -104.11 -45.96 4.58 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 125.996 1.719 . . . . 0.0 111.28 -174.816 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 66.9 m -120.89 178.1 4.85 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 127.26 2.224 . . . . 0.0 110.11 177.087 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 10.7 tt -84.28 137.13 21.41 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 O-C-N 120.679 -1.263 . . . . 0.0 110.708 178.178 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.8 m -106.75 172.5 6.78 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 125.249 1.419 . . . . 0.0 111.586 176.989 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 34.6 t -122.13 149.17 43.96 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 125.32 1.448 . . . . 0.0 112.08 176.98 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 82.6 mt -60.08 -29.12 68.36 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 121.422 -0.799 . . . . 0.0 111.747 171.076 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 79.1 t80 -63.98 -28.15 69.61 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 113.272 0.842 . . . . 0.0 113.272 173.776 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 90.3 mt-30 -76.26 -37.68 57.27 Favored 'General case' 0 CA--C 1.534 0.328 0 O-C-N 121.621 -0.675 . . . . 0.0 110.466 172.689 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 31.7 mt -64.09 -40.33 96.0 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 118.668 0.667 . . . . 0.0 112.13 175.181 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -54.92 -34.26 62.97 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.297 1.039 . . . . 0.0 113.309 171.631 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 -69.03 -21.43 64.12 Favored 'General case' 0 CA--C 1.549 0.912 0 O-C-N 121.309 -0.869 . . . . 0.0 113.158 179.005 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 75.0 m-85 -96.45 -0.96 48.38 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.186 1.394 . . . . 0.0 114.009 175.758 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 72.7 m -71.31 150.32 45.25 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 119.237 0.926 . . . . 0.0 112.88 173.565 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 . . . . . 0 C--O 1.255 1.383 0 C-N-CA 125.259 1.424 . . . . 0.0 112.762 176.243 . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 46.2 t80 . . . . . 0 N--CA 1.486 1.365 0 CA-C-O 119.752 -0.166 . . . . 0.0 111.398 . . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 21.0 t 74.98 -57.29 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.325 0 C-N-CA 128.321 2.648 . . . . 0.0 111.114 -175.996 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 25.1 m120 -111.99 134.99 53.2 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.729 1.212 . . . . 0.0 112.326 177.864 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -151.63 155.52 38.56 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 125.28 1.432 . . . . 0.0 111.646 -175.569 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 95.4 m-70 -93.15 133.37 36.4 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 108.004 -1.109 . . . . 0.0 108.004 166.148 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 84.0 mt -143.52 134.71 25.78 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 124.687 1.195 . . . . 0.0 110.538 -170.972 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.6 t -149.49 132.41 16.13 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 123.399 0.68 . . . . 0.0 111.883 -175.107 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 58.65 -124.41 36.46 Favored Glycine 0 N--CA 1.472 1.047 0 C-N-CA 124.356 0.979 . . . . 0.0 112.861 177.295 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.8 m -52.02 -37.77 54.54 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.789 1.236 . . . . 0.0 112.827 177.454 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 40.8 m80 -66.21 -40.18 90.16 Favored 'General case' 0 CA--C 1.543 0.684 0 O-C-N 121.084 -1.01 . . . . 0.0 111.582 -179.143 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 53.3 tp -66.86 -41.62 87.01 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.056 0.942 . . . . 0.0 111.171 174.636 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 40.1 t -62.63 -43.06 98.21 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 C-N-CA 124.337 1.055 . . . . 0.0 111.457 175.313 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -61.05 -49.33 77.81 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.565 0.746 . . . . 0.0 111.259 173.797 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.99 -42.15 98.83 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 123.493 0.717 . . . . 0.0 111.501 -179.397 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 29.9 mt -57.37 -52.11 66.7 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 118.613 -0.708 . . . . 0.0 111.339 173.561 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -66.87 -31.83 72.7 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 120.118 1.326 . . . . 0.0 112.484 -178.627 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 79.5 mt -69.64 -39.09 77.33 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 123.903 0.881 . . . . 0.0 112.475 174.82 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 42.4 t -70.73 -44.6 76.24 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 C-N-CA 123.904 0.882 . . . . 0.0 111.954 175.285 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 59.2 m -80.52 -26.45 38.11 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 113.575 0.954 . . . . 0.0 113.575 -174.399 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 71.1 -147.81 43.42 Favored Glycine 0 CA--C 1.532 1.097 0 C-N-CA 124.437 1.018 . . . . 0.0 111.535 -173.256 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -63.24 -14.99 55.62 Favored 'General case' 0 CA--C 1.544 0.732 0 N-CA-C 114.451 1.278 . . . . 0.0 114.451 -178.559 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 59.1 mtm180 -65.36 -35.59 81.43 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.891 1.277 . . . . 0.0 112.742 177.092 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.04 -178.69 51.0 Favored Glycine 0 CA--C 1.533 1.202 0 C-N-CA 124.234 0.921 . . . . 0.0 113.611 -172.852 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 45.7 p90 -124.99 165.86 17.38 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.791 1.636 . . . . 0.0 112.709 -175.056 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 34.6 t80 -142.19 41.99 1.65 Allowed 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 126.669 1.987 . . . . 0.0 110.081 -179.281 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -64.59 156.08 31.12 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 124.685 1.194 . . . . 0.0 114.161 -177.79 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 22.9 p -122.68 67.22 29.39 Favored Pre-proline 0 N--CA 1.48 1.062 0 C-N-CA 125.041 1.336 . . . . 0.0 112.807 -170.618 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -72.76 157.23 52.29 Favored 'Trans proline' 0 C--N 1.348 0.509 0 C-N-CA 123.103 2.536 . . . . 0.0 111.672 176.237 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 94.1 mttt . . . . . 0 N--CA 1.476 0.835 0 C-N-CA 129.114 2.965 . . . . 0.0 112.455 172.075 . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 17.2 tt . . . . . 0 N--CA 1.483 1.221 0 N-CA-C 115.972 1.841 . . . . 0.0 115.972 . . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 3.7 p -58.88 -29.54 40.86 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 CA-C-N 120.413 1.46 . . . . 0.0 112.17 173.399 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -73.04 -10.4 59.76 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.567 1.147 . . . . 0.0 112.693 177.033 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -99.74 -58.92 1.81 Allowed 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 124.387 1.075 . . . . 0.0 109.115 168.831 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 90.8 m -62.46 -29.85 70.82 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 115.085 1.513 . . . . 0.0 115.085 -172.74 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 8.1 t -87.93 -27.52 22.08 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 123.829 0.851 . . . . 0.0 112.562 179.188 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 23.1 m -90.47 -34.51 15.56 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 126.251 1.821 . . . . 0.0 111.992 -175.418 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.7 t -145.65 -163.68 1.78 Allowed 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 126.356 1.862 . . . . 0.0 110.18 178.654 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 17.8 mm -80.35 146.1 8.11 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 C-N-CA 124.927 1.291 . . . . 0.0 110.713 173.598 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 18.1 p -135.1 170.43 15.91 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.31 1.444 . . . . 0.0 111.886 169.433 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 74.7 m -124.89 153.43 42.64 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.184 1.394 . . . . 0.0 112.627 -170.05 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 43.1 mt -60.36 -31.65 70.53 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 113.619 0.97 . . . . 0.0 113.619 -173.87 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 91.9 t80 -62.43 -31.63 72.36 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 123.886 0.874 . . . . 0.0 113.243 172.909 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 68.5 mt-30 -75.44 -34.94 61.02 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.754 0.822 . . . . 0.0 110.53 176.014 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 57.9 mt -64.05 -48.17 77.32 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 123.334 0.654 . . . . 0.0 110.938 173.344 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -56.35 -28.87 60.42 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.802 1.241 . . . . 0.0 113.715 176.06 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 27.7 t30 -58.25 -26.97 63.55 Favored 'General case' 0 CA--C 1.546 0.823 0 O-C-N 120.931 -1.105 . . . . 0.0 113.523 178.3 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -97.86 -2.81 39.99 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.284 1.434 . . . . 0.0 113.606 179.614 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 80.3 m -82.83 161.3 22.0 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.456 1.103 . . . . 0.0 113.022 177.698 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 16.5 t-20 . . . . . 0 C--O 1.253 1.257 0 C-N-CA 124.911 1.284 . . . . 0.0 113.453 -175.727 . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 36.9 p90 . . . . . 0 N--CA 1.487 1.402 0 N-CA-C 111.914 0.338 . . . . 0.0 111.914 . . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 49.0 t 71.69 -58.68 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.342 0 C-N-CA 128.463 2.705 . . . . 0.0 113.871 171.431 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 34.6 m120 -78.48 125.46 29.39 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.388 1.475 . . . . 0.0 111.911 -174.71 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -150.79 159.94 44.2 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.281 1.032 . . . . 0.0 112.165 -179.352 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 86.2 m-70 -97.71 136.31 38.25 Favored 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 107.066 -1.457 . . . . 0.0 107.066 165.365 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 87.0 mt -147.2 137.2 23.17 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.505 1.122 . . . . 0.0 110.814 -177.16 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.8 t -152.38 138.76 18.51 Favored 'General case' 0 N--CA 1.47 0.559 0 O-C-N 121.318 -0.864 . . . . 0.0 113.024 -177.901 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 58.32 -128.16 46.91 Favored Glycine 0 N--CA 1.47 0.965 0 C-N-CA 124.35 0.976 . . . . 0.0 113.334 174.303 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.7 m -55.25 -32.54 62.41 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.528 1.131 . . . . 0.0 113.046 176.993 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 25.0 m80 -69.85 -41.41 74.93 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 121.16 -0.962 . . . . 0.0 111.325 177.328 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 64.1 tp -64.89 -45.92 83.91 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.132 0.973 . . . . 0.0 110.782 173.763 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 38.6 t -57.55 -46.31 86.13 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.928 0 C-N-CA 124.717 1.207 . . . . 0.0 111.229 175.494 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -64.84 -42.99 94.48 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.429 0.691 . . . . 0.0 111.811 176.0 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.22 -41.62 98.56 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 121.574 -0.704 . . . . 0.0 112.21 176.766 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -56.66 -46.79 80.86 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.533 0.733 . . . . 0.0 110.963 173.51 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 31.6 m-85 -65.37 -36.51 84.22 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 113.453 0.909 . . . . 0.0 113.453 175.534 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 77.9 mt -71.31 -42.34 68.74 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 118.98 0.809 . . . . 0.0 112.684 177.4 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 54.8 t -72.07 -47.82 52.73 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.726 0 C-N-CA 124.334 1.054 . . . . 0.0 111.292 -177.885 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 81.4 m -93.75 -9.63 36.99 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 114.243 1.201 . . . . 0.0 114.243 -174.734 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 70.82 -154.33 52.12 Favored Glycine 0 CA--C 1.532 1.122 0 C-N-CA 124.998 1.285 . . . . 0.0 112.929 177.387 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -64.03 -9.07 13.92 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.972 1.309 . . . . 0.0 114.335 176.252 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 14.6 ttp180 -61.53 -30.99 70.99 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.668 1.587 . . . . 0.0 113.038 179.195 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 82.09 173.97 49.21 Favored Glycine 0 CA--C 1.53 1.024 0 C-N-CA 125.31 1.433 . . . . 0.0 114.17 174.639 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 23.4 p90 -151.16 155.22 38.43 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.26 1.424 . . . . 0.0 113.42 -176.159 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 74.9 t80 -90.99 -29.85 17.15 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.367 1.067 . . . . 0.0 113.71 -170.924 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 85.3 t80 -70.21 153.32 43.23 Favored 'General case' 0 CA--C 1.546 0.808 0 N-CA-C 114.915 1.45 . . . . 0.0 114.915 -170.266 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 24.3 p -136.02 142.75 41.4 Favored Pre-proline 0 N--CA 1.476 0.829 0 C-N-CA 126.903 2.081 . . . . 0.0 108.784 169.045 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -70.29 124.29 10.73 Favored 'Trans proline' 0 C--N 1.35 0.619 0 C-N-CA 122.78 2.32 . . . . 0.0 111.099 -170.658 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 25.3 mmmt . . . . . 0 CA--C 1.546 0.807 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 -178.198 . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . 0.417 HG23 ' H ' ' B' ' 27' ' ' THR . 9.0 tp . . . . . 0 N--CA 1.483 1.204 0 N-CA-C 113.626 0.973 . . . . 0.0 113.626 . . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 5.0 p -63.74 -26.92 41.79 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 O-C-N 121.088 -1.008 . . . . 0.0 112.982 176.651 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 65.4 tt0 -72.05 -13.61 61.64 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.857 1.263 . . . . 0.0 112.351 175.154 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 31.9 tt0 -104.97 -45.32 4.58 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.223 1.409 . . . . 0.0 110.946 176.269 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 29.7 m -80.95 -25.91 37.03 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 115.502 1.667 . . . . 0.0 115.502 -175.672 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 49.4 t -87.99 -55.25 3.84 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 120.249 1.386 . . . . 0.0 112.6 -173.416 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 25.9 p -77.86 -20.23 53.41 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 125.471 1.508 . . . . 0.0 113.371 -176.574 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.4 t -132.83 -173.36 3.16 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.533 1.533 . . . . 0.0 111.257 171.723 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 71.0 mt -87.5 139.72 16.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 124.785 1.234 . . . . 0.0 110.209 178.241 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.3 p -131.26 153.8 49.14 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 122.081 0.943 . . . . 0.0 112.125 169.424 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 41.5 t -95.24 153.91 17.44 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 125.802 1.641 . . . . 0.0 112.77 -178.695 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 11.1 mp -58.99 -27.85 65.79 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 121.466 -0.771 . . . . 0.0 111.613 169.305 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 74.5 t80 -62.41 -31.72 72.45 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 123.884 0.873 . . . . 0.0 113.093 171.729 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 35.4 mt-30 -77.28 -42.39 37.15 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 123.961 0.905 . . . . 0.0 110.49 174.34 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 80.7 mt -56.71 -52.72 63.85 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 123.764 0.826 . . . . 0.0 111.612 174.565 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -60.54 -34.66 74.45 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 123.841 0.857 . . . . 0.0 112.854 178.428 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -71.38 -32.19 68.18 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 123.688 0.795 . . . . 0.0 112.627 175.483 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -72.8 -43.4 62.8 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.117 0.967 . . . . 0.0 111.811 175.284 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 87.9 m -55.49 136.35 49.94 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 125.695 1.598 . . . . 0.0 112.229 170.92 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 4.4 p30 . . . . . 0 C--O 1.252 1.237 0 C-N-CA 126.945 2.098 . . . . 0.0 112.882 -171.399 . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 82.7 m-85 . . . . . 0 N--CA 1.485 1.307 0 N-CA-C 111.125 0.046 . . . . 0.0 111.125 . . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 57.4 t -66.77 137.59 24.55 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 C-N-CA 123.723 0.809 . . . . 0.0 109.334 171.884 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -158.48 150.48 21.48 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.451 1.101 . . . . 0.0 112.504 -170.64 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -175.85 176.9 1.75 Allowed 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 125.994 1.718 . . . . 0.0 110.703 -178.277 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 53.9 m-70 -77.94 135.72 37.88 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 124.5 1.12 . . . . 0.0 109.672 166.155 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 49.5 mt -141.81 135.82 30.02 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 126.607 1.963 . . . . 0.0 109.779 175.731 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 2.1 t -139.27 145.23 38.91 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 -174.315 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 50.21 -125.02 19.48 Favored Glycine 0 N--CA 1.471 0.976 0 C-N-CA 125.102 1.334 . . . . 0.0 114.277 169.957 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 18.9 m -55.65 -37.24 67.98 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.777 1.231 . . . . 0.0 113.09 178.223 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 70.3 m-70 -74.69 -30.29 61.51 Favored 'General case' 0 CA--C 1.541 0.599 0 O-C-N 120.79 -1.194 . . . . 0.0 112.79 176.99 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 39.2 tp -68.38 -44.68 74.62 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 118.805 0.73 . . . . 0.0 111.296 169.687 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 53.4 t -60.0 -46.21 94.43 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.014 0 C-N-CA 124.023 0.929 . . . . 0.0 110.919 173.993 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -58.61 -47.18 85.21 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 125.038 1.335 . . . . 0.0 111.869 174.33 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.53 -46.39 88.61 Favored 'General case' 0 CA--C 1.532 0.271 0 O-C-N 121.674 -0.641 . . . . 0.0 111.799 176.731 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 28.7 mt -54.84 -45.81 74.54 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 123.837 0.855 . . . . 0.0 111.138 175.788 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 11.0 m-85 -60.61 -51.51 69.11 Favored 'General case' 0 CA--C 1.544 0.722 0 O-C-N 121.041 -1.037 . . . . 0.0 112.819 173.972 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 91.9 mt -68.67 -40.23 80.26 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.133 0.973 . . . . 0.0 113.348 -175.395 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 54.3 t -73.58 -43.98 54.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 124.858 1.263 . . . . 0.0 111.365 -177.209 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 69.3 m -87.93 -27.91 21.84 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 114.705 1.372 . . . . 0.0 114.705 -170.147 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 56.17 -121.56 24.33 Favored Glycine 0 CA--C 1.531 1.045 0 C-N-CA 124.114 0.864 . . . . 0.0 112.799 174.575 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 3.7 pm0 -64.78 -14.62 59.69 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.809 1.643 . . . . 0.0 115.045 -177.064 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 61.1 mtp85 -62.77 -28.43 69.98 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 119.012 0.824 . . . . 0.0 112.655 172.621 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.84 133.05 1.57 Allowed Glycine 0 CA--C 1.53 1.014 0 C-N-CA 125.023 1.297 . . . . 0.0 110.661 -170.59 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -78.17 164.26 25.1 Favored 'General case' 0 CA--C 1.536 0.441 0 O-C-N 122.05 -0.676 . . . . 0.0 112.601 -177.697 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 53.4 t80 -155.75 134.63 11.99 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.398 1.079 . . . . 0.0 110.573 170.706 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 40.6 t80 -135.68 146.37 47.72 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 125.834 1.654 . . . . 0.0 111.849 -175.988 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 27' ' ' THR . . . . . 0.417 ' H ' HG23 ' A' ' 2' ' ' ILE . 27.1 p -141.32 139.68 19.43 Favored Pre-proline 0 CA--C 1.544 0.727 0 C-N-CA 126.108 1.763 . . . . 0.0 110.43 175.721 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -84.7 -177.43 2.87 Favored 'Trans proline' 0 CA--C 1.539 0.759 0 C-N-CA 124.01 3.14 . . . . 0.0 112.55 -174.744 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 33.0 ttpt . . . . . 0 CA--C 1.551 1.016 0 C-N-CA 126.437 1.895 . . . . 0.0 112.921 174.855 . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 9.0 tp . . . . . 0 N--CA 1.485 1.283 0 N-CA-C 114.971 1.471 . . . . 0.0 114.971 . . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 6.3 p -64.96 -24.72 36.1 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 O-C-N 121.342 -0.849 . . . . 0.0 112.985 178.855 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -75.93 0.28 18.92 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 124.067 0.947 . . . . 0.0 112.319 175.466 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 31.9 tt0 -124.46 -48.21 1.83 Allowed 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.221 1.408 . . . . 0.0 111.216 174.992 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 17.1 m -71.02 -27.39 63.64 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 114.736 1.384 . . . . 0.0 114.736 179.735 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 12.3 t -83.79 -42.07 16.88 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 119.492 1.042 . . . . 0.0 111.449 179.295 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 19.7 p -76.8 -33.94 57.97 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 126.955 2.102 . . . . 0.0 112.911 -177.159 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 73.8 m -134.27 170.8 15.16 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.468 1.507 . . . . 0.0 111.885 179.827 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 58.7 mt -68.47 136.12 27.08 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 O-C-N 120.8 -1.188 . . . . 0.0 110.13 170.833 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.0 p -133.07 162.98 30.28 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.462 1.105 . . . . 0.0 112.975 175.167 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 6.2 t -128.76 172.7 11.01 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 125.479 1.511 . . . . 0.0 112.566 -175.983 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -59.03 -31.65 69.03 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.133 1.373 . . . . 0.0 113.1 -169.855 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 87.9 t80 -63.5 -33.5 75.71 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 123.608 0.763 . . . . 0.0 113.008 175.951 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 38.0 mt-30 -76.55 -33.7 58.54 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 124.295 1.038 . . . . 0.0 110.683 176.616 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 80.8 mt -68.31 -52.81 29.39 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.871 0.868 . . . . 0.0 111.387 174.038 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -63.95 -21.47 66.5 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 113.56 0.948 . . . . 0.0 113.56 -179.026 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.3 t30 -68.69 -33.32 73.76 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 123.877 0.871 . . . . 0.0 112.618 174.876 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 9.1 m-85 -88.52 -14.34 37.99 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 114.302 1.223 . . . . 0.0 114.302 -179.086 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 91.7 m -71.53 160.34 32.88 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.692 0.797 . . . . 0.0 112.936 170.988 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 7.1 p-10 . . . . . 0 C--O 1.254 1.299 0 C-N-CA 126.895 2.078 . . . . 0.0 113.356 179.675 . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 67.5 m-85 . . . . . 0 N--CA 1.484 1.261 0 CA-C-O 117.898 -1.048 . . . . 0.0 108.743 . . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 80.2 t -68.62 -36.37 74.25 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.38 0 CA-C-N 120.861 1.664 . . . . 0.0 109.475 168.625 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 51.7 p-10 -65.48 149.02 50.74 Favored 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 125.458 1.503 . . . . 0.0 112.291 168.515 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -162.14 165.3 27.24 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.13 0.972 . . . . 0.0 111.253 -171.441 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 34.0 m-70 -74.86 143.29 43.93 Favored 'General case' 0 CA--C 1.55 0.979 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 164.412 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 40.6 mt -142.97 137.73 29.58 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 125.773 1.629 . . . . 0.0 109.208 174.722 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 3.4 t -145.62 148.76 33.45 Favored 'General case' 0 N--CA 1.47 0.574 0 O-C-N 121.367 -0.833 . . . . 0.0 112.581 -176.2 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 52.89 -128.91 38.03 Favored Glycine 0 N--CA 1.473 1.133 0 C-N-CA 125.08 1.324 . . . . 0.0 114.018 172.141 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 26.7 m -56.87 -38.17 72.36 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.182 0.993 . . . . 0.0 113.03 -178.717 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 69.7 m-70 -73.13 -30.19 63.43 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 119.308 0.958 . . . . 0.0 112.839 177.529 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 51.1 tp -68.5 -45.77 71.42 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 118.881 0.764 . . . . 0.0 111.119 170.85 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 73.8 t -63.94 -42.3 95.33 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 CA-C-N 118.489 0.586 . . . . 0.0 111.351 176.435 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -56.3 -49.54 74.0 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.991 1.317 . . . . 0.0 111.502 171.018 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.38 -43.77 98.3 Favored 'General case' 0 CA--C 1.536 0.423 0 O-C-N 121.547 -0.721 . . . . 0.0 111.448 177.48 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 21.3 mt -58.24 -44.32 88.22 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 123.626 0.771 . . . . 0.0 111.535 176.516 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 14.8 m-85 -63.03 -45.36 92.65 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 119.107 0.867 . . . . 0.0 112.755 174.116 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 9.0 mp -72.75 -41.17 65.41 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 123.799 0.839 . . . . 0.0 113.063 -176.512 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 55.5 t -70.5 -43.48 77.9 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 C-N-CA 124.644 1.178 . . . . 0.0 110.934 -177.741 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 68.7 m -79.82 -15.95 56.42 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 113.412 0.893 . . . . 0.0 113.412 -178.565 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 59.12 -120.72 23.94 Favored Glycine 0 N--CA 1.469 0.884 0 C-N-CA 125.09 1.328 . . . . 0.0 113.427 168.842 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -59.93 -24.07 64.05 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.409 1.484 . . . . 0.0 113.418 -178.332 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 79.9 mtp180 -63.83 -30.36 71.46 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.084 0.954 . . . . 0.0 112.276 173.331 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.22 -155.19 51.38 Favored Glycine 0 CA--C 1.534 1.257 0 C-N-CA 124.461 1.029 . . . . 0.0 111.495 -168.904 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 58.3 t80 -149.36 148.01 29.0 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.431 1.492 . . . . 0.0 109.969 174.923 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 46.6 t80 -159.06 64.69 0.41 Allowed 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 124.234 1.014 . . . . 0.0 111.631 -169.28 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 67.7 t80 -156.97 155.92 32.12 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.713 1.605 . . . . 0.0 111.116 176.336 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 22.9 p -118.96 99.88 50.92 Favored Pre-proline 0 N--CA 1.475 0.785 0 C-N-CA 125.428 1.491 . . . . 0.0 110.557 -179.825 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -63.61 170.44 8.37 Favored 'Trans proline' 0 CA--C 1.539 0.768 0 C-N-CA 123.528 2.819 . . . . 0.0 113.441 173.842 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt . . . . . 0 N--CA 1.478 0.927 0 N-CA-C 114.172 1.175 . . . . 0.0 114.172 -178.384 . . . . . . . . 0 0 . 1 . 031 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 6.3 tp . . . . . 0 N--CA 1.487 1.379 0 N-CA-C 110.116 -0.327 . . . . 0.0 110.116 . . . . . . . . . 0 0 . 1 . 031 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 7.2 p -61.09 -32.41 52.64 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 O-C-N 121.408 -0.808 . . . . 0.0 112.335 179.46 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.7 pm0 -73.15 -18.98 61.22 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.371 1.068 . . . . 0.0 113.505 175.421 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 25.5 tp60 -88.74 -44.05 10.83 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.226 1.01 . . . . 0.0 110.3 172.445 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 21.4 m -78.82 -32.1 46.11 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 115.254 1.575 . . . . 0.0 115.254 -177.37 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 42.6 t -93.16 -59.24 2.08 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-N 119.825 1.193 . . . . 0.0 112.12 -175.487 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 19.2 m -67.84 -44.58 76.87 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.746 1.218 . . . . 0.0 110.62 -176.525 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.3 t -103.04 -163.16 0.97 Allowed 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.623 1.169 . . . . 0.0 110.832 169.119 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 82.0 mt -109.21 138.91 34.25 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 125.835 1.654 . . . . 0.0 109.471 -179.001 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 10.2 p -129.87 170.54 13.77 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.779 0.832 . . . . 0.0 113.149 173.565 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 81.9 p -120.22 167.13 12.58 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 125.962 1.705 . . . . 0.0 112.562 -175.43 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 51.0 mt -62.16 -30.94 71.4 Favored 'General case' 0 CA--C 1.539 0.554 0 O-C-N 121.751 -0.593 . . . . 0.0 111.954 173.989 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 89.7 t80 -64.81 -36.72 85.25 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 121.416 -0.802 . . . . 0.0 112.739 171.891 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -70.82 -26.16 63.18 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 118.632 -0.699 . . . . 0.0 111.815 173.011 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 74.4 mt -73.95 -43.62 57.62 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 119.423 1.01 . . . . 0.0 112.182 169.728 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -55.51 -34.87 65.02 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 123.575 0.75 . . . . 0.0 112.777 175.11 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 15.1 t30 -58.81 -27.77 65.38 Favored 'General case' 0 CA--C 1.55 0.969 0 N-CA-C 113.679 0.992 . . . . 0.0 113.679 176.551 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 49.9 m-85 -98.3 0.44 45.59 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 125.482 1.513 . . . . 0.0 113.751 179.339 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 37.9 t -75.37 167.74 21.32 Favored 'General case' 0 CA--C 1.544 0.745 0 O-C-N 120.846 -1.159 . . . . 0.0 112.116 169.917 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 25.9 m120 . . . . . 0 C--O 1.251 1.177 0 C-N-CA 126.356 1.862 . . . . 0.0 112.094 177.643 . . . . . . . . 0 0 . 1 . 031 nuclear orig core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 33.9 t80 . . . . . 0 N--CA 1.487 1.399 0 CA-C-O 117.985 -1.007 . . . . 0.0 110.106 . . . . . . . . . 0 0 . 1 . 031 nuclear orig core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 4.8 p -173.75 102.84 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 C-N-CA 126.601 1.96 . . . . 0.0 107.793 178.13 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 10.4 m120 -144.8 135.77 24.88 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.623 1.169 . . . . 0.0 111.292 -167.156 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 2.8 mm-40 -161.48 170.04 20.69 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.842 1.257 . . . . 0.0 112.542 -177.27 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 86.5 m-70 -86.04 135.02 33.8 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.327 1.051 . . . . 0.0 109.647 167.62 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 82.5 mt -139.85 119.38 13.1 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 125.892 1.677 . . . . 0.0 109.926 178.576 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 72.1 m -123.29 130.63 53.0 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 124.911 1.284 . . . . 0.0 112.243 -174.352 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 56.31 -120.65 20.74 Favored Glycine 0 N--CA 1.472 1.072 0 C-N-CA 124.729 1.156 . . . . 0.0 113.733 169.344 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 22.2 m -54.24 -33.24 57.98 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 124.562 1.145 . . . . 0.0 112.912 177.459 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 34.7 m80 -71.24 -41.11 70.54 Favored 'General case' 0 CA--C 1.539 0.551 0 O-C-N 120.895 -1.128 . . . . 0.0 111.34 178.07 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 60.4 tp -63.79 -45.27 90.44 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 123.637 0.775 . . . . 0.0 111.024 172.648 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 31.8 t -60.33 -46.12 95.43 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 C-N-CA 124.33 1.052 . . . . 0.0 110.77 177.808 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -63.87 -45.92 87.27 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 123.198 0.599 . . . . 0.0 111.767 176.409 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.27 -42.18 96.58 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 118.638 0.654 . . . . 0.0 111.897 179.235 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 27.1 tp -66.14 -37.75 86.46 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.075 0.95 . . . . 0.0 111.292 178.825 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 11.8 m-85 -64.67 -42.97 94.99 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 119.248 0.931 . . . . 0.0 112.448 169.109 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 70.2 mt -63.88 -39.09 93.38 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 119.08 0.855 . . . . 0.0 112.226 177.872 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 39.3 t -68.59 -45.55 81.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 124.052 0.941 . . . . 0.0 112.212 174.353 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 16.8 t -84.96 -23.21 28.85 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 114.238 1.199 . . . . 0.0 114.238 -171.915 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 77.38 -157.59 46.44 Favored Glycine 0 CA--C 1.533 1.165 0 C-N-CA 124.857 1.217 . . . . 0.0 112.372 -174.845 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -69.36 -10.86 59.83 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.034 1.334 . . . . 0.0 114.44 -175.083 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 71.1 mtm-85 -67.7 -25.56 65.74 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.698 1.199 . . . . 0.0 113.883 -175.975 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.17 155.18 12.36 Favored Glycine 0 CA--C 1.533 1.204 0 C-N-CA 124.856 1.217 . . . . 0.0 112.74 -175.02 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 22.2 p90 -115.15 170.89 8.03 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.64 1.576 . . . . 0.0 112.619 -177.591 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 45.2 p90 -108.74 152.06 25.36 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.705 1.202 . . . . 0.0 110.003 167.41 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 49.9 t80 -156.98 144.94 19.28 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 123.563 0.745 . . . . 0.0 112.742 -169.59 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 53.8 m -141.1 134.32 14.55 Favored Pre-proline 0 N--CA 1.473 0.707 0 C-N-CA 126.268 1.827 . . . . 0.0 108.361 173.755 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_endo -76.0 -170.48 0.86 Allowed 'Trans proline' 0 CA--C 1.542 0.91 0 C-N-CA 123.261 2.641 . . . . 0.0 111.896 178.339 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 28.4 ttpp . . . . . 0 CA--C 1.544 0.724 0 N-CA-C 114.489 1.292 . . . . 0.0 114.489 -175.336 . . . . . . . . 0 0 . 1 . 032 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 19.5 tt . . . . . 0 N--CA 1.481 1.092 0 N-CA-C 114.498 1.296 . . . . 0.0 114.498 . . . . . . . . . 0 0 . 1 . 032 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 58.0 t -67.68 -39.45 82.17 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.099 0 C-N-CA 123.712 0.805 . . . . 0.0 111.977 -168.16 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.7 pm0 -75.24 -35.49 61.42 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.436 1.094 . . . . 0.0 111.928 171.464 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 11.0 tp60 -74.26 -43.72 55.78 Favored 'General case' 0 CA--C 1.537 0.471 0 O-C-N 121.363 -0.835 . . . . 0.0 111.962 -172.396 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 33.3 m -65.58 -21.08 66.56 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 123.706 0.802 . . . . 0.0 113.072 172.947 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 48.7 t -91.49 -45.75 8.36 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 118.701 0.682 . . . . 0.0 112.09 -178.622 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 49.2 p -76.33 -20.59 57.11 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 125.234 1.413 . . . . 0.0 113.838 179.932 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 7.8 t -143.63 -167.82 2.68 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.733 1.213 . . . . 0.0 110.991 173.653 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 70.3 mt -93.55 132.23 38.29 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 C-N-CA 124.689 1.196 . . . . 0.0 109.052 172.953 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 27.0 p -114.46 164.74 13.55 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.364 1.066 . . . . 0.0 113.305 178.238 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 36.8 t -94.69 152.52 18.41 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 124.802 1.241 . . . . 0.0 112.813 -175.855 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 48.7 mt -60.82 -30.64 70.21 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 121.457 -0.777 . . . . 0.0 111.84 173.724 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 90.9 t80 -60.84 -36.81 80.08 Favored 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 171.788 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 64.6 mt-30 -70.32 -44.56 67.98 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.322 0.649 . . . . 0.0 110.061 176.886 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 98.6 mt -57.77 -42.98 85.2 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.7 0.8 . . . . 0.0 111.958 176.667 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -72.12 -35.09 69.04 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 113.981 1.104 . . . . 0.0 113.981 175.276 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -72.66 -34.77 67.45 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 119.104 0.865 . . . . 0.0 112.958 -177.628 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 27.5 m-85 -80.75 -5.83 57.66 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 113.741 1.015 . . . . 0.0 113.741 173.868 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 8.3 t -76.8 173.32 11.82 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 123.961 0.905 . . . . 0.0 112.785 172.401 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 . . . . . 0 C--O 1.253 1.268 0 C-N-CA 125.363 1.465 . . . . 0.0 114.022 -175.403 . . . . . . . . 0 0 . 1 . 032 nuclear orig core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 54.9 p90 . . . . . 0 N--CA 1.483 1.193 0 N-CA-C 111.232 0.086 . . . . 0.0 111.232 . . . . . . . . . 0 0 . 1 . 032 nuclear orig core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 17.5 m -71.28 145.97 12.12 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.33 0 C-N-CA 123.909 0.884 . . . . 0.0 112.334 -177.308 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 58.91 70.71 0.63 Allowed 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 125.546 1.538 . . . . 0.0 110.98 178.803 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -141.96 166.12 25.59 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 126.869 2.068 . . . . 0.0 110.228 -168.713 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 24.3 m-70 -68.08 131.87 46.21 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 165.008 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 74.9 mt -140.24 115.75 10.06 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 126.224 1.81 . . . . 0.0 109.072 -173.615 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 78.2 m -121.57 143.82 49.08 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.084 1.353 . . . . 0.0 111.544 -178.649 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 48.62 -124.12 11.46 Favored Glycine 0 N--CA 1.473 1.118 0 C-N-CA 125.298 1.428 . . . . 0.0 114.529 169.338 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 18.7 m -53.6 -39.89 65.26 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.444 1.098 . . . . 0.0 113.338 178.559 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 18.6 t60 -72.4 -31.23 65.35 Favored 'General case' 0 CA--C 1.543 0.677 0 O-C-N 120.971 -1.08 . . . . 0.0 112.058 179.655 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 50.3 tp -67.17 -42.87 83.53 Favored 'General case' 0 C--O 1.224 -0.253 0 O-C-N 121.503 -0.748 . . . . 0.0 110.924 168.885 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 77.2 t -60.81 -43.45 95.45 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 CA-C-N 119.029 0.831 . . . . 0.0 111.241 175.983 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 67.2 mt-10 -54.75 -50.91 67.24 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 118.927 0.785 . . . . 0.0 111.087 171.166 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.02 -44.4 92.68 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.681 0.792 . . . . 0.0 112.11 -177.821 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 33.1 mt -56.22 -48.01 77.32 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 124.169 0.988 . . . . 0.0 110.892 176.338 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 14.2 m-85 -65.41 -43.77 89.53 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 119.074 0.852 . . . . 0.0 112.851 177.201 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 76.9 mt -66.85 -42.93 84.87 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 123.608 0.763 . . . . 0.0 112.552 -179.87 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 71.0 t -77.14 -36.65 24.86 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 C-N-CA 124.557 1.143 . . . . 0.0 111.602 -176.741 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 49.8 t -77.57 -31.48 53.17 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 113.875 1.065 . . . . 0.0 113.875 178.017 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 76.95 -140.37 24.78 Favored Glycine 0 CA--C 1.531 1.054 0 C-N-CA 124.072 0.844 . . . . 0.0 112.886 178.041 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 3.6 pm0 -66.46 -16.67 64.29 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 115.416 1.635 . . . . 0.0 115.416 -169.499 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 49.2 mtm180 -62.74 -37.24 85.82 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 118.785 0.721 . . . . 0.0 112.106 174.957 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.62 139.15 1.51 Allowed Glycine 0 CA--C 1.531 1.07 0 C-N-CA 125.809 1.671 . . . . 0.0 113.147 179.139 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 50.1 t80 -71.48 156.86 38.96 Favored 'General case' 0 CA--C 1.545 0.762 0 O-C-N 122.066 -0.667 . . . . 0.0 112.494 177.701 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 89.7 t80 -156.42 -32.29 0.09 Allowed 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 114.723 1.379 . . . . 0.0 114.723 -168.882 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 79.1 t80 -60.78 131.53 50.99 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.281 1.033 . . . . 0.0 113.285 -176.102 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 39.7 p -74.74 145.92 82.38 Favored Pre-proline 0 N--CA 1.477 0.899 0 O-C-N 121.27 -0.894 . . . . 0.0 111.697 -176.807 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -73.32 137.84 26.47 Favored 'Trans proline' 0 N--CA 1.456 -0.706 0 C-N-CA 122.955 2.437 . . . . 0.0 111.332 -178.537 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 45.3 mmtm . . . . . 0 CA--C 1.546 0.809 0 N-CA-C 113.628 0.973 . . . . 0.0 113.628 -177.69 . . . . . . . . 0 0 . 1 . 033 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 7.1 tp . . . . . 0 N--CA 1.488 1.45 0 N-CA-C 110.399 -0.223 . . . . 0.0 110.399 . . . . . . . . . 0 0 . 1 . 033 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 48.4 t -59.21 -35.91 60.29 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 C-N-CA 124.188 0.995 . . . . 0.0 110.957 178.437 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 13.0 pm0 -69.67 -9.28 53.66 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.79 1.236 . . . . 0.0 114.047 177.207 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 25.7 tt0 -99.68 -66.41 0.91 Allowed 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.17 0.988 . . . . 0.0 109.152 169.505 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 50.8 m -71.99 -26.53 62.27 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 115.464 1.654 . . . . 0.0 115.464 -168.928 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 13.4 t -85.43 -44.54 12.66 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 119.304 0.956 . . . . 0.0 110.992 176.924 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 27.3 m -65.63 -40.13 92.21 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 126.086 1.754 . . . . 0.0 111.893 -179.743 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 67.3 m -138.25 172.25 13.19 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.232 1.413 . . . . 0.0 112.0 -174.866 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 43.4 mt -64.98 136.17 27.1 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 O-C-N 120.748 -1.22 . . . . 0.0 110.179 170.666 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 9.6 p -134.51 176.72 8.37 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.235 1.414 . . . . 0.0 111.673 170.793 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 22.9 t -138.03 161.78 35.83 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.556 1.143 . . . . 0.0 112.708 -179.936 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -61.18 -28.88 69.45 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.927 1.291 . . . . 0.0 111.783 -179.932 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 79.9 t80 -63.27 -24.25 67.78 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.68 1.192 . . . . 0.0 113.439 172.954 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 62.8 mt-30 -85.1 -37.43 20.28 Favored 'General case' 0 N--CA 1.469 0.517 0 O-C-N 121.549 -0.719 . . . . 0.0 110.638 171.884 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 27.5 mt -60.97 -33.33 73.04 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 118.965 0.802 . . . . 0.0 113.001 175.532 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.7 mm-40 -50.93 -30.97 16.23 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 124.637 1.175 . . . . 0.0 113.714 169.175 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 -73.93 -19.86 60.55 Favored 'General case' 0 CA--C 1.546 0.82 0 O-C-N 121.09 -1.006 . . . . 0.0 113.101 177.037 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 79.9 m-85 -93.35 -7.19 45.45 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.593 1.557 . . . . 0.0 113.191 176.944 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 33.1 m -74.16 136.44 42.87 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.477 1.111 . . . . 0.0 109.236 167.598 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 9.3 p30 . . . . . 0 C--O 1.253 1.268 0 CA-C-O 118.026 -0.988 . . . . 0.0 113.364 179.293 . . . . . . . . 0 0 . 1 . 033 nuclear orig core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 63.7 m-85 . . . . . 0 N--CA 1.488 1.464 0 CA-C-O 119.051 -0.5 . . . . 0.0 110.299 . . . . . . . . . 0 0 . 1 . 033 nuclear orig core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 27.6 m -61.02 -34.71 61.07 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.367 0 CA-C-N 119.97 1.259 . . . . 0.0 112.616 179.227 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 24.6 m120 -83.87 120.42 26.05 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.429 1.091 . . . . 0.0 109.737 168.93 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 5.4 tt0 -166.76 163.47 16.52 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 124.172 0.989 . . . . 0.0 111.646 -177.014 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 26.4 m-70 -77.48 142.5 39.11 Favored 'General case' 0 CA--C 1.548 0.87 0 N-CA-C 107.631 -1.248 . . . . 0.0 107.631 163.932 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 58.5 mt -139.72 132.53 29.15 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 125.719 1.607 . . . . 0.0 108.557 175.251 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.6 t -144.04 149.33 36.5 Favored 'General case' 0 N--CA 1.47 0.569 0 O-C-N 121.439 -0.788 . . . . 0.0 112.391 -175.054 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.32 -128.01 43.19 Favored Glycine 0 N--CA 1.469 0.855 0 C-N-CA 124.702 1.144 . . . . 0.0 113.515 172.611 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 27.2 p -53.41 -44.99 69.17 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.437 1.095 . . . . 0.0 112.923 177.363 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 12.8 m-70 -67.38 -31.27 71.39 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 120.941 -1.099 . . . . 0.0 113.352 179.255 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 40.6 tp -70.53 -44.34 67.73 Favored 'General case' 0 N--CA 1.466 0.343 0 O-C-N 121.616 -0.677 . . . . 0.0 110.892 171.517 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 54.0 t -59.02 -43.04 88.03 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 C-N-CA 123.585 0.754 . . . . 0.0 111.168 173.692 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -59.43 -44.5 92.9 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 123.864 0.866 . . . . 0.0 111.819 172.229 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.53 -42.44 99.52 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-N 119.062 0.846 . . . . 0.0 111.982 176.467 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -58.48 -46.04 87.45 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 118.79 0.723 . . . . 0.0 111.599 173.162 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 9.5 m-85 -59.12 -46.09 89.23 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 119.024 0.829 . . . . 0.0 112.339 174.28 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 67.8 mt -68.13 -39.64 82.66 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.196 0.998 . . . . 0.0 112.495 -178.229 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 71.9 t -72.23 -53.49 19.54 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 C-N-CA 123.629 0.772 . . . . 0.0 111.213 177.249 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 65.5 m -79.64 -31.69 41.55 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 113.579 0.955 . . . . 0.0 113.579 -170.729 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.5 -133.97 41.76 Favored Glycine 0 CA--C 1.528 0.871 0 C-N-CA 124.094 0.854 . . . . 0.0 111.815 178.09 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -65.32 -14.57 61.09 Favored 'General case' 0 CA--C 1.543 0.673 0 N-CA-C 114.633 1.346 . . . . 0.0 114.633 -179.632 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 88.0 mtm180 -66.43 -40.03 89.25 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 118.775 0.716 . . . . 0.0 112.216 177.981 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.93 170.74 45.0 Favored Glycine 0 CA--C 1.536 1.377 0 C-N-CA 124.225 0.917 . . . . 0.0 112.67 -168.795 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 54.6 p90 -148.03 166.49 27.6 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 114.835 1.42 . . . . 0.0 114.835 -169.272 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -99.65 141.78 32.0 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.495 1.518 . . . . 0.0 110.418 168.49 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 34.7 t80 -158.24 129.54 6.55 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.049 1.34 . . . . 0.0 111.47 177.893 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 29.5 p -149.22 154.51 39.11 Favored Pre-proline 0 N--CA 1.476 0.863 0 C-N-CA 126.403 1.881 . . . . 0.0 110.613 170.556 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_endo -72.05 176.63 8.16 Favored 'Trans proline' 0 C--N 1.354 0.839 0 C-N-CA 124.272 3.315 . . . . 0.0 112.434 178.154 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 77.8 mttt . . . . . 0 CA--C 1.544 0.739 0 N-CA-C 114.43 1.27 . . . . 0.0 114.43 -169.6 . . . . . . . . 0 0 . 1 . 034 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 12.1 tt . . . . . 0 N--CA 1.481 1.088 0 N-CA-C 115.676 1.732 . . . . 0.0 115.676 . . . . . . . . . 0 0 . 1 . 034 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . 0.404 HG12 ' H ' ' B' ' 29' ' ' LYS . 2.7 p -64.46 -29.86 48.56 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.193 0 CA-C-N 120.187 1.358 . . . . 0.0 112.735 175.396 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -73.8 -36.4 64.99 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 118.501 0.591 . . . . 0.0 111.394 173.08 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 32.1 tt0 -76.94 -57.96 3.55 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 124.75 1.22 . . . . 0.0 111.952 -174.988 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 21.0 m -67.14 -21.5 65.82 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 113.892 1.071 . . . . 0.0 113.892 -177.27 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 8.1 t -87.82 -30.15 20.43 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.804 0.841 . . . . 0.0 112.702 179.949 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 28.9 m -88.47 -46.49 9.08 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 125.095 1.358 . . . . 0.0 110.949 177.359 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 49.1 m -113.39 167.66 10.38 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 125.714 1.606 . . . . 0.0 111.473 -176.482 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 62.9 mt -75.08 137.17 23.53 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 O-C-N 120.96 -1.088 . . . . 0.0 108.705 170.429 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.4 p -132.87 173.34 11.49 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.61 1.164 . . . . 0.0 112.816 178.01 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 23.2 t -131.88 166.29 21.94 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 125.313 1.445 . . . . 0.0 112.459 -175.67 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 60.0 mt -57.64 -29.16 64.34 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.781 1.233 . . . . 0.0 112.455 177.94 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 86.9 t80 -61.03 -31.31 70.95 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 124.387 1.075 . . . . 0.0 113.317 173.584 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 33.4 mt-30 -79.19 -33.3 44.02 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 123.731 0.812 . . . . 0.0 110.856 175.309 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 88.2 mt -63.61 -42.72 98.2 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 118.779 0.718 . . . . 0.0 111.553 171.728 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -56.38 -34.81 67.05 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.676 0.79 . . . . 0.0 113.027 174.698 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 17.3 t30 -64.14 -26.63 68.62 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 113.109 0.781 . . . . 0.0 113.109 179.76 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 54.7 m-85 -98.37 1.67 47.2 Favored 'General case' 0 CA--C 1.551 1.007 0 C-N-CA 125.363 1.465 . . . . 0.0 113.826 179.475 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 46.4 t -84.53 174.11 10.28 Favored 'General case' 0 CA--C 1.55 0.942 0 C-N-CA 124.886 1.274 . . . . 0.0 111.223 168.151 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 8.3 p30 . . . . . 0 C--O 1.253 1.251 0 C-N-CA 125.177 1.391 . . . . 0.0 112.042 170.535 . . . . . . . . 0 0 . 1 . 034 nuclear orig core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 15.2 t80 . . . . . 0 N--CA 1.488 1.439 0 CA-C-O 118.912 -0.566 . . . . 0.0 110.03 . . . . . . . . . 0 0 . 1 . 034 nuclear orig core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 30.2 m -65.06 -22.44 31.39 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.341 0 CA-C-N 120.621 1.555 . . . . 0.0 114.433 -174.431 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 23.0 m120 -78.75 118.76 21.13 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.589 1.155 . . . . 0.0 111.545 176.773 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 16.7 tt0 -162.81 164.68 26.05 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.804 1.242 . . . . 0.0 111.096 -179.808 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 97.5 m-70 -79.02 146.62 33.23 Favored 'General case' 0 CA--C 1.544 0.726 0 O-C-N 120.782 -1.199 . . . . 0.0 110.058 167.9 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 83.5 mt -141.24 133.43 27.96 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 125.039 1.335 . . . . 0.0 110.075 175.525 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 5.0 t -153.47 143.26 21.95 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 121.526 -0.734 . . . . 0.0 112.211 -177.319 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 60.36 -133.38 50.37 Favored Glycine 0 CA--C 1.531 1.069 0 C-N-CA 124.377 0.989 . . . . 0.0 112.981 177.375 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.0 m -54.84 -32.76 60.92 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 124.676 1.19 . . . . 0.0 113.16 178.473 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 20.1 m80 -67.71 -43.82 79.15 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.225 -0.922 . . . . 0.0 111.182 177.874 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 59.2 tp -65.1 -44.37 89.04 Favored 'General case' 0 C--N 1.342 0.262 0 C-N-CA 123.587 0.755 . . . . 0.0 111.244 174.072 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 41.0 t -60.45 -45.56 96.64 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 124.173 0.989 . . . . 0.0 110.925 178.431 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -62.98 -47.33 83.63 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 123.469 0.708 . . . . 0.0 111.597 175.65 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.8 -41.9 97.81 Favored 'General case' 0 CA--C 1.542 0.649 0 O-C-N 121.391 -0.818 . . . . 0.0 112.326 179.439 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 30.8 tp -66.76 -37.61 84.96 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.176 0.99 . . . . 0.0 111.086 178.776 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 11.6 m-85 -65.91 -40.93 91.94 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 119.395 0.998 . . . . 0.0 112.45 169.523 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 65.1 mt -64.13 -41.14 97.33 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 119.178 0.899 . . . . 0.0 112.155 176.891 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 41.2 t -70.34 -44.14 77.75 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.954 0 C-N-CA 123.4 0.68 . . . . 0.0 112.468 175.31 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 9.5 t -80.52 -18.29 48.96 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 113.757 1.021 . . . . 0.0 113.757 -175.81 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 71.8 -149.65 45.08 Favored Glycine 0 CA--C 1.527 0.838 0 C-N-CA 125.495 1.521 . . . . 0.0 112.897 174.506 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -62.96 -22.04 66.52 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.21 1.404 . . . . 0.0 113.182 -175.993 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 88.3 mtm-85 -64.46 -33.66 76.39 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.021 0.929 . . . . 0.0 113.126 -179.553 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.29 141.47 0.87 Allowed Glycine 0 CA--C 1.531 1.065 0 C-N-CA 125.323 1.44 . . . . 0.0 112.071 -172.524 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 32.8 p90 -76.06 153.0 36.71 Favored 'General case' 0 CA--C 1.542 0.67 0 O-C-N 121.636 -0.92 . . . . 0.0 113.199 -178.11 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 78.3 t80 -84.97 -24.7 28.19 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.073 1.349 . . . . 0.0 112.641 -179.012 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 52.0 t80 -63.22 158.33 20.35 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 126.42 1.888 . . . . 0.0 115.085 -177.128 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 17.7 p -137.88 132.52 17.25 Favored Pre-proline 0 N--CA 1.471 0.615 0 C-N-CA 126.274 1.83 . . . . 0.0 108.765 168.315 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -79.57 162.33 24.71 Favored 'Trans proline' 0 N--CA 1.46 -0.483 0 C-N-CA 122.936 2.424 . . . . 0.0 111.948 -177.057 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . 0.404 ' H ' HG12 ' A' ' 3' ' ' VAL . 59.5 mtpt . . . . . 0 CA--C 1.547 0.86 0 C-N-CA 124.872 1.269 . . . . 0.0 114.41 179.956 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . 0.411 ' HB ' ' CD2' ' A' ' 19' ' ' TYR . 7.7 tp . . . . . 0 N--CA 1.476 0.842 0 N-CA-C 114.716 1.376 . . . . 0.0 114.716 . . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 11.0 p -58.81 -57.1 12.65 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 N-CA-C 112.878 0.696 . . . . 0.0 112.878 -168.44 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 67.0 mt-10 -73.33 -30.23 63.2 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 119.854 1.206 . . . . 0.0 112.205 177.013 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 26.5 tt0 -62.59 -32.62 73.65 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.957 0.903 . . . . 0.0 112.114 -178.934 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 62.0 m -94.61 -27.05 16.11 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 114.505 1.298 . . . . 0.0 114.505 170.701 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 60.8 m -72.37 -64.81 0.87 Allowed 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 120.229 1.377 . . . . 0.0 112.181 178.99 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 40.4 p -87.8 -15.29 37.31 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.131 0.972 . . . . 0.0 113.538 -171.523 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 68.6 m -122.03 167.78 12.71 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.967 1.307 . . . . 0.0 111.72 171.86 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 72.3 mt -79.61 135.35 25.75 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 124.275 1.03 . . . . 0.0 109.352 173.753 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 11.9 p -130.69 163.83 26.37 Favored 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 113.905 1.076 . . . . 0.0 113.905 178.15 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 35.1 t -111.23 159.3 18.03 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.99 1.716 . . . . 0.0 112.346 179.726 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 53.6 mt -60.47 -27.97 67.96 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.81 0.844 . . . . 0.0 111.555 174.108 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 85.9 t80 -62.24 -30.56 71.19 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.283 1.033 . . . . 0.0 113.088 172.456 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 68.3 mt-30 -81.55 -31.06 32.85 Favored 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 123.548 0.739 . . . . 0.0 110.969 174.877 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 66.3 mt -63.74 -43.15 97.35 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 118.968 0.804 . . . . 0.0 111.494 169.657 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -55.98 -35.26 66.55 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.665 1.186 . . . . 0.0 113.526 175.025 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -60.31 -31.08 69.93 Favored 'General case' 0 CA--C 1.547 0.836 0 O-C-N 121.505 -0.747 . . . . 0.0 112.38 178.112 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.411 ' CD2' ' HB ' ' A' ' 2' ' ' ILE . 92.0 m-85 -103.39 10.11 37.52 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.762 1.225 . . . . 0.0 114.163 -177.721 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 76.0 m -73.46 150.74 41.41 Favored 'General case' 0 N--CA 1.468 0.452 0 O-C-N 121.462 -0.774 . . . . 0.0 110.977 167.89 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 21.9 t-20 . . . . . 0 C--O 1.254 1.318 0 C-N-CA 124.385 1.074 . . . . 0.0 113.132 176.336 . . . . . . . . 0 0 . 1 . 035 nuclear orig core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 83.1 m-85 . . . . . 0 N--CA 1.487 1.376 0 CA-C-O 117.993 -1.003 . . . . 0.0 110.916 . . . . . . . . . 0 0 . 1 . 035 nuclear orig core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 8.7 p -66.39 145.97 13.53 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.276 0 CA-C-N 120.576 1.534 . . . . 0.0 112.051 179.67 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 2.2 t30 58.57 63.8 1.61 Allowed 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 126.177 1.791 . . . . 0.0 111.311 175.874 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 -151.87 160.87 43.39 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.943 0.897 . . . . 0.0 111.83 -169.528 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 68.5 m-70 -76.59 138.14 39.95 Favored 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 164.824 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 66.3 mt -142.37 123.26 14.39 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 126.018 1.727 . . . . 0.0 108.759 177.484 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 5.6 t -141.36 149.92 41.77 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 121.36 -0.837 . . . . 0.0 112.729 -175.082 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.69 -128.42 44.86 Favored Glycine 0 N--CA 1.47 0.916 0 C-N-CA 124.261 0.934 . . . . 0.0 112.718 174.964 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.5 m -53.63 -37.98 63.61 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.681 1.192 . . . . 0.0 112.986 176.782 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 42.4 m-70 -70.59 -35.59 73.11 Favored 'General case' 0 CA--C 1.539 0.521 0 O-C-N 120.977 -1.077 . . . . 0.0 112.242 179.421 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 44.2 tp -67.62 -40.98 84.66 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 123.297 0.639 . . . . 0.0 111.28 171.724 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 25.5 t -59.52 -46.79 92.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 124.338 1.055 . . . . 0.0 111.266 172.789 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -61.19 -46.19 91.48 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 123.773 0.829 . . . . 0.0 111.567 175.077 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.06 -41.06 99.37 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 121.61 -0.681 . . . . 0.0 112.017 179.021 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 43.6 mt -65.92 -40.3 91.34 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 118.487 -0.768 . . . . 0.0 111.81 175.1 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 16.6 m-85 -61.57 -38.78 88.75 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 120.381 1.446 . . . . 0.0 112.765 171.41 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 76.4 mt -68.09 -44.54 76.01 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.801 0.84 . . . . 0.0 112.297 176.422 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 55.2 t -74.07 -45.68 47.57 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 C-N-CA 123.479 0.712 . . . . 0.0 112.232 -179.027 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 49.6 m -84.58 -26.59 27.86 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 113.786 1.032 . . . . 0.0 113.786 -173.789 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 71.81 -149.21 44.4 Favored Glycine 0 CA--C 1.531 1.076 0 C-N-CA 124.576 1.084 . . . . 0.0 112.092 -174.435 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -62.28 -19.82 63.64 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.116 1.366 . . . . 0.0 113.419 -178.815 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 62.7 mtm180 -58.79 -35.55 73.0 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.536 1.134 . . . . 0.0 113.21 178.495 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.68 -173.09 55.32 Favored Glycine 0 CA--C 1.53 1.011 0 C-N-CA 124.282 0.944 . . . . 0.0 113.199 -172.333 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 37.6 p90 -146.69 162.79 37.76 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 126.078 1.751 . . . . 0.0 112.571 -169.114 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 61.6 m-85 -89.95 -27.67 19.66 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 114.193 1.182 . . . . 0.0 114.193 -177.042 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 4.1 t80 57.03 31.46 19.95 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 125.059 1.344 . . . . 0.0 113.183 -179.633 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 38.4 m -47.17 123.12 8.16 Favored Pre-proline 0 CA--C 1.543 0.682 0 C-N-CA 126.276 1.83 . . . . 0.0 112.324 -168.959 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_exo -61.35 178.05 0.69 Allowed 'Trans proline' 0 C--N 1.352 0.714 0 C-N-CA 124.754 3.636 . . . . 0.0 115.292 179.216 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 17.3 ptmt . . . . . 0 CA--C 1.547 0.842 0 N-CA-C 114.956 1.465 . . . . 0.0 114.956 174.801 . . . . . . . . 0 0 . 1 . 036 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 19.1 tt . . . . . 0 N--CA 1.478 0.946 0 CA-C-O 118.936 -0.554 . . . . 0.0 112.44 . . . . . . . . . 0 0 . 1 . 036 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 72.2 t -56.31 -58.73 4.24 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 123.743 0.817 . . . . 0.0 111.878 -169.289 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -81.47 -20.47 40.18 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 -179.526 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 11.9 tp60 -69.2 -43.95 73.11 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 119.413 1.006 . . . . 0.0 111.338 177.268 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 46.8 m -67.23 -26.7 66.72 Favored 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 172.732 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 77.5 m -71.83 -56.54 5.55 Favored 'General case' 0 CA--C 1.543 0.675 0 O-C-N 121.016 -1.052 . . . . 0.0 111.193 172.985 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 46.6 p -75.16 -22.79 57.85 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 125.264 1.426 . . . . 0.0 113.98 -170.715 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 6.2 t -144.13 178.99 7.49 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 122.641 1.21 . . . . 0.0 112.411 175.586 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 17.6 mm -70.19 129.49 34.38 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.676 0 C-N-CA 125.439 1.496 . . . . 0.0 109.188 174.353 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 10.2 p -128.54 155.87 44.19 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.157 0.983 . . . . 0.0 112.448 174.576 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 75.3 p -103.84 164.04 11.95 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 114.946 1.462 . . . . 0.0 114.946 -169.741 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 10.5 mp -65.39 -27.56 68.65 Favored 'General case' 0 CA--C 1.539 0.551 0 O-C-N 121.185 -0.947 . . . . 0.0 111.651 172.09 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 89.6 t80 -64.52 -34.05 77.32 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 121.653 -0.654 . . . . 0.0 112.568 170.788 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 67.2 mt-30 -72.6 -39.52 67.25 Favored 'General case' 0 N--CA 1.47 0.543 0 O-C-N 121.62 -0.675 . . . . 0.0 111.289 171.581 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 94.5 mt -61.22 -43.73 98.41 Favored 'General case' 0 CA--C 1.545 0.757 0 CA-C-N 119.322 0.965 . . . . 0.0 111.727 174.089 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 40.0 mm-40 -55.5 -40.82 72.22 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 125.538 1.535 . . . . 0.0 112.806 171.551 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 17.0 t-20 -63.46 -23.02 67.22 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 113.419 0.896 . . . . 0.0 113.419 -177.965 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 64.2 m-85 -102.22 3.26 38.11 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 125.455 1.502 . . . . 0.0 114.194 176.785 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 85.2 m -66.64 146.77 54.12 Favored 'General case' 0 CA--C 1.544 0.732 0 O-C-N 121.235 -0.916 . . . . 0.0 110.402 167.934 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 . . . . . 0 C--O 1.255 1.386 0 C-N-CA 124.758 1.223 . . . . 0.0 113.083 -174.511 . . . . . . . . 0 0 . 1 . 036 nuclear orig core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 72.1 m-85 . . . . . 0 N--CA 1.484 1.238 0 CA-C-O 119.39 -0.338 . . . . 0.0 110.725 . . . . . . . . . 0 0 . 1 . 036 nuclear orig core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 13.4 p -84.36 115.97 27.3 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.012 0 C-N-CA 123.834 0.854 . . . . 0.0 111.08 -178.134 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -174.0 143.68 0.95 Allowed 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.566 1.546 . . . . 0.0 111.978 -171.956 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 29.3 mm-40 -154.58 169.27 24.24 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 125.503 1.521 . . . . 0.0 111.017 -174.307 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 51.5 m-70 -77.91 135.13 37.82 Favored 'General case' 0 CA--C 1.548 0.868 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 166.273 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 86.1 mt -140.54 124.75 17.57 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 125.404 1.482 . . . . 0.0 109.273 -179.485 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 5.2 t -142.21 142.41 32.65 Favored 'General case' 0 N--CA 1.469 0.494 0 O-C-N 121.485 -0.76 . . . . 0.0 112.84 -174.908 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 56.94 -126.61 42.42 Favored Glycine 0 CA--C 1.53 1.005 0 C-N-CA 124.598 1.094 . . . . 0.0 113.148 175.527 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 22.1 p -54.68 -38.07 66.52 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.411 1.085 . . . . 0.0 112.934 176.46 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 20.3 t-160 -68.95 -36.39 77.88 Favored 'General case' 0 CA--C 1.543 0.701 0 O-C-N 120.832 -1.168 . . . . 0.0 111.55 179.235 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 58.9 tp -67.99 -43.18 79.48 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 123.524 0.73 . . . . 0.0 111.361 172.083 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 28.8 t -59.26 -45.82 92.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 C-N-CA 124.31 1.044 . . . . 0.0 110.769 175.517 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -63.57 -44.05 95.23 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 118.621 0.646 . . . . 0.0 112.106 174.385 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.36 -41.71 94.24 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 119.254 0.934 . . . . 0.0 112.096 176.619 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 58.1 mt -63.58 -41.61 98.35 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 123.419 0.687 . . . . 0.0 111.749 174.546 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 14.0 m-85 -59.04 -45.94 89.49 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 119.761 1.164 . . . . 0.0 112.445 171.247 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 9.0 mp -67.55 -43.78 79.86 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.785 0.834 . . . . 0.0 112.35 -179.626 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 52.7 t -70.93 -49.37 50.44 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 CA-C-N 118.549 0.613 . . . . 0.0 111.456 -179.959 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 63.3 m -77.35 -33.23 55.43 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 113.371 0.878 . . . . 0.0 113.371 -174.189 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 65.36 -135.4 36.51 Favored Glycine 0 CA--C 1.529 0.907 0 C-N-CA 124.211 0.91 . . . . 0.0 111.781 178.573 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -64.09 -15.33 59.39 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 114.287 1.218 . . . . 0.0 114.287 -179.398 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 89.3 mtm180 -67.17 -36.6 82.14 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.896 0.878 . . . . 0.0 112.596 177.622 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.99 -177.41 50.23 Favored Glycine 0 CA--C 1.533 1.172 0 C-N-CA 124.391 0.996 . . . . 0.0 112.406 -169.657 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 46.5 p90 -159.85 174.45 14.43 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 125.058 1.343 . . . . 0.0 113.556 -172.039 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 27.9 t80 -142.89 125.03 15.35 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.189 0.996 . . . . 0.0 110.206 168.761 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 48.7 p90 -90.31 132.22 35.67 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 124.989 1.315 . . . . 0.0 112.096 -179.121 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 64.1 m -122.85 122.82 27.0 Favored Pre-proline 0 N--CA 1.479 0.996 0 C-N-CA 123.887 0.875 . . . . 0.0 111.648 -172.585 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_endo -91.46 177.56 1.89 Allowed 'Trans proline' 0 CA--C 1.539 0.767 0 C-N-CA 125.126 3.884 . . . . 0.0 112.263 172.959 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 88.8 tttt . . . . . 0 N--CA 1.474 0.763 0 C-N-CA 126.08 1.752 . . . . 0.0 113.805 174.896 . . . . . . . . 0 0 . 1 . 037 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 19.1 tt . . . . . 0 N--CA 1.481 1.082 0 N-CA-C 113.629 0.974 . . . . 0.0 113.629 . . . . . . . . . 0 0 . 1 . 037 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 55.9 t -57.54 -29.38 33.84 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 172.805 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -89.96 -35.48 15.54 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 118.978 0.808 . . . . 0.0 112.463 169.656 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -69.27 -41.21 77.18 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 121.84 -0.538 . . . . 0.0 112.299 -171.93 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.3 m -74.75 -21.98 59.04 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 113.118 0.784 . . . . 0.0 113.118 172.174 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 17.1 t -89.38 -46.81 8.45 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.427 0.691 . . . . 0.0 112.489 -171.585 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 85.7 m -82.72 -44.35 15.74 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 125.393 1.477 . . . . 0.0 111.326 178.039 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 68.8 m -106.09 172.95 6.53 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 124.4 1.08 . . . . 0.0 111.813 177.53 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 22.6 mm -73.91 144.55 12.41 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 O-C-N 120.89 -1.131 . . . . 0.0 110.108 171.285 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 11.8 p -134.9 -177.03 4.44 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 113.751 1.019 . . . . 0.0 113.751 170.601 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 79.3 p -147.76 164.58 33.17 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 125.382 1.473 . . . . 0.0 112.5 -169.172 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 10.9 mp -61.89 -29.33 70.13 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 121.416 -0.803 . . . . 0.0 112.423 -177.416 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 90.3 t80 -63.01 -37.0 85.45 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 123.44 0.696 . . . . 0.0 112.483 172.773 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 58.6 mt-30 -74.9 -36.56 62.23 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 123.786 0.835 . . . . 0.0 111.052 175.461 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 94.9 mt -61.83 -48.48 80.38 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 118.728 0.695 . . . . 0.0 111.279 172.97 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 19.6 mm-40 -60.97 -34.56 74.95 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.208 1.003 . . . . 0.0 113.268 176.691 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 17.0 t30 -57.76 -28.01 63.56 Favored 'General case' 0 CA--C 1.547 0.85 0 O-C-N 121.013 -1.054 . . . . 0.0 113.028 178.209 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 71.0 m-85 -103.08 6.89 38.88 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.183 1.393 . . . . 0.0 113.906 177.445 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 98.9 m -92.27 160.64 15.05 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.134 0.974 . . . . 0.0 112.994 171.12 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 . . . . . 0 C--O 1.253 1.267 0 N-CA-C 113.55 0.944 . . . . 0.0 113.55 -173.078 . . . . . . . . 0 0 . 1 . 037 nuclear orig core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 62.5 t80 . . . . . 0 N--CA 1.488 1.456 0 N-CA-C 110.175 -0.305 . . . . 0.0 110.175 . . . . . . . . . 0 0 . 1 . 037 nuclear orig core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 9.4 p -66.23 145.99 13.52 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.2 0 O-C-N 121.344 -0.847 . . . . 0.0 111.891 179.119 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 1.9 t30 61.33 58.63 2.11 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.186 1.394 . . . . 0.0 111.288 177.091 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -150.43 164.17 36.57 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.022 1.329 . . . . 0.0 110.473 -176.088 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 97.7 m-70 -80.08 145.54 32.38 Favored 'General case' 0 CA--C 1.549 0.908 0 O-C-N 121.224 -0.923 . . . . 0.0 111.044 170.658 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 80.8 mt -142.57 139.71 31.47 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.988 1.715 . . . . 0.0 110.069 173.78 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.0 t -151.65 145.77 25.32 Favored 'General case' 0 N--CA 1.471 0.604 0 O-C-N 121.316 -0.865 . . . . 0.0 112.056 -177.345 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 54.42 -124.22 30.5 Favored Glycine 0 CA--C 1.529 0.964 0 C-N-CA 124.549 1.071 . . . . 0.0 113.385 172.829 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 71.8 p -55.09 -35.61 64.77 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 124.892 1.277 . . . . 0.0 113.463 177.458 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 4.2 m80 -75.52 -37.18 60.25 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 121.503 -0.748 . . . . 0.0 111.112 -179.078 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 54.3 tp -64.98 -45.38 85.9 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 123.437 0.695 . . . . 0.0 111.308 171.573 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 22.2 t -59.37 -46.81 92.28 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.913 0 C-N-CA 124.747 1.219 . . . . 0.0 111.275 175.555 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -63.61 -43.52 96.63 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.315 0.646 . . . . 0.0 111.767 177.105 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.17 -44.35 96.81 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.35 0.66 . . . . 0.0 111.837 176.65 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 44.4 mt -58.76 -43.66 90.41 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 123.024 0.53 . . . . 0.0 111.635 175.808 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 20.4 m-85 -63.95 -43.68 95.1 Favored 'General case' 0 CA--C 1.544 0.717 0 O-C-N 121.343 -0.848 . . . . 0.0 112.629 174.2 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 76.5 mt -67.44 -41.28 85.0 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 123.674 0.79 . . . . 0.0 112.641 179.589 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 61.6 t -73.55 -46.96 46.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 124.359 1.064 . . . . 0.0 111.58 -178.159 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 58.8 m -98.9 -16.47 18.8 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 115.389 1.626 . . . . 0.0 115.389 -169.312 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 73.97 -148.5 39.73 Favored Glycine 0 CA--C 1.531 1.061 0 C-N-CA 124.309 0.957 . . . . 0.0 113.431 177.896 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 2.9 pm0 -67.02 -11.42 56.99 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.633 1.573 . . . . 0.0 114.541 -176.35 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 40.2 mtp180 -57.71 -36.03 71.45 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 125.02 1.328 . . . . 0.0 112.789 172.359 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.5 175.48 30.77 Favored Glycine 0 CA--C 1.529 0.928 0 C-N-CA 124.288 0.947 . . . . 0.0 113.663 -176.935 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 37.6 p90 -120.52 153.45 36.67 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.967 1.307 . . . . 0.0 113.064 -176.801 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 57.1 m-85 -127.59 38.55 4.03 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 127.74 2.416 . . . . 0.0 109.327 -179.119 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.84 151.1 43.27 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.899 1.68 . . . . 0.0 115.348 -170.405 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 18.9 p -97.86 134.79 21.92 Favored Pre-proline 0 N--CA 1.473 0.7 0 C-N-CA 124.72 1.208 . . . . 0.0 111.76 -175.215 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -76.55 173.84 13.82 Favored 'Trans proline' 0 C--N 1.351 0.68 0 C-N-CA 124.442 3.428 . . . . 0.0 112.17 -175.093 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.546 0.794 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 173.619 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 10.8 tp . . . . . 0 N--CA 1.487 1.389 0 N-CA-C 113.951 1.093 . . . . 0.0 113.951 . . . . . . . . . 0 0 . 1 . 038 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 6.4 t -70.11 -21.11 23.49 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.276 0 C-N-CA 124.593 1.157 . . . . 0.0 112.682 -179.819 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -86.98 -48.03 8.46 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 123.784 0.834 . . . . 0.0 109.227 167.789 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 33.5 tt0 -65.33 -43.47 90.82 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 124.968 1.307 . . . . 0.0 113.87 -167.569 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 67.2 m -73.83 -12.7 60.76 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 113.545 0.942 . . . . 0.0 113.545 173.959 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 15.1 t -104.66 -43.55 5.1 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.955 1.302 . . . . 0.0 113.353 -168.863 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 81.5 p -85.84 -28.36 24.5 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 124.951 1.3 . . . . 0.0 112.279 175.328 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 5.5 t -126.39 -169.55 2.04 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.319 1.447 . . . . 0.0 111.035 170.107 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 6.5 tt -98.37 147.73 6.56 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.513 0 C-N-CA 125.08 1.352 . . . . 0.0 110.719 177.353 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 17.5 p -133.63 150.36 51.58 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 113.889 1.07 . . . . 0.0 113.889 -178.698 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 34.2 t -91.59 160.92 15.15 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 125.826 1.65 . . . . 0.0 112.276 178.195 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 10.0 mp -59.09 -29.18 67.16 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.357 1.063 . . . . 0.0 111.54 171.303 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 94.6 t80 -60.99 -37.72 83.47 Favored 'General case' 0 CA--C 1.54 0.56 0 O-C-N 121.55 -0.719 . . . . 0.0 112.786 171.546 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 37.0 mt-30 -74.73 -38.33 62.3 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 123.413 0.685 . . . . 0.0 110.45 177.618 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 95.5 mt -60.71 -43.77 97.4 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 123.467 0.707 . . . . 0.0 111.795 173.579 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -68.63 -35.28 77.09 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 113.518 0.932 . . . . 0.0 113.518 173.314 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -63.68 -32.18 73.58 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-N 119.535 1.061 . . . . 0.0 113.105 -177.627 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 41.4 m-85 -86.61 -1.97 58.11 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 124.786 1.234 . . . . 0.0 113.89 172.491 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 6.5 t -86.95 172.44 10.03 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 124.27 1.028 . . . . 0.0 112.542 171.47 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 19.8 m120 . . . . . 0 C--O 1.253 1.265 0 C-N-CA 125.68 1.592 . . . . 0.0 112.878 176.564 . . . . . . . . 0 0 . 1 . 038 nuclear orig core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 65.2 m-85 . . . . . 0 N--CA 1.489 1.51 0 N-CA-C 111.343 0.127 . . . . 0.0 111.343 . . . . . . . . . 0 0 . 1 . 038 nuclear orig core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 32.6 m -76.13 -6.11 8.32 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.388 0 C-N-CA 124.65 1.18 . . . . 0.0 114.08 -179.829 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 4.0 m120 -63.37 146.37 53.67 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.739 1.216 . . . . 0.0 113.036 -174.399 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 44.2 mt-30 -142.4 157.92 44.26 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.159 1.384 . . . . 0.0 111.868 -177.833 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 84.9 m-70 -95.03 126.47 40.39 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 108.166 -1.05 . . . . 0.0 108.166 167.197 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 54.5 mt -144.58 138.68 27.63 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 125.137 1.375 . . . . 0.0 109.862 -172.395 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 1.8 t -154.99 151.99 29.13 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 123.358 0.663 . . . . 0.0 111.664 -179.169 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 57.69 -133.11 52.8 Favored Glycine 0 CA--C 1.532 1.106 0 C-N-CA 124.336 0.969 . . . . 0.0 113.434 175.303 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 23.3 p -54.22 -43.22 70.62 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.734 1.214 . . . . 0.0 112.968 179.03 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 15.7 m-70 -67.15 -32.37 73.42 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 120.848 -1.157 . . . . 0.0 112.912 179.446 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 57.4 tp -68.91 -41.88 77.61 Favored 'General case' 0 N--CA 1.468 0.438 0 O-C-N 121.742 -0.599 . . . . 0.0 111.473 170.343 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 55.6 t -60.39 -44.59 96.4 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 CA-C-N 118.813 0.733 . . . . 0.0 110.864 175.457 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -58.4 -50.67 72.83 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 123.879 0.872 . . . . 0.0 111.354 172.049 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.91 -42.36 99.76 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.705 0.802 . . . . 0.0 112.432 -177.677 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 60.5 mt -57.73 -45.5 85.71 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 119.035 0.834 . . . . 0.0 111.087 175.399 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 25.8 m-85 -66.96 -41.0 87.65 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 118.868 0.758 . . . . 0.0 112.763 176.152 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 75.8 mt -67.42 -43.99 79.84 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 123.808 0.843 . . . . 0.0 112.417 178.793 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 67.7 t -76.68 -38.83 31.06 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 124.417 1.087 . . . . 0.0 111.749 -175.923 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 28.8 t -80.86 -26.22 37.1 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 113.266 0.839 . . . . 0.0 113.266 178.665 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 79.2 -153.85 38.12 Favored Glycine 0 CA--C 1.528 0.881 0 C-N-CA 124.731 1.158 . . . . 0.0 112.78 179.311 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -61.35 -14.29 26.23 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 115.196 1.554 . . . . 0.0 115.196 -174.228 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 49.8 mtp180 -54.22 -48.64 70.85 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 125.159 1.384 . . . . 0.0 112.24 171.192 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.74 145.85 0.9 Allowed Glycine 0 CA--C 1.533 1.21 0 C-N-CA 125.217 1.389 . . . . 0.0 112.604 -174.881 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 14.9 p90 -98.08 166.48 11.4 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 123.924 0.89 . . . . 0.0 112.2 175.797 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 69.9 t80 -151.87 119.36 6.03 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.356 1.462 . . . . 0.0 109.295 170.314 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 54.7 t80 -161.53 148.06 14.27 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 124.142 0.977 . . . . 0.0 112.39 -172.519 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 38.2 m -86.2 117.19 68.28 Favored Pre-proline 0 N--CA 1.474 0.733 0 C-N-CA 125.191 1.397 . . . . 0.0 109.639 178.103 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -74.63 165.58 31.26 Favored 'Trans proline' 0 CA--C 1.537 0.645 0 C-N-CA 123.375 2.717 . . . . 0.0 111.869 -176.84 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 64.4 pttt . . . . . 0 N--CA 1.477 0.894 0 N-CA-C 114.23 1.196 . . . . 0.0 114.23 -176.597 . . . . . . . . 0 0 . 1 . 039 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 8.5 tp . . . . . 0 N--CA 1.484 1.269 0 N-CA-C 116.257 1.947 . . . . 0.0 116.257 . . . . . . . . . 0 0 . 1 . 039 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 67.6 t -68.71 -43.49 82.99 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 CA-C-N 118.619 0.645 . . . . 0.0 112.253 -171.896 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -75.45 -38.22 59.82 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 118.109 0.413 . . . . 0.0 111.505 170.372 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 52.3 tt0 -67.24 -43.53 81.73 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 125.129 1.372 . . . . 0.0 113.587 -171.058 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 41.6 m -70.04 -20.4 63.25 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 173.166 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 23.1 t -99.36 -38.2 8.93 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 118.929 0.786 . . . . 0.0 112.592 -171.972 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 67.5 p -86.74 -20.46 27.64 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 125.496 1.518 . . . . 0.0 113.416 176.412 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.5 t -138.88 -170.68 2.91 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.238 1.415 . . . . 0.0 110.725 174.361 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 78.0 mt -91.58 135.31 27.38 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 C-N-CA 124.884 1.273 . . . . 0.0 108.987 176.229 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 15.2 p -121.97 -176.11 3.26 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.217 1.007 . . . . 0.0 112.016 172.189 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 95.7 p -143.48 165.39 27.68 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 125.046 1.339 . . . . 0.0 112.294 -172.671 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 43.0 mt -58.17 -33.23 69.01 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.238 0.615 . . . . 0.0 112.106 177.731 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 71.9 t80 -65.75 -28.94 69.4 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.139 0.976 . . . . 0.0 113.23 174.25 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 54.2 mt-30 -80.1 -32.7 39.15 Favored 'General case' 0 CA--C 1.538 0.483 0 O-C-N 121.509 -0.744 . . . . 0.0 111.321 173.175 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 91.0 mt -65.94 -44.32 85.43 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 118.888 0.767 . . . . 0.0 111.495 171.763 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.0 mm-40 -52.14 -38.04 56.31 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 125.661 1.584 . . . . 0.0 112.959 172.648 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.9 t30 -62.05 -24.38 67.05 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 113.373 0.879 . . . . 0.0 113.373 -178.64 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 79.0 m-85 -105.6 12.63 30.99 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.441 1.496 . . . . 0.0 113.929 179.456 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 78.3 m -82.14 164.58 21.2 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 123.855 0.862 . . . . 0.0 110.722 167.201 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 13.8 m120 . . . . . 0 C--O 1.254 1.295 0 CA-C-O 118.243 -0.884 . . . . 0.0 112.432 170.917 . . . . . . . . 0 0 . 1 . 039 nuclear orig core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 47.9 t80 . . . . . 0 N--CA 1.486 1.351 0 CA-C-O 119.705 -0.188 . . . . 0.0 110.612 . . . . . . . . . 0 0 . 1 . 039 nuclear orig core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 27.6 m -64.35 -24.4 35.58 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 N-CA-C 114.513 1.301 . . . . 0.0 114.513 -173.147 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 16.8 m120 -128.19 127.74 43.49 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 126.167 1.787 . . . . 0.0 109.095 169.825 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 3.3 tt0 -169.92 166.35 9.43 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 119.139 0.881 . . . . 0.0 112.948 -170.283 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 99.4 m-70 -85.97 142.74 28.58 Favored 'General case' 0 CA--C 1.549 0.931 0 N-CA-C 108.412 -0.959 . . . . 0.0 108.412 164.198 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 75.9 mt -145.73 126.75 14.6 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 126.092 1.757 . . . . 0.0 109.477 176.098 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 92.4 m -124.92 146.04 49.54 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 125.135 1.374 . . . . 0.0 111.253 179.474 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 45.95 -122.11 5.71 Favored Glycine 0 N--CA 1.473 1.127 0 C-N-CA 125.314 1.435 . . . . 0.0 115.021 168.568 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 67.8 p -52.42 -40.11 61.78 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 125.034 1.334 . . . . 0.0 113.301 -179.931 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 2.2 m80 -70.84 -37.92 73.18 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.217 -0.927 . . . . 0.0 111.019 -177.933 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 60.6 tp -66.11 -45.0 82.66 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.346 0.658 . . . . 0.0 111.49 171.915 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 53.2 t -61.54 -43.42 96.89 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 C-N-CA 123.802 0.841 . . . . 0.0 110.99 178.766 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -65.58 -41.66 92.64 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 118.767 0.712 . . . . 0.0 112.332 173.016 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.76 -41.79 96.14 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 119.667 1.122 . . . . 0.0 112.111 174.938 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 54.8 mt -61.21 -44.24 97.6 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 123.524 0.729 . . . . 0.0 111.317 173.627 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 13.9 m-30 -58.86 -43.41 90.84 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 119.495 1.043 . . . . 0.0 112.025 175.138 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 8.3 mp -67.46 -45.45 75.94 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 124.083 0.953 . . . . 0.0 112.427 177.28 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 45.5 t -69.4 -48.71 65.62 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 C-N-CA 123.351 0.661 . . . . 0.0 111.637 -178.506 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 62.6 m -70.6 -39.0 74.06 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 118.53 0.605 . . . . 0.0 112.281 -176.936 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.58 -137.76 42.38 Favored Glycine 0 CA--C 1.527 0.815 0 C-N-CA 124.281 0.944 . . . . 0.0 112.347 176.863 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -63.94 -15.84 60.09 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 114.549 1.314 . . . . 0.0 114.549 -177.861 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 91.6 mtm180 -67.1 -35.13 79.13 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 123.818 0.847 . . . . 0.0 112.727 175.994 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 94.44 154.2 30.8 Favored Glycine 0 CA--C 1.533 1.212 0 C-N-CA 125.34 1.448 . . . . 0.0 113.322 -172.401 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 53.7 p90 -93.41 153.84 18.28 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 125.946 1.698 . . . . 0.0 111.326 176.962 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 20.4 t80 -144.06 21.12 1.76 Allowed 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 124.302 1.041 . . . . 0.0 112.953 -173.483 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 17.3 p90 -65.89 147.25 53.66 Favored 'General case' 0 CA--C 1.55 0.951 0 O-C-N 120.715 -1.241 . . . . 0.0 113.181 178.067 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' B' B ' 27' ' ' THR . . . . . 0.491 ' H ' ' CD ' ' B' ' 28' ' ' PRO . 74.3 p -139.81 -26.98 0.01 OUTLIER Pre-proline 0 N--CA 1.479 1.009 0 CA-C-O 115.532 -2.175 . . . . 0.0 116.105 178.436 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . 0.491 ' CD ' ' H ' ' B' ' 27' ' ' THR . 94.5 Cg_exo -54.72 144.61 64.41 Favored 'Trans proline' 0 C--N 1.361 1.201 0 C-N-CA 122.969 2.446 . . . . 0.0 114.277 -177.207 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 58.0 tttt . . . . . 0 CA--C 1.557 1.235 0 C-N-CA 127.818 2.447 . . . . 0.0 116.509 178.992 . . . . . . . . 0 0 . 1 . 040 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 10.3 tp . . . . . 0 N--CA 1.481 1.109 0 N-CA-C 113.997 1.11 . . . . 0.0 113.997 . . . . . . . . . 0 0 . 1 . 040 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 9.9 p -64.82 -34.49 70.59 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.295 0 CA-C-N 119.54 1.064 . . . . 0.0 112.587 -176.338 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 26.6 pt-20 -71.57 -3.69 22.82 Favored 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 113.95 1.092 . . . . 0.0 113.95 174.472 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 53.6 tp60 -104.05 -58.62 1.85 Allowed 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.165 0.986 . . . . 0.0 109.042 167.906 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 58.9 m -68.99 -25.99 64.79 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 114.701 1.371 . . . . 0.0 114.701 -169.524 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 11.7 t -80.85 -39.89 25.76 Favored 'General case' 0 N--CA 1.472 0.631 0 O-C-N 121.57 -0.706 . . . . 0.0 112.22 -175.744 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 24.5 p -95.1 -31.09 13.72 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 126.238 1.815 . . . . 0.0 112.686 -177.498 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 10.7 t -129.35 -169.75 2.16 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.975 1.71 . . . . 0.0 110.761 178.27 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 33.2 mm -87.92 146.71 5.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 C-N-CA 125.049 1.34 . . . . 0.0 111.273 -174.381 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 4.1 m -124.27 159.23 30.69 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 122.637 1.208 . . . . 0.0 114.006 170.742 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 17.7 t -130.78 157.23 43.4 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 127.598 2.359 . . . . 0.0 110.533 173.884 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 17.5 mt -59.7 -26.05 65.28 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 114.284 1.216 . . . . 0.0 114.284 -169.552 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 92.7 t80 -59.8 -33.69 72.06 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 121.548 -0.72 . . . . 0.0 112.572 173.227 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 68.3 mt-30 -78.88 -32.48 45.91 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.768 1.227 . . . . 0.0 111.122 179.376 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -63.02 -50.48 70.51 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.755 0.822 . . . . 0.0 109.681 170.489 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -60.33 -33.54 72.54 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 113.499 0.925 . . . . 0.0 113.499 178.308 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 19.1 t-20 -61.16 -24.0 65.97 Favored 'General case' 0 CA--C 1.548 0.889 0 N-CA-C 114.146 1.165 . . . . 0.0 114.146 -177.577 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 58.7 m-85 -106.73 3.84 27.06 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.612 1.565 . . . . 0.0 114.132 179.081 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 89.4 m -84.34 165.75 17.99 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.112 0.965 . . . . 0.0 113.422 173.652 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.252 1.228 0 C-N-CA 125.28 1.432 . . . . 0.0 110.731 -176.342 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 78.4 t80 . . . . . 0 N--CA 1.489 1.495 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 . . . . . . . . . 0 0 . 1 . 040 nuclear orig core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 14.3 p -67.93 131.04 33.48 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.246 0 CA-C-N 119.085 0.857 . . . . 0.0 111.796 -176.294 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 19.1 t30 -166.83 102.15 0.56 Allowed 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.142 1.777 . . . . 0.0 108.143 -169.843 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -163.78 167.05 21.39 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 123.483 0.713 . . . . 0.0 111.664 -166.545 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 96.2 m-70 -70.79 146.18 49.91 Favored 'General case' 0 CA--C 1.549 0.916 0 O-C-N 121.06 -1.025 . . . . 0.0 111.489 168.918 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 74.5 mt -145.2 134.27 22.67 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 125.768 1.627 . . . . 0.0 109.848 174.113 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 5.5 t -148.08 153.11 38.47 Favored 'General case' 0 N--CA 1.47 0.553 0 O-C-N 121.198 -0.938 . . . . 0.0 112.76 179.366 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 54.18 -128.18 40.54 Favored Glycine 0 N--CA 1.471 0.99 0 C-N-CA 124.635 1.112 . . . . 0.0 113.54 172.68 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 76.4 p -53.13 -37.08 61.49 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 125.036 1.335 . . . . 0.0 113.065 177.436 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 5.3 m80 -74.88 -36.41 62.27 Favored 'General case' 0 CA--C 1.54 0.581 0 O-C-N 121.486 -0.759 . . . . 0.0 111.24 -178.851 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 56.1 tp -67.61 -43.99 79.11 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 123.304 0.642 . . . . 0.0 111.48 172.646 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 46.8 t -59.85 -46.65 93.54 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 C-N-CA 124.351 1.06 . . . . 0.0 110.659 175.437 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -63.3 -42.97 99.08 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.154 0.582 . . . . 0.0 111.462 175.561 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.15 -42.13 98.0 Favored 'General case' 0 CA--C 1.536 0.415 0 O-C-N 121.255 -0.903 . . . . 0.0 112.166 176.999 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 43.5 mt -59.08 -42.67 90.97 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 118.796 0.725 . . . . 0.0 111.219 175.736 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 36.9 m-85 -68.64 -37.4 79.66 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 113.554 0.946 . . . . 0.0 113.554 173.796 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 65.2 mt -67.77 -42.75 81.24 Favored 'General case' 0 N--CA 1.473 0.715 0 O-C-N 121.066 -1.021 . . . . 0.0 112.178 176.663 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 74.6 t -72.26 -48.92 46.3 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 124.484 1.114 . . . . 0.0 111.27 -179.271 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 61.9 m -97.82 -7.99 29.33 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 114.702 1.371 . . . . 0.0 114.702 -169.777 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 83.37 -161.32 38.99 Favored Glycine 0 N--CA 1.469 0.864 0 C-N-CA 125.451 1.501 . . . . 0.0 113.179 179.627 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 2.9 pm0 -63.92 -12.39 36.67 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.445 1.498 . . . . 0.0 114.167 -178.879 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 57.8 mtm180 -57.4 -38.16 73.84 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 124.923 1.289 . . . . 0.0 112.675 171.607 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 69.83 -150.47 49.27 Favored Glycine 0 CA--C 1.532 1.095 0 C-N-CA 124.171 0.891 . . . . 0.0 112.326 -172.302 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 53.5 p90 -141.42 155.81 45.84 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.988 1.315 . . . . 0.0 113.226 -170.206 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 74.2 t80 -90.03 -25.71 20.68 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.649 1.18 . . . . 0.0 113.12 -175.989 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 63.2 t80 -65.71 148.77 51.22 Favored 'General case' 0 CA--C 1.543 0.676 0 N-CA-C 114.765 1.395 . . . . 0.0 114.765 -173.034 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 20.8 p -115.66 114.92 42.0 Favored Pre-proline 0 N--CA 1.476 0.85 0 C-N-CA 126.042 1.737 . . . . 0.0 109.511 171.962 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -57.25 136.25 75.18 Favored 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 123.632 2.888 . . . . 0.0 112.719 178.279 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 19.9 ptmt . . . . . 0 CA--C 1.545 0.757 0 N-CA-C 114.004 1.112 . . . . 0.0 114.004 -178.478 . . . . . . . . 0 0 . 1 . 041 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 18.1 tt . . . . . 0 N--CA 1.48 1.074 0 N-CA-C 114.675 1.361 . . . . 0.0 114.675 . . . . . . . . . 0 0 . 1 . 041 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . 0.421 HG12 ' H ' ' B' ' 29' ' ' LYS . 4.9 p -61.68 -26.91 41.02 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 C-N-CA 123.747 0.819 . . . . 0.0 112.411 178.827 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -73.0 -5.08 36.43 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.17 0.988 . . . . 0.0 112.649 177.099 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 24.2 tt0 -113.78 -56.64 2.38 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.265 1.026 . . . . 0.0 110.06 170.441 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 12.4 m -67.36 -24.1 65.67 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 115.393 1.627 . . . . 0.0 115.393 -173.361 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 34.5 t -91.73 -47.95 7.08 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 119.608 1.095 . . . . 0.0 112.214 -178.977 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 5.3 t -71.19 -29.95 65.8 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.429 1.092 . . . . 0.0 113.131 -178.946 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.2 t -131.76 -173.36 3.11 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.855 1.262 . . . . 0.0 111.231 175.758 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 61.8 mt -84.03 140.56 15.98 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 C-N-CA 124.639 1.176 . . . . 0.0 109.885 177.209 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 12.9 p -136.38 154.89 50.68 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 122.207 1.003 . . . . 0.0 113.165 170.136 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 8.4 t -119.04 173.09 7.11 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 126.047 1.739 . . . . 0.0 111.776 178.823 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 62.9 mt -56.46 -33.81 66.28 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.255 1.422 . . . . 0.0 112.946 -171.13 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 90.5 t80 -60.89 -34.61 74.9 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 123.817 0.847 . . . . 0.0 112.784 175.121 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -79.09 -28.84 43.08 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 124.527 1.131 . . . . 0.0 111.036 177.927 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 58.8 mt -67.29 -50.16 61.43 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 123.356 0.662 . . . . 0.0 110.404 170.466 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -63.9 -27.04 68.88 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.067 0.947 . . . . 0.0 113.147 178.129 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 17.6 t30 -61.35 -35.23 76.87 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 124.319 1.048 . . . . 0.0 113.292 -179.376 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 26.0 m-85 -81.21 -24.64 37.31 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 113.652 0.982 . . . . 0.0 113.652 177.479 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 69.2 m -71.83 149.34 45.33 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.051 1.34 . . . . 0.0 112.502 -178.689 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.251 1.165 0 C-N-CA 128.112 2.565 . . . . 0.0 112.439 -172.309 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 80.2 m-85 . . . . . 0 N--CA 1.487 1.4 0 CA-C-O 119.599 -0.238 . . . . 0.0 111.142 . . . . . . . . . 0 0 . 1 . 041 nuclear orig core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 22.7 t 86.82 -58.6 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.287 0 C-N-CA 129.077 2.951 . . . . 0.0 110.264 177.064 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 16.1 p-10 -86.03 104.06 15.29 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 123.317 0.647 . . . . 0.0 109.402 168.828 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -146.06 171.08 15.42 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.136 1.374 . . . . 0.0 111.412 -169.099 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 48.2 m-70 -80.82 138.64 36.23 Favored 'General case' 0 CA--C 1.549 0.912 0 O-C-N 121.044 -1.035 . . . . 0.0 108.923 167.113 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 30.8 mt -138.9 135.61 34.63 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 125.778 1.631 . . . . 0.0 109.335 175.305 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 1.8 t -141.63 148.82 39.8 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 -174.65 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 53.95 -135.37 43.2 Favored Glycine 0 N--CA 1.47 0.94 0 C-N-CA 124.765 1.174 . . . . 0.0 114.127 169.94 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 5.6 m -59.12 -26.3 64.58 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 177.008 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -70.24 -36.89 74.79 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 120.239 1.381 . . . . 0.0 111.77 174.123 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 53.1 tp -70.33 -42.11 72.34 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.058 0.943 . . . . 0.0 111.675 172.763 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 78.2 t -60.65 -42.52 92.13 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.888 0 C-N-CA 123.096 0.558 . . . . 0.0 110.628 174.381 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -67.77 -39.17 84.16 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.855 0.862 . . . . 0.0 112.301 175.239 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -57.96 -42.27 84.66 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 121.359 -0.838 . . . . 0.0 111.234 171.633 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 6.7 mp -65.36 -39.07 91.87 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 118.815 0.734 . . . . 0.0 112.137 173.787 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 22.0 m-30 -59.66 -39.91 86.02 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-N 119.71 1.141 . . . . 0.0 112.08 174.372 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 88.4 mt -74.34 -51.27 15.63 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.58 1.152 . . . . 0.0 111.961 178.145 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 76.2 t -75.79 -37.07 34.71 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 C-N-CA 124.221 1.008 . . . . 0.0 112.133 -171.43 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 72.2 m -105.89 19.41 20.58 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.496 1.119 . . . . 0.0 113.695 -176.2 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -58.06 -29.05 61.88 Favored Glycine 0 CA--C 1.535 1.296 0 CA-C-N 119.149 0.886 . . . . 0.0 113.97 -179.268 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -94.38 -33.36 13.19 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.93 1.292 . . . . 0.0 112.979 172.475 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 35.6 mmt180 -68.93 -28.62 66.82 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 124.156 0.982 . . . . 0.0 113.284 178.948 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 86.08 107.25 0.75 Allowed Glycine 0 CA--C 1.529 0.957 0 N-CA-C 108.81 -1.716 . . . . 0.0 108.81 -167.293 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 13.4 p90 -74.23 152.92 39.64 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 -177.466 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 86.6 t80 -151.34 80.12 1.3 Allowed 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 125.142 1.377 . . . . 0.0 108.702 177.452 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 43.4 p90 -79.89 141.69 35.88 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.285 1.434 . . . . 0.0 112.859 -176.443 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 27.9 p -134.61 66.87 70.69 Favored Pre-proline 0 N--CA 1.477 0.9 0 C-N-CA 125.179 1.391 . . . . 0.0 113.142 -176.406 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -73.34 139.08 28.46 Favored 'Trans proline' 0 C--N 1.351 0.701 0 C-N-CA 123.06 2.507 . . . . 0.0 109.461 168.487 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . 0.421 ' H ' HG12 ' A' ' 3' ' ' VAL . 78.2 tttt . . . . . 0 CA--C 1.541 0.621 0 N-CA-C 113.26 0.837 . . . . 0.0 113.26 -170.24 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 3.8 tt . . . . . 0 N--CA 1.48 1.069 0 N-CA-C 115.051 1.5 . . . . 0.0 115.051 . . . . . . . . . 0 0 . 1 . 042 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 3.9 p -62.03 -29.05 45.61 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.349 0 CA-C-N 121.325 1.875 . . . . 0.0 110.968 179.249 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -65.6 -10.37 34.97 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 126.254 1.822 . . . . 0.0 113.519 174.592 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 36.9 tt0 -111.29 -53.01 2.75 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.334 1.454 . . . . 0.0 109.9 169.152 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 85.2 m -60.73 -31.52 70.82 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 114.265 1.209 . . . . 0.0 114.265 -173.267 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 8.7 t -91.24 -20.82 21.51 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 113.253 0.835 . . . . 0.0 113.253 -173.894 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 30.0 p -104.14 -27.44 12.07 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 126.368 1.867 . . . . 0.0 112.715 179.988 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 10.3 t -144.01 -165.94 2.24 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.895 2.078 . . . . 0.0 110.163 -177.943 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 29.2 mm -87.65 144.23 9.66 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 C-N-CA 124.963 1.305 . . . . 0.0 110.804 178.082 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.8 p -138.44 179.07 6.68 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.518 1.527 . . . . 0.0 110.65 168.966 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 7.4 t -152.49 166.96 30.35 Favored 'General case' 0 N--CA 1.474 0.755 0 O-C-N 120.733 -1.23 . . . . 0.0 113.925 -174.045 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 26.9 mt -61.11 -34.48 75.02 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.647 1.579 . . . . 0.0 112.286 -170.625 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 87.1 t80 -60.74 -28.08 68.42 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.454 1.102 . . . . 0.0 112.993 175.553 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 41.8 mt-30 -82.96 -38.35 22.84 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 123.748 0.819 . . . . 0.0 111.23 173.276 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 84.9 mt -61.31 -34.5 75.34 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.908 0.883 . . . . 0.0 112.608 177.017 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -54.72 -32.21 59.33 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 113.423 0.898 . . . . 0.0 113.423 171.857 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 16.5 t-20 -68.18 -19.1 64.75 Favored 'General case' 0 CA--C 1.547 0.834 0 CA-C-N 118.92 0.782 . . . . 0.0 113.073 179.469 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 97.4 m-85 -98.1 4.55 49.13 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.568 1.547 . . . . 0.0 113.659 178.347 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 17.5 t -77.41 173.9 11.43 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 124.903 1.281 . . . . 0.0 111.312 168.481 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.049 0 C-N-CA 125.105 1.362 . . . . 0.0 111.531 169.634 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 75.8 m-85 . . . . . 0 N--CA 1.487 1.392 0 N-CA-C 107.757 -1.201 . . . . 0.0 107.757 . . . . . . . . . 0 0 . 1 . 042 nuclear orig core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 4.2 t 69.28 176.9 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.706 0 C-N-CA 125.42 1.488 . . . . 0.0 108.934 -168.167 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 7.2 p30 -62.24 131.9 50.94 Favored 'General case' 0 CA--C 1.546 0.811 0 O-C-N 120.357 -1.464 . . . . 0.0 111.533 174.523 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 70.4 mt-30 -160.75 173.42 15.44 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.968 1.307 . . . . 0.0 111.032 -169.345 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 99.3 m-70 -87.49 139.24 30.75 Favored 'General case' 0 CA--C 1.549 0.915 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 165.093 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 5.0 mp -143.03 145.48 32.95 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 124.969 1.308 . . . . 0.0 111.116 177.717 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 1.8 t -156.35 151.3 26.2 Favored 'General case' 0 N--CA 1.468 0.445 0 O-C-N 121.212 -0.93 . . . . 0.0 112.022 178.935 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 53.52 -129.49 40.9 Favored Glycine 0 N--CA 1.472 1.053 0 C-N-CA 124.326 0.965 . . . . 0.0 114.044 172.625 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.5 m -57.16 -31.99 65.95 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 124.481 1.113 . . . . 0.0 113.79 178.854 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -71.42 -38.08 71.42 Favored 'General case' 0 CA--C 1.544 0.737 0 O-C-N 120.983 -1.073 . . . . 0.0 111.492 176.164 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 42.4 tp -67.85 -41.29 83.14 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 123.485 0.714 . . . . 0.0 110.844 174.183 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 40.4 t -59.31 -45.86 92.88 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.975 0 C-N-CA 124.542 1.137 . . . . 0.0 111.306 172.599 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -63.09 -43.51 98.31 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.456 0.702 . . . . 0.0 111.447 177.033 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -65.13 -39.85 93.62 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 121.35 -0.844 . . . . 0.0 112.406 177.075 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 48.7 mt -61.18 -42.54 98.75 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 118.521 0.6 . . . . 0.0 111.351 174.098 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 17.0 m-85 -62.26 -41.54 98.54 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 119.079 0.854 . . . . 0.0 112.613 172.291 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 73.3 mt -67.25 -43.12 82.7 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 123.668 0.787 . . . . 0.0 112.193 178.498 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 55.1 t -72.53 -44.55 61.17 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 C-N-CA 123.896 0.878 . . . . 0.0 112.384 -179.149 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 35.5 t -82.86 -24.98 32.99 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 113.397 0.888 . . . . 0.0 113.397 -177.914 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 74.35 -155.23 48.59 Favored Glycine 0 CA--C 1.529 0.962 0 C-N-CA 124.65 1.119 . . . . 0.0 112.422 -178.334 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -62.69 -12.16 21.87 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 114.455 1.279 . . . . 0.0 114.455 179.471 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 56.1 mtp85 -61.3 -31.04 70.87 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.939 1.296 . . . . 0.0 112.683 175.007 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.39 139.48 1.5 Allowed Glycine 0 CA--C 1.533 1.218 0 C-N-CA 125.56 1.552 . . . . 0.0 112.945 -178.706 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 7.1 p90 -74.7 160.61 30.55 Favored 'General case' 0 CA--C 1.541 0.626 0 O-C-N 121.933 -0.745 . . . . 0.0 112.97 177.48 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 76.8 t80 -91.24 -27.67 18.3 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 125.21 1.404 . . . . 0.0 112.79 175.352 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 18.3 t80 -117.44 139.8 50.42 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 126.196 1.799 . . . . 0.0 113.069 -170.99 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 26.2 p -110.57 155.28 42.39 Favored Pre-proline 0 N--CA 1.478 0.926 0 C-N-CA 125.149 1.38 . . . . 0.0 108.54 167.509 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_exo -50.82 129.16 26.64 Favored 'Trans proline' 0 C--N 1.351 0.696 0 C-N-CA 123.558 2.839 . . . . 0.0 112.636 -177.06 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 7.0 mtmp? . . . . . 0 N--CA 1.482 1.159 0 C-N-CA 128.272 2.629 . . . . 0.0 113.452 179.946 . . . . . . . . 0 0 . 1 . 043 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 11.7 pt . . . . . 0 N--CA 1.487 1.392 0 N-CA-C 114.347 1.24 . . . . 0.0 114.347 . . . . . . . . . 0 0 . 1 . 043 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 7.1 p -57.84 -34.14 47.45 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 C-N-CA 124.973 1.309 . . . . 0.0 112.695 -174.977 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -70.38 -47.82 59.1 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 118.252 0.478 . . . . 0.0 110.863 172.172 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -71.2 -43.9 66.47 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.674 0.789 . . . . 0.0 111.837 -171.414 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 67.8 m -58.92 -28.34 66.12 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 123.991 0.916 . . . . 0.0 112.415 172.932 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 8.7 t -83.09 -54.33 5.12 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.706 0.803 . . . . 0.0 111.466 -178.86 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 81.3 p -77.66 -21.66 51.82 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 124.517 1.127 . . . . 0.0 113.739 -177.03 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.7 t -143.49 -165.39 2.08 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.386 1.474 . . . . 0.0 111.126 -178.508 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 37.6 mt -99.39 132.82 44.09 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 C-N-CA 125.295 1.438 . . . . 0.0 109.887 -174.531 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 7.8 p -132.8 159.19 40.48 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.247 1.019 . . . . 0.0 112.858 178.962 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 77.3 p -108.94 163.39 13.34 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 114.661 1.356 . . . . 0.0 114.661 -169.687 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 75.2 mt -59.55 -30.26 68.5 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 121.398 -0.814 . . . . 0.0 112.567 174.781 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 94.0 t80 -63.79 -33.43 75.64 Favored 'General case' 0 N--CA 1.473 0.688 0 O-C-N 121.383 -0.823 . . . . 0.0 112.603 173.802 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 58.3 mt-30 -74.1 -37.5 64.12 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 123.414 0.685 . . . . 0.0 110.868 173.617 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 41.2 mt -60.8 -43.74 97.76 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 118.336 0.516 . . . . 0.0 112.156 171.465 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -59.07 -38.91 80.55 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.033 0.933 . . . . 0.0 112.538 172.465 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 -65.1 -22.68 66.98 Favored 'General case' 0 CA--C 1.552 1.048 0 O-C-N 121.436 -0.79 . . . . 0.0 112.981 174.368 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -90.58 -1.81 57.88 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 125.953 1.701 . . . . 0.0 114.271 173.482 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 78.2 m -71.95 158.84 35.27 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 119.973 1.26 . . . . 0.0 112.112 171.418 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 . . . . . 0 C--O 1.255 1.35 0 C-N-CA 125.155 1.382 . . . . 0.0 113.497 179.669 . . . . . . . . 0 0 . 1 . 043 nuclear orig core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . 0.25 48.7 p90 . . . . . 0 N--CA 1.481 1.12 0 CA-C-O 117.107 -1.425 . . . . 0.0 113.267 . . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 3.5 p -176.29 -51.47 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 CA-C-N 121.228 1.831 . . . . 0.0 113.512 178.066 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 63.7 t30 -120.48 99.76 6.75 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 123.945 0.898 . . . . 0.0 110.158 -169.84 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 8.5 mt-30 -143.45 168.38 19.98 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 124.795 1.238 . . . . 0.0 113.056 -166.255 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 26.2 m-70 -77.54 135.34 38.19 Favored 'General case' 0 CA--C 1.549 0.926 0 N-CA-C 108.339 -0.985 . . . . 0.0 108.339 166.159 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 87.8 mt -144.1 128.51 17.93 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 125.961 1.704 . . . . 0.0 109.343 177.874 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 5.6 t -145.8 145.29 30.74 Favored 'General case' 0 N--CA 1.469 0.504 0 O-C-N 121.335 -0.853 . . . . 0.0 112.174 -179.495 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.08 -125.85 36.99 Favored Glycine 0 N--CA 1.469 0.842 0 C-N-CA 124.395 0.998 . . . . 0.0 113.354 175.926 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 28.9 p -56.4 -35.79 68.16 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.763 1.225 . . . . 0.0 113.448 178.487 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 94.8 m-70 -68.26 -39.71 82.11 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 120.78 -1.2 . . . . 0.0 111.945 176.872 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 38.4 tp -68.13 -42.7 79.8 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 123.734 0.813 . . . . 0.0 111.308 174.41 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 40.9 t -61.37 -42.21 92.82 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.973 0 C-N-CA 124.095 0.958 . . . . 0.0 111.315 174.878 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -63.93 -44.9 91.47 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 123.829 0.852 . . . . 0.0 111.528 174.537 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.79 -39.33 91.31 Favored 'General case' 0 CA--C 1.541 0.599 0 O-C-N 121.466 -0.771 . . . . 0.0 112.117 175.988 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 70.1 mt -66.08 -40.05 90.54 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 118.526 -0.749 . . . . 0.0 112.194 174.039 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 19.4 m-85 -60.18 -40.42 89.94 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 120.363 1.438 . . . . 0.0 112.236 170.943 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 81.0 mt -68.07 -44.69 75.73 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.632 0.773 . . . . 0.0 112.47 177.336 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 53.0 t -73.46 -47.82 44.03 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 123.725 0.81 . . . . 0.0 112.181 -179.258 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 56.7 m -80.84 -32.07 35.26 Favored 'General case' 0 N--CA 1.47 0.544 0 N-CA-C 113.227 0.825 . . . . 0.0 113.227 -174.205 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 66.75 -138.34 35.33 Favored Glycine 0 CA--C 1.53 1.0 0 C-N-CA 124.137 0.875 . . . . 0.0 111.999 -177.934 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -62.26 -21.39 65.15 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 124.775 1.23 . . . . 0.0 113.258 -178.684 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 89.4 mtm180 -61.79 -35.75 79.08 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.151 0.981 . . . . 0.0 112.939 178.326 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.68 -175.73 49.39 Favored Glycine 0 CA--C 1.533 1.21 0 C-N-CA 124.131 0.872 . . . . 0.0 113.033 -171.232 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 2.0 p90 -130.03 167.68 17.91 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.146 1.378 . . . . 0.0 114.48 -170.442 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 58.1 t80 -93.38 1.53 56.87 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 127.303 2.241 . . . . 0.0 113.125 176.837 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 76.7 t80 -52.05 141.46 18.2 Favored 'General case' 0 CA--C 1.546 0.798 0 N-CA-C 115.753 1.761 . . . . 0.0 115.753 -171.902 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -162.97 127.37 1.96 Allowed Pre-proline 0 N--CA 1.47 0.573 0 C-N-CA 127.347 2.259 . . . . 0.0 108.0 170.463 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -70.5 145.66 53.47 Favored 'Trans proline' 0 C--N 1.35 0.641 0 C-N-CA 123.2 2.6 . . . . 0.0 113.434 -169.033 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 35.9 mmtm . . . . . 0 CA--C 1.55 0.952 0 C-N-CA 125.579 1.552 . . . . 0.0 113.056 173.481 . . . . . . . . 0 0 . 1 . 044 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 9.6 tp . . . . . 0 N--CA 1.475 0.795 0 N-CA-C 113.647 0.981 . . . . 0.0 113.647 . . . . . . . . . 0 0 . 1 . 044 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 41.5 t -68.49 -35.33 70.03 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.107 0 CA-C-N 120.02 1.282 . . . . 0.0 111.092 -172.625 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.3 pm0 -69.97 -9.9 56.74 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 113.64 0.978 . . . . 0.0 113.64 174.884 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 60.5 mt-30 -93.96 -58.48 2.23 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 118.706 0.684 . . . . 0.0 109.199 169.716 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 86.7 m -76.42 -27.93 56.44 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 115.689 1.736 . . . . 0.0 115.689 -169.395 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 16.3 t -85.41 -49.51 8.05 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 118.404 0.547 . . . . 0.0 110.726 179.65 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 15.3 m -64.75 -38.23 90.29 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 126.248 1.819 . . . . 0.0 111.924 -178.197 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 65.8 m -142.92 -176.0 4.73 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 125.592 1.557 . . . . 0.0 111.405 -173.898 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 95.6 mt -79.38 122.77 35.27 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 O-C-N 120.252 -1.53 . . . . 0.0 108.174 168.057 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 20.8 p -100.77 157.08 16.97 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.934 0.893 . . . . 0.0 111.407 170.627 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 37.5 t -79.97 152.9 29.25 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 120.948 -1.095 . . . . 0.0 112.067 175.51 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -62.11 -28.43 69.62 Favored 'General case' 0 CA--C 1.543 0.709 0 O-C-N 121.038 -1.039 . . . . 0.0 110.721 170.77 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.7 t80 -66.8 -30.96 71.28 Favored 'General case' 0 CA--C 1.542 0.654 0 O-C-N 121.324 -0.86 . . . . 0.0 112.996 170.435 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 94.7 mt-30 -76.16 -33.96 59.37 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 121.453 -0.779 . . . . 0.0 110.879 175.361 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 93.9 mt -59.2 -49.87 76.19 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 119.192 0.906 . . . . 0.0 110.19 168.479 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -62.79 -29.5 70.75 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 114.249 1.203 . . . . 0.0 114.249 176.48 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -63.01 -24.83 68.1 Favored 'General case' 0 CA--C 1.548 0.868 0 CA-C-N 119.527 1.058 . . . . 0.0 113.012 -179.306 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 52.9 m-85 -95.15 2.95 55.16 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.427 1.491 . . . . 0.0 113.624 173.732 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 95.4 m -103.76 124.72 49.41 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 121.218 -0.926 . . . . 0.0 112.966 179.753 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.252 1.225 0 C-N-CA 127.254 2.221 . . . . 0.0 112.843 -169.262 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 45.6 p90 . . . . . 0 N--CA 1.485 1.294 0 CA-C-O 119.745 -0.169 . . . . 0.0 110.887 . . . . . . . . . 0 0 . 1 . 044 nuclear orig core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 22.4 m -138.03 151.14 25.08 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 C-N-CA 124.983 1.313 . . . . 0.0 111.093 171.638 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 60.8 t30 -77.92 179.69 6.58 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 124.233 1.013 . . . . 0.0 111.61 170.447 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 15.8 mp0 -107.68 169.89 8.32 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.828 1.651 . . . . 0.0 110.914 177.838 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 15.1 m-70 -71.28 139.62 50.05 Favored 'General case' 0 CA--C 1.545 0.763 0 O-C-N 121.376 -0.827 . . . . 0.0 109.013 167.481 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 73.7 mt -135.03 126.23 28.09 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 125.478 1.511 . . . . 0.0 108.875 179.699 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.6 t -144.36 150.02 37.1 Favored 'General case' 0 N--CA 1.47 0.538 0 O-C-N 121.691 -0.63 . . . . 0.0 112.02 -176.903 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 56.83 -128.79 47.94 Favored Glycine 0 CA--C 1.529 0.908 0 C-N-CA 124.344 0.973 . . . . 0.0 113.588 174.244 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 26.5 p -56.43 -37.48 70.27 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.853 1.261 . . . . 0.0 113.044 177.516 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 68.4 m-70 -73.51 -29.26 62.37 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 119.615 1.098 . . . . 0.0 112.689 177.452 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 39.5 tp -71.93 -42.42 66.7 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 121.144 -0.973 . . . . 0.0 111.402 170.654 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 21.7 t -57.64 -47.91 84.48 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 C-N-CA 124.285 1.034 . . . . 0.0 110.896 171.286 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -58.37 -47.56 83.42 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.542 1.537 . . . . 0.0 111.677 174.589 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.86 -43.68 98.14 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 118.671 0.669 . . . . 0.0 112.21 177.778 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 44.8 mt -61.04 -42.75 99.06 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 118.619 0.645 . . . . 0.0 111.454 176.384 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 16.8 m-85 -61.22 -45.28 95.22 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.046 0.839 . . . . 0.0 112.491 172.776 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 78.2 mt -68.06 -42.6 80.21 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.788 0.835 . . . . 0.0 112.966 -179.5 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 54.6 t -73.99 -44.69 50.44 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 124.524 1.13 . . . . 0.0 111.606 -178.079 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 65.9 m -99.71 -18.93 17.01 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 114.984 1.475 . . . . 0.0 114.984 -169.896 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 61.72 -133.07 47.11 Favored Glycine 0 CA--C 1.533 1.158 0 CA-C-N 118.973 0.806 . . . . 0.0 112.633 177.571 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 5.3 pm0 -66.93 -11.97 58.05 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.7 1.6 . . . . 0.0 115.223 -176.799 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 69.8 mtp180 -60.22 -38.01 82.05 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.859 0.863 . . . . 0.0 112.478 176.134 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.62 166.62 9.6 Favored Glycine 0 CA--C 1.536 1.362 0 C-N-CA 124.087 0.851 . . . . 0.0 112.364 -170.393 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 47.6 p90 -130.83 147.79 52.53 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.019 1.328 . . . . 0.0 112.98 -174.479 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 39.4 t80 -94.37 91.43 6.68 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 125.789 1.636 . . . . 0.0 109.457 172.424 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 15.9 t80 -71.36 127.81 33.82 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 121.718 -0.614 . . . . 0.0 111.597 -177.156 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 3.9 p -136.83 108.02 9.06 Favored Pre-proline 0 N--CA 1.477 0.908 0 C-N-CA 124.974 1.31 . . . . 0.0 110.394 -172.934 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -81.87 170.96 13.51 Favored 'Trans proline' 0 C--N 1.355 0.881 0 C-N-CA 124.481 3.454 . . . . 0.0 113.654 -170.355 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 27.4 mtpp . . . . . 0 N--CA 1.478 0.937 0 C-N-CA 124.529 1.132 . . . . 0.0 113.917 176.064 . . . . . . . . 0 0 . 1 . 045 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 20.1 tt . . . . . 0 N--CA 1.483 1.219 0 N-CA-C 112.474 0.546 . . . . 0.0 112.474 . . . . . . . . . 0 0 . 1 . 045 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 58.0 t -58.74 -44.92 91.18 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.058 0 C-N-CA 124.367 1.067 . . . . 0.0 110.408 -177.003 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.0 pm0 -66.63 -11.31 53.08 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.633 1.573 . . . . 0.0 113.819 177.671 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 26.3 mm100 -95.27 -53.11 3.9 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.457 1.103 . . . . 0.0 109.561 168.833 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 84.8 m -61.06 -34.91 75.64 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.939 1.296 . . . . 0.0 114.153 -174.749 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 72.7 m -72.79 -46.08 55.17 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 121.244 -0.91 . . . . 0.0 111.147 174.995 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 21.7 m -77.15 -32.33 56.23 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 126.723 2.009 . . . . 0.0 112.849 -170.442 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.4 t -150.91 -168.96 3.25 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 126.069 1.748 . . . . 0.0 110.865 -176.167 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 62.5 mt -79.45 136.08 24.35 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 O-C-N 120.681 -1.262 . . . . 0.0 110.322 175.658 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.6 p -127.28 160.69 30.56 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.311 1.044 . . . . 0.0 112.402 173.731 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 33.5 t -101.26 154.02 19.12 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 114.194 1.183 . . . . 0.0 114.194 -168.848 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 32.2 mt -62.21 -30.64 71.23 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.139 0.976 . . . . 0.0 111.702 174.121 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 87.5 t80 -61.6 -34.72 76.12 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 123.695 0.798 . . . . 0.0 112.716 171.985 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 58.8 mt-30 -72.1 -43.74 64.31 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.423 0.689 . . . . 0.0 109.797 176.363 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 95.3 mt -57.23 -49.45 76.0 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 122.979 0.512 . . . . 0.0 111.734 174.411 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -62.77 -28.35 69.92 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 113.243 0.831 . . . . 0.0 113.243 178.166 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -81.19 -38.94 26.24 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 124.221 1.008 . . . . 0.0 112.942 179.039 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 20.7 m-85 -84.58 -6.46 59.37 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 114.55 1.315 . . . . 0.0 114.55 179.64 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 39.4 t -70.72 174.38 6.05 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 124.45 1.1 . . . . 0.0 112.07 168.076 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 14.6 t-20 . . . . . 0 C--O 1.251 1.178 0 C-N-CA 125.304 1.442 . . . . 0.0 113.313 -176.645 . . . . . . . . 0 0 . 1 . 045 nuclear orig core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 34.1 t80 . . . . . 0 N--CA 1.487 1.381 0 CA-C-O 119.884 -0.103 . . . . 0.0 111.017 . . . . . . . . . 0 0 . 1 . 045 nuclear orig core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 19.1 t -79.37 -19.92 12.6 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.362 0 O-C-N 120.784 -1.198 . . . . 0.0 113.049 -169.75 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 24.2 t30 -60.92 94.85 0.03 OUTLIER 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 125.586 1.554 . . . . 0.0 111.424 174.955 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -153.03 -170.69 3.7 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 126.415 1.886 . . . . 0.0 110.516 -168.804 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 19.9 m-70 -75.3 146.26 41.14 Favored 'General case' 0 CA--C 1.546 0.814 0 O-C-N 120.846 -1.159 . . . . 0.0 109.54 167.442 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 61.2 mt -146.5 133.02 19.73 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 126.535 1.934 . . . . 0.0 109.201 174.874 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.1 t -145.46 150.47 36.56 Favored 'General case' 0 N--CA 1.468 0.438 0 O-C-N 121.189 -0.944 . . . . 0.0 113.013 179.928 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 57.04 -129.99 50.29 Favored Glycine 0 N--CA 1.469 0.884 0 C-N-CA 124.929 1.252 . . . . 0.0 113.864 172.4 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 17.4 p -54.72 -43.28 72.46 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 124.348 1.059 . . . . 0.0 112.409 175.566 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -65.48 -34.83 79.19 Favored 'General case' 0 CA--C 1.542 0.666 0 O-C-N 121.117 -0.989 . . . . 0.0 112.256 178.919 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 62.2 tp -67.34 -44.87 78.03 Favored 'General case' 0 C--O 1.222 -0.371 0 CA-C-O 118.033 -0.984 . . . . 0.0 111.259 171.203 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 54.3 t -62.24 -43.41 97.93 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.078 0 CA-C-N 119.643 1.111 . . . . 0.0 111.25 178.975 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.1 mm-40 -60.79 -51.28 70.01 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 123.689 0.795 . . . . 0.0 111.224 173.8 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.89 -43.44 92.9 Favored 'General case' 0 CA--C 1.534 0.339 0 O-C-N 121.551 -0.718 . . . . 0.0 111.934 -177.5 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 62.0 tp -55.25 -47.14 75.85 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 125.339 1.456 . . . . 0.0 111.184 177.697 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -72.69 -39.34 67.12 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 119.134 0.879 . . . . 0.0 112.365 177.996 . . . . . . . . 2 2 . 1 . 045 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 74.9 mt -66.92 -41.21 87.44 Favored 'General case' 0 N--CA 1.474 0.754 0 CA-C-N 118.95 0.796 . . . . 0.0 112.816 179.845 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 54.7 t -68.39 -34.86 68.17 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 C-N-CA 124.992 1.317 . . . . 0.0 111.566 176.33 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 42.7 t -80.97 -34.07 33.38 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 114.261 1.208 . . . . 0.0 114.261 -179.15 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 86.03 -145.34 20.64 Favored Glycine 0 CA--C 1.533 1.182 0 C-N-CA 125.197 1.38 . . . . 0.0 113.42 179.786 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -59.27 -22.75 61.63 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 126.232 1.813 . . . . 0.0 114.593 -169.593 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 71.3 mtp180 -52.33 -38.33 58.36 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 125.419 1.487 . . . . 0.0 113.176 175.496 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.04 148.84 3.02 Favored Glycine 0 CA--C 1.533 1.186 0 C-N-CA 125.101 1.334 . . . . 0.0 112.263 -174.085 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 27.2 p90 -71.56 168.29 17.92 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 113.993 1.108 . . . . 0.0 113.993 -175.079 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 73.5 t80 -136.96 -60.34 0.69 Allowed 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.854 1.262 . . . . 0.0 111.96 -177.486 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 15.6 t80 -74.16 114.15 12.17 Favored 'General case' 0 CA--C 1.546 0.814 0 O-C-N 121.75 -0.594 . . . . 0.0 112.373 -172.672 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 23.3 p -78.29 155.43 79.37 Favored Pre-proline 0 N--CA 1.48 1.029 0 C-N-CA 125.85 1.66 . . . . 0.0 112.167 -178.686 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -73.27 108.04 2.52 Favored 'Trans proline' 0 C--N 1.352 0.723 0 C-N-CA 123.537 2.825 . . . . 0.0 111.47 -176.88 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt . . . . . 0 CA--C 1.541 0.629 0 N-CA-C 114.223 1.194 . . . . 0.0 114.223 -169.69 . . . . . . . . 0 0 . 1 . 046 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 11.3 tt . . . . . 0 N--CA 1.479 0.988 0 N-CA-C 113.042 0.756 . . . . 0.0 113.042 . . . . . . . . . 0 0 . 1 . 046 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 9.8 p -68.78 -28.12 38.58 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 O-C-N 121.64 -0.662 . . . . 0.0 111.827 -176.596 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 37.2 mp0 -68.75 -12.9 61.99 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 123.853 0.861 . . . . 0.0 113.045 173.018 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 5.5 tp60 -97.99 -58.35 2.0 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.022 0.929 . . . . 0.0 110.347 169.199 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 34.7 m -70.77 -27.13 63.69 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 114.675 1.361 . . . . 0.0 114.675 -170.095 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 10.6 t -81.28 -38.8 26.24 Favored 'General case' 0 N--CA 1.472 0.646 0 O-C-N 120.868 -1.145 . . . . 0.0 111.105 175.288 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 28.7 m -69.61 -38.99 77.49 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 126.881 2.072 . . . . 0.0 112.586 -177.614 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 21.5 m -143.52 166.41 24.88 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 124.711 1.205 . . . . 0.0 111.304 -178.035 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 70.0 mt -58.93 128.78 20.2 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 O-C-N 121.129 -0.982 . . . . 0.0 109.326 169.447 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 15.1 p -120.37 154.6 34.86 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 122.066 0.936 . . . . 0.0 112.29 175.926 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 47.4 t -98.01 153.85 18.1 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 124.497 1.119 . . . . 0.0 112.621 -174.103 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 10.7 mp -61.61 -26.94 68.3 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.861 0.864 . . . . 0.0 111.503 174.21 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 93.5 t80 -59.31 -37.92 78.95 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 123.574 0.75 . . . . 0.0 112.669 169.582 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 68.9 mt-30 -75.62 -39.81 57.3 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 124.155 0.982 . . . . 0.0 110.567 178.418 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 78.6 mt -58.68 -53.76 54.71 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.128 0.971 . . . . 0.0 111.201 172.702 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -66.13 -30.34 70.82 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 -179.98 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 20.1 t30 -66.15 -33.03 74.84 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 118.927 0.785 . . . . 0.0 112.326 172.678 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -73.96 -33.23 63.8 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.03 0.932 . . . . 0.0 112.652 172.856 . . . . . . . . 2 2 . 1 . 046 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 87.5 m -71.17 177.15 3.97 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 125.451 1.5 . . . . 0.0 114.655 176.866 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 31.2 m120 . . . . . 0 C--O 1.256 1.431 0 C-N-CA 125.549 1.54 . . . . 0.0 112.021 170.44 . . . . . . . . 0 0 . 1 . 046 nuclear orig core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 41.2 t80 . . . . . 0 N--CA 1.487 1.41 0 CA-C-O 119.549 -0.262 . . . . 0.0 111.044 . . . . . . . . . 0 0 . 1 . 046 nuclear orig core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 27.4 m -75.32 -36.37 36.08 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.42 0 O-C-N 121.209 -0.932 . . . . 0.0 113.366 -174.785 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -84.02 104.63 14.24 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.673 1.189 . . . . 0.0 108.022 169.268 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -169.73 -177.11 2.58 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.712 1.205 . . . . 0.0 110.336 -167.905 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 26.2 m-70 -71.83 136.74 47.14 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 164.472 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 84.4 mt -138.84 128.83 25.21 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 126.142 1.777 . . . . 0.0 109.176 -179.831 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.3 t -141.48 133.67 27.89 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 112.77 0.656 . . . . 0.0 112.77 -171.407 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 60.05 -126.88 42.81 Favored Glycine 0 CA--C 1.528 0.845 0 C-N-CA 124.361 0.982 . . . . 0.0 113.241 175.059 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 18.8 m -55.21 -32.81 62.53 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.281 1.032 . . . . 0.0 113.069 177.769 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 32.4 m80 -68.46 -39.0 81.58 Favored 'General case' 0 CA--C 1.542 0.662 0 O-C-N 121.043 -1.036 . . . . 0.0 111.732 177.465 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 32.1 tp -71.38 -41.26 69.87 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 124.255 1.022 . . . . 0.0 111.086 175.618 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 64.5 t -60.74 -43.29 94.86 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 123.597 0.759 . . . . 0.0 110.953 173.004 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -64.66 -41.77 95.86 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 123.643 0.777 . . . . 0.0 111.922 174.305 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.37 -45.26 94.14 Favored 'General case' 0 CA--C 1.535 0.399 0 O-C-N 121.568 -0.708 . . . . 0.0 111.483 174.396 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 51.6 mt -58.69 -44.1 90.19 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 123.627 0.771 . . . . 0.0 111.838 174.893 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 4.6 m-85 -56.01 -50.77 69.96 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.514 0.726 . . . . 0.0 112.126 172.593 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 8.4 mp -71.03 -42.23 69.79 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 123.522 0.729 . . . . 0.0 112.649 -176.573 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 69.2 t -76.02 -40.19 37.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 C-N-CA 124.624 1.17 . . . . 0.0 111.886 -174.224 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 58.5 m -95.61 -18.21 20.74 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 113.697 0.999 . . . . 0.0 113.697 -174.828 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 62.45 -140.32 46.19 Favored Glycine 0 CA--C 1.532 1.136 0 C-N-CA 124.761 1.172 . . . . 0.0 114.073 168.928 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -68.22 -13.95 62.62 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 124.951 1.3 . . . . 0.0 114.153 -174.111 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 57.0 mtm-85 -67.68 -26.08 66.01 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 123.867 0.867 . . . . 0.0 112.663 176.662 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.2 168.38 44.21 Favored Glycine 0 CA--C 1.531 1.051 0 C-N-CA 125.059 1.314 . . . . 0.0 112.908 -171.458 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 39.9 p90 -135.02 170.6 15.66 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.267 1.427 . . . . 0.0 112.437 -179.199 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 65.6 t80 -129.52 148.87 51.46 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.344 1.458 . . . . 0.0 110.169 172.021 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 63.2 t80 -156.8 125.21 5.7 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.743 1.217 . . . . 0.0 110.956 -174.437 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 50.3 m -152.17 124.41 3.92 Favored Pre-proline 0 N--CA 1.474 0.753 0 C-N-CA 124.869 1.268 . . . . 0.0 109.782 177.534 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -84.39 161.44 12.97 Favored 'Trans proline' 0 CA--C 1.536 0.618 0 C-N-CA 123.937 3.091 . . . . 0.0 111.056 169.401 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 58.2 tptt . . . . . 0 CA--C 1.546 0.794 0 C-N-CA 124.308 1.043 . . . . 0.0 113.245 177.522 . . . . . . . . 0 0 . 1 . 047 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 19.4 tt . . . . . 0 N--CA 1.479 0.995 0 N-CA-C 112.756 0.651 . . . . 0.0 112.756 . . . . . . . . . 0 0 . 1 . 047 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 13.4 p -63.07 -31.91 54.31 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.129 0 CA-C-N 119.156 0.889 . . . . 0.0 112.523 -176.177 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 6.0 pm0 -72.46 -5.09 34.29 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.854 1.261 . . . . 0.0 113.618 175.768 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 47.2 tp60 -107.82 -52.83 2.71 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.257 1.423 . . . . 0.0 109.211 168.183 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 95.3 m -59.59 -35.1 73.63 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 114.238 1.199 . . . . 0.0 114.238 -175.423 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 19.0 t -82.74 -33.11 27.56 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 113.14 0.793 . . . . 0.0 113.14 -172.689 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 27.5 p -100.48 -26.85 13.71 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 126.388 1.875 . . . . 0.0 112.875 -175.701 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.7 t -138.98 -160.74 1.1 Allowed 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 126.114 1.766 . . . . 0.0 110.137 179.632 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 72.1 mt -97.81 140.03 18.8 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.71 0 O-C-N 120.546 -1.347 . . . . 0.0 110.109 -177.535 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 15.1 p -134.51 161.85 33.91 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 124.595 1.158 . . . . 0.0 112.66 173.983 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 60.1 p -109.16 165.64 11.45 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 115.174 1.546 . . . . 0.0 115.174 -170.647 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 11.0 mp -65.3 -30.25 71.09 Favored 'General case' 0 N--CA 1.47 0.549 0 O-C-N 121.454 -0.779 . . . . 0.0 111.726 171.831 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 80.1 t80 -63.63 -31.73 72.99 Favored 'General case' 0 CA--C 1.543 0.698 0 O-C-N 121.462 -0.774 . . . . 0.0 112.717 172.54 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 84.9 mt-30 -75.4 -36.34 60.86 Favored 'General case' 0 CA--C 1.537 0.46 0 O-C-N 121.483 -0.761 . . . . 0.0 111.495 172.593 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 86.7 mt -62.11 -42.11 98.9 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 119.374 0.988 . . . . 0.0 111.866 171.778 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -58.61 -27.11 64.37 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.748 1.219 . . . . 0.0 113.807 176.856 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.8 t30 -59.24 -28.01 66.3 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-N 119.125 0.875 . . . . 0.0 113.27 179.155 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 82.2 m-85 -100.55 6.98 44.33 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.508 1.523 . . . . 0.0 113.959 -178.522 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 54.2 m -89.39 153.42 20.86 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.194 0.998 . . . . 0.0 112.573 172.814 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.254 1.313 0 C-N-CA 126.589 1.956 . . . . 0.0 112.349 178.679 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . 0.263 12.0 p90 . . . . . 0 N--CA 1.486 1.352 0 CA-C-O 118.45 -0.786 . . . . 0.0 110.591 . . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 73.1 t -82.36 142.58 13.45 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.287 0 CA-C-N 120.203 1.365 . . . . 0.0 110.079 171.541 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -158.14 147.5 19.57 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 126.039 1.736 . . . . 0.0 112.551 177.57 . . . . . . . . 2 2 . 1 . 047 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -162.54 170.62 18.32 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.825 1.25 . . . . 0.0 111.644 -170.304 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 96.6 m-70 -80.01 139.3 37.04 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 108.334 -0.988 . . . . 0.0 108.334 165.389 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 83.1 mt -148.76 133.81 18.19 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 125.24 1.416 . . . . 0.0 110.367 -179.581 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.6 t -152.36 147.64 26.54 Favored 'General case' 0 N--CA 1.473 0.693 0 O-C-N 121.112 -0.993 . . . . 0.0 113.078 178.183 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 57.88 -129.97 50.32 Favored Glycine 0 CA--C 1.528 0.861 0 C-N-CA 124.517 1.056 . . . . 0.0 112.79 176.174 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.4 m -54.29 -32.36 56.18 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 124.784 1.233 . . . . 0.0 113.335 177.46 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 24.0 m80 -70.81 -41.06 72.09 Favored 'General case' 0 CA--C 1.539 0.52 0 O-C-N 121.33 -0.857 . . . . 0.0 111.628 178.24 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 52.2 tp -67.84 -44.84 76.25 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 123.796 0.839 . . . . 0.0 110.52 174.395 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 25.6 t -56.37 -44.94 81.29 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.99 0 C-N-CA 124.499 1.12 . . . . 0.0 111.22 173.804 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -63.99 -41.77 97.41 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.174 0.59 . . . . 0.0 111.903 174.376 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.34 -41.0 98.21 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 118.881 0.764 . . . . 0.0 112.495 176.05 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -60.6 -46.26 90.93 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 119.234 0.925 . . . . 0.0 111.047 171.084 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 21.5 m-85 -61.81 -34.86 76.68 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 119.978 1.263 . . . . 0.0 113.137 176.117 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 71.9 mt -70.71 -43.99 67.84 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 123.783 0.833 . . . . 0.0 112.195 175.359 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 72.0 t -75.86 -40.9 39.31 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 CA-C-N 118.634 0.652 . . . . 0.0 112.021 -178.057 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 50.8 m -85.2 -23.31 28.35 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 114.011 1.115 . . . . 0.0 114.011 -179.104 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 79.53 -162.47 47.47 Favored Glycine 0 CA--C 1.53 0.999 0 C-N-CA 124.85 1.214 . . . . 0.0 112.673 -173.801 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -61.98 -11.84 15.44 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 125.053 1.341 . . . . 0.0 114.513 -178.58 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 87.9 mtm180 -60.02 -27.54 66.99 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 125.04 1.336 . . . . 0.0 113.537 173.786 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.05 -167.01 54.2 Favored Glycine 0 CA--C 1.533 1.182 0 C-N-CA 124.224 0.916 . . . . 0.0 112.05 -169.727 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 22.9 p90 -138.94 157.65 45.64 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.713 1.205 . . . . 0.0 113.969 -169.871 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 59.4 t80 -87.66 -14.46 39.91 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 126.265 1.826 . . . . 0.0 113.098 174.029 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 18.4 t80 -54.2 143.97 21.31 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 125.285 1.434 . . . . 0.0 113.562 178.27 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 15.3 t -153.89 141.21 13.46 Favored Pre-proline 0 CA--C 1.541 0.632 0 C-N-CA 127.382 2.273 . . . . 0.0 108.335 172.717 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -68.65 152.95 74.27 Favored 'Trans proline' 0 C--N 1.35 0.631 0 C-N-CA 122.637 2.225 . . . . 0.0 112.708 -171.923 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.549 0.942 0 N-CA-C 114.691 1.367 . . . . 0.0 114.691 -174.432 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 11.0 tp . . . . . 0 N--CA 1.485 1.297 0 N-CA-C 114.031 1.123 . . . . 0.0 114.031 . . . . . . . . . 0 0 . 1 . 048 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 70.3 t -57.53 -52.87 51.73 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.331 0 C-N-CA 124.622 1.169 . . . . 0.0 110.096 -177.876 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 25.6 pt-20 -66.55 0.76 2.05 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 125.468 1.507 . . . . 0.0 114.968 -179.098 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 17.9 tt0 -115.9 -50.81 2.67 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 119.097 0.862 . . . . 0.0 111.365 168.725 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 58.8 m -60.97 -28.41 68.98 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 114.283 1.216 . . . . 0.0 114.283 -177.565 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 87.8 m -73.1 -31.02 64.08 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 179.331 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 29.4 p -112.05 -44.83 3.37 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 125.579 1.552 . . . . 0.0 112.527 -169.055 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 63.2 m -101.99 168.15 9.59 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 125.908 1.683 . . . . 0.0 111.054 172.854 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 7.0 tt -81.57 132.31 31.82 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 O-C-N 120.822 -1.174 . . . . 0.0 109.151 170.865 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 17.0 p -121.61 158.65 28.14 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.447 1.099 . . . . 0.0 112.441 -176.133 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 34.1 t -98.08 151.93 19.85 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 124.322 1.049 . . . . 0.0 112.763 -173.923 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 39.8 mt -59.68 -29.7 68.26 Favored 'General case' 0 N--CA 1.471 0.585 0 O-C-N 121.632 -0.668 . . . . 0.0 111.46 171.597 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.6 t80 -62.23 -32.36 73.02 Favored 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 113.147 0.795 . . . . 0.0 113.147 172.231 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 64.9 mt-30 -78.08 -34.0 50.48 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 123.617 0.767 . . . . 0.0 111.084 175.558 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 81.5 mt -60.38 -47.88 84.17 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 118.639 0.654 . . . . 0.0 110.753 169.876 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -62.0 -32.32 72.78 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 175.191 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 15.5 t30 -59.23 -33.01 70.49 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 119.464 1.029 . . . . 0.0 113.03 179.446 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 67.6 m-85 -92.99 -0.63 57.16 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.708 1.203 . . . . 0.0 113.925 177.283 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 92.9 m -82.9 154.25 24.69 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 121.249 -0.907 . . . . 0.0 112.907 173.131 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.25 1.082 0 C-N-CA 125.819 1.648 . . . . 0.0 112.908 -176.646 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 65.8 m-85 . . . . . 0 N--CA 1.488 1.447 0 CA-C-O 118.617 -0.706 . . . . 0.0 109.403 . . . . . . . . . 0 0 . 1 . 048 nuclear orig core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 5.9 m -82.58 83.81 1.69 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 CA-C-N 120.149 1.34 . . . . 0.0 110.079 175.127 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 27.9 m120 -124.88 140.71 52.68 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.092 1.357 . . . . 0.0 112.462 -170.869 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -148.06 160.78 42.51 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.45 1.5 . . . . 0.0 111.99 -178.804 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 90.7 m-70 -99.49 130.05 45.71 Favored 'General case' 0 CA--C 1.543 0.673 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 166.506 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 54.3 mt -148.16 136.54 21.41 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 124.89 1.276 . . . . 0.0 110.077 -171.682 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.3 t -147.34 150.8 35.45 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 113.035 0.754 . . . . 0.0 113.035 -178.376 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 53.55 -130.4 42.14 Favored Glycine 0 N--CA 1.469 0.853 0 C-N-CA 124.523 1.059 . . . . 0.0 113.181 173.167 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 39.0 m -59.11 -34.14 71.68 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 123.556 0.742 . . . . 0.0 112.931 -179.365 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 18.1 m-70 -70.41 -32.17 69.69 Favored 'General case' 0 CA--C 1.538 0.483 0 O-C-N 120.621 -1.299 . . . . 0.0 113.172 175.446 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 42.9 tp -69.6 -40.07 76.88 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 118.688 0.676 . . . . 0.0 111.24 171.16 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 78.5 t -60.83 -45.8 97.38 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.078 0 C-N-CA 123.947 0.899 . . . . 0.0 110.911 172.739 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -58.42 -48.17 81.55 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 123.558 0.743 . . . . 0.0 111.4 172.757 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.7 -41.81 99.32 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 123.631 0.772 . . . . 0.0 112.229 -178.655 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 31.0 mt -58.45 -43.97 89.02 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 118.558 0.617 . . . . 0.0 111.412 174.929 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 9.4 m-85 -70.88 -31.9 68.71 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 113.764 1.024 . . . . 0.0 113.764 174.898 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 64.4 mt -71.62 -41.41 68.89 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 119.382 0.992 . . . . 0.0 112.017 175.478 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 54.5 t -73.15 -47.8 45.9 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 C-N-CA 124.527 1.131 . . . . 0.0 111.501 179.97 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 66.8 m -94.73 -10.58 31.19 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 114.815 1.413 . . . . 0.0 114.815 -172.996 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 82.03 -164.53 44.48 Favored Glycine 0 CA--C 1.53 1.001 0 C-N-CA 124.867 1.222 . . . . 0.0 112.836 -177.372 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -61.68 -11.32 11.31 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 114.801 1.408 . . . . 0.0 114.801 -178.601 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 53.6 mtm180 -56.34 -33.49 65.69 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 125.056 1.342 . . . . 0.0 112.878 171.811 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 66.04 -154.51 51.3 Favored Glycine 0 CA--C 1.535 1.299 0 C-N-CA 123.692 0.663 . . . . 0.0 112.07 -172.422 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 54.5 p90 -141.69 155.41 45.67 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.802 1.241 . . . . 0.0 113.276 -172.159 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 75.1 t80 -87.47 -28.53 22.01 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.831 1.252 . . . . 0.0 113.185 -172.939 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 50.7 t80 -62.36 149.45 42.31 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.808 1.243 . . . . 0.0 113.14 179.841 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 13.5 t -111.61 126.12 29.14 Favored Pre-proline 0 N--CA 1.474 0.727 0 C-N-CA 124.216 1.007 . . . . 0.0 109.363 171.359 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -75.47 138.52 22.03 Favored 'Trans proline' 0 N--CA 1.455 -0.753 0 C-N-CA 122.674 2.249 . . . . 0.0 111.31 -171.118 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 18.9 ptmt . . . . . 0 CA--C 1.547 0.856 0 N-CA-C 113.362 0.875 . . . . 0.0 113.362 176.009 . . . . . . . . 0 0 . 1 . 049 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 20.7 tt . . . . . 0 N--CA 1.482 1.13 0 N-CA-C 114.783 1.401 . . . . 0.0 114.783 . . . . . . . . . 0 0 . 1 . 049 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 74.1 t -59.94 -40.86 84.15 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.028 0 C-N-CA 123.253 0.621 . . . . 0.0 111.166 -175.638 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -81.86 -2.75 52.16 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 113.149 0.796 . . . . 0.0 113.149 -179.509 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 20.8 tt0 -94.55 -58.72 2.11 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 123.56 0.744 . . . . 0.0 109.706 169.351 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 85.8 m -72.19 -30.37 64.9 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 113.962 1.097 . . . . 0.0 113.962 -170.054 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 71.2 m -69.93 -46.45 65.31 Favored 'General case' 0 N--CA 1.473 0.701 0 O-C-N 120.752 -1.218 . . . . 0.0 110.706 173.371 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 21.0 m -76.86 -37.95 54.62 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 126.756 2.023 . . . . 0.0 112.871 -170.084 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.7 t -144.19 -169.19 3.06 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.963 1.305 . . . . 0.0 111.77 -174.897 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 61.2 mt -79.91 127.27 39.37 Favored 'Isoleucine or valine' 0 C--O 1.238 0.448 0 O-C-N 120.818 -1.176 . . . . 0.0 111.707 -172.719 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 4.2 m -112.5 171.33 7.58 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 127.013 2.125 . . . . 0.0 110.832 168.166 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 35.4 t -163.34 163.26 25.22 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 126.422 1.889 . . . . 0.0 108.21 -170.715 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 9.8 mp -56.98 -33.71 67.35 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 119.231 0.923 . . . . 0.0 111.976 -176.092 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 73.2 t80 -61.11 -33.09 72.82 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 124.294 1.038 . . . . 0.0 113.572 173.4 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 36.9 mt-30 -86.8 -32.25 20.44 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 125.196 1.398 . . . . 0.0 111.333 177.682 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 96.1 mt -65.46 -50.56 64.88 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.624 1.17 . . . . 0.0 110.679 173.567 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -66.48 -23.23 66.23 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 113.35 0.87 . . . . 0.0 113.35 179.416 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 19.4 t30 -59.93 -29.74 68.59 Favored 'General case' 0 CA--C 1.545 0.788 0 O-C-N 121.118 -0.989 . . . . 0.0 113.031 177.427 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 51.9 m-85 -94.47 5.5 51.62 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.565 1.546 . . . . 0.0 113.717 176.946 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 75.0 m -101.09 129.1 46.92 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.016 0.927 . . . . 0.0 112.7 -179.646 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.252 1.211 0 C-N-CA 128.086 2.554 . . . . 0.0 112.393 -169.495 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 . . . . . 0 N--CA 1.486 1.338 0 CA-C-O 119.75 -0.167 . . . . 0.0 111.109 . . . . . . . . . 0 0 . 1 . 049 nuclear orig core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 88.1 t -78.01 141.12 15.94 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.207 0 C-N-CA 124.721 1.208 . . . . 0.0 109.583 172.437 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 5.8 p-10 -134.0 158.36 43.71 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 124.919 1.288 . . . . 0.0 113.614 -174.427 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 2.6 mm-40 -176.2 -172.7 0.5 Allowed 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 127.417 2.287 . . . . 0.0 108.779 -173.052 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 5.9 m-70 -83.44 -105.37 0.04 OUTLIER 'General case' 0 CA--C 1.549 0.923 0 O-C-N 120.457 -1.402 . . . . 0.0 107.912 166.497 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 57.2 mt 113.17 124.48 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.946 1 C-N-CA 131.879 4.072 . . . . 0.0 109.425 171.478 . . . . . . . . 2 2 . 1 . 049 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 5.8 t -146.31 154.12 41.32 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.194 0.598 . . . . 0.0 112.431 -175.285 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 59.58 -136.29 50.58 Favored Glycine 0 N--CA 1.471 0.99 0 C-N-CA 123.801 0.715 . . . . 0.0 113.278 172.557 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 14.4 p -54.08 -36.99 63.75 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 124.541 1.136 . . . . 0.0 112.988 173.49 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 -69.67 -33.28 72.34 Favored 'General case' 0 CA--C 1.544 0.731 0 O-C-N 121.139 -0.975 . . . . 0.0 112.384 -179.751 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 53.7 tp -68.88 -42.48 76.92 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 118.562 0.619 . . . . 0.0 110.945 171.197 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 60.3 t -59.15 -46.77 91.79 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 C-N-CA 124.053 0.941 . . . . 0.0 111.064 174.488 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -65.69 -41.54 92.29 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 123.703 0.801 . . . . 0.0 112.137 176.679 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.75 -43.74 97.59 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 119.279 0.945 . . . . 0.0 111.529 174.823 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 62.5 mt -64.25 -40.22 95.55 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 118.299 0.499 . . . . 0.0 112.155 177.035 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 7.2 m-85 -58.14 -47.88 81.98 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.107 0.867 . . . . 0.0 111.86 170.744 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 78.5 mt -69.8 -41.63 74.78 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 124.146 0.979 . . . . 0.0 112.661 -177.156 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 60.6 t -76.82 -44.1 32.92 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 C-N-CA 123.754 0.822 . . . . 0.0 111.892 -177.268 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 73.7 m -95.9 -27.56 15.11 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 114.73 1.381 . . . . 0.0 114.73 -172.654 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 66.16 -134.76 34.14 Favored Glycine 0 N--CA 1.469 0.866 0 C-N-CA 124.216 0.913 . . . . 0.0 112.676 176.318 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -63.96 -17.92 63.76 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.248 1.419 . . . . 0.0 113.636 -177.847 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 84.9 mtm180 -61.66 -29.25 69.95 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 179.286 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.59 157.98 9.66 Favored Glycine 0 CA--C 1.534 1.234 0 C-N-CA 124.662 1.125 . . . . 0.0 113.144 -177.862 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 51.6 p90 -137.37 152.55 49.8 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.246 1.418 . . . . 0.0 113.334 -172.078 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 24.7 t80 -105.69 68.94 0.81 Allowed 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.748 1.619 . . . . 0.0 111.282 -179.749 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 50.5 t80 -67.34 117.71 9.7 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.469 1.108 . . . . 0.0 110.975 173.331 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 6.9 t -173.96 151.07 1.72 Allowed Pre-proline 0 N--CA 1.48 1.049 0 C-N-CA 125.637 1.575 . . . . 0.0 112.75 -175.656 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -89.5 -174.39 0.9 Allowed 'Trans proline' 0 CA--C 1.547 1.173 0 C-N-CA 124.493 3.462 . . . . 0.0 109.565 166.661 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 32.1 mtmm . . . . . 0 N--CA 1.481 1.075 0 O-C-N 120.282 -1.511 . . . . 0.0 112.43 170.007 . . . . . . . . 0 0 . 1 . 050 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 8.1 tp . . . . . 0 N--CA 1.477 0.917 0 N-CA-C 114.243 1.201 . . . . 0.0 114.243 . . . . . . . . . 0 0 . 1 . 050 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 40.1 t -65.22 -47.35 87.77 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 CA-C-N 118.452 0.569 . . . . 0.0 110.845 -179.14 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -64.34 -41.0 97.0 Favored 'General case' 0 CA--C 1.539 0.542 0 O-C-N 121.449 -0.782 . . . . 0.0 111.591 174.098 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 34.6 mt-30 -66.09 -35.74 81.31 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 118.374 -0.822 . . . . 0.0 112.955 -177.472 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 99.7 m -93.4 -31.18 14.73 Favored 'General case' 0 N--CA 1.47 0.525 0 N-CA-C 114.63 1.344 . . . . 0.0 114.63 179.281 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 78.2 m -86.76 -52.75 5.32 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 119.457 1.026 . . . . 0.0 111.602 -177.004 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 27.3 m -83.07 -40.8 19.4 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.731 1.212 . . . . 0.0 110.578 -174.067 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 7.9 t -112.5 -171.85 1.94 Allowed 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.398 1.079 . . . . 0.0 112.039 170.827 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 90.4 mt -96.24 128.68 47.22 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 C-N-CA 126.029 1.732 . . . . 0.0 108.522 175.596 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 21.1 p -107.9 -157.96 0.63 Allowed 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.987 0.915 . . . . 0.0 112.1 178.025 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 92.8 p -155.1 164.53 38.73 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 125.776 1.63 . . . . 0.0 111.387 -179.153 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 44.9 mt -62.01 -33.32 74.13 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 122.957 0.503 . . . . 0.0 111.601 174.381 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 93.2 t80 -63.29 -36.93 85.3 Favored 'General case' 0 CA--C 1.539 0.551 0 O-C-N 121.532 -0.73 . . . . 0.0 112.727 171.409 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -71.86 -34.58 69.34 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 118.757 -0.64 . . . . 0.0 111.739 174.687 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 95.5 mt -59.29 -49.57 77.32 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 119.503 1.047 . . . . 0.0 110.703 169.829 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -61.88 -34.37 75.91 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 113.562 0.949 . . . . 0.0 113.562 176.316 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 15.3 t30 -61.78 -27.78 68.99 Favored 'General case' 0 CA--C 1.546 0.821 0 O-C-N 121.129 -0.982 . . . . 0.0 112.79 177.92 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 66.3 m-85 -104.7 29.34 6.27 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.78 1.632 . . . . 0.0 112.814 176.008 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 93.7 m -125.59 172.97 9.3 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 126.681 1.992 . . . . 0.0 112.635 168.869 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 . . . . . 0 C--O 1.251 1.137 0 C-N-CA 124.551 1.141 . . . . 0.0 112.407 175.97 . . . . . . . . 0 0 . 1 . 050 nuclear orig core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 66.3 m-85 . . . . . 0 N--CA 1.488 1.46 0 CA-C-O 118.896 -0.573 . . . . 0.0 109.999 . . . . . . . . . 0 0 . 1 . 050 nuclear orig core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 9.1 p -62.28 -28.89 45.45 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.345 0 CA-C-N 120.145 1.338 . . . . 0.0 112.435 174.439 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 28.9 m120 -92.46 144.67 25.13 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.068 1.347 . . . . 0.0 111.94 171.54 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -175.22 167.77 3.4 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 125.699 1.599 . . . . 0.0 111.723 178.326 . . . . . . . . 2 2 . 1 . 050 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 83.8 m-70 -87.51 143.15 27.36 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 124.628 1.171 . . . . 0.0 108.967 166.049 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 73.9 mt -146.63 138.07 24.4 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 125.636 1.574 . . . . 0.0 109.346 174.825 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 1.8 t -150.09 157.6 43.3 Favored 'General case' 0 N--CA 1.469 0.491 0 O-C-N 121.291 -0.881 . . . . 0.0 113.214 176.337 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.99 -136.44 48.07 Favored Glycine 0 CA--C 1.531 1.037 0 C-N-CA 124.741 1.163 . . . . 0.0 113.388 175.038 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 21.0 m -53.58 -37.4 62.92 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.99 0.916 . . . . 0.0 112.69 177.049 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -69.7 -36.13 75.68 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 120.793 -1.192 . . . . 0.0 112.104 179.401 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 65.6 tp -64.59 -47.16 79.71 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 118.684 0.675 . . . . 0.0 110.721 170.579 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 59.0 t -61.78 -44.3 98.57 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 C-N-CA 123.91 0.884 . . . . 0.0 110.942 -179.221 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -64.12 -45.67 87.54 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 118.589 0.631 . . . . 0.0 112.18 174.408 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.94 -44.87 94.89 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 119.39 0.995 . . . . 0.0 111.747 178.388 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 28.0 tp -58.07 -47.01 84.46 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.009 1.324 . . . . 0.0 110.885 177.089 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 8.2 m-30 -63.54 -43.43 97.1 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 123.6 0.76 . . . . 0.0 112.312 176.721 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 73.9 mt -67.95 -39.37 83.41 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 123.719 0.807 . . . . 0.0 112.446 179.029 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 40.8 t -70.15 -45.94 74.13 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 123.972 0.909 . . . . 0.0 111.868 177.897 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 68.8 m -88.93 -21.64 23.48 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 114.831 1.419 . . . . 0.0 114.831 -172.343 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.24 -141.2 45.89 Favored Glycine 0 CA--C 1.53 0.97 0 C-N-CA 124.504 1.05 . . . . 0.0 113.646 170.981 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -66.11 -19.93 66.0 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.083 1.353 . . . . 0.0 113.588 -175.462 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 78.0 mtp85 -62.24 -33.71 75.11 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.827 0.851 . . . . 0.0 112.897 178.068 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.46 161.54 37.31 Favored Glycine 0 CA--C 1.534 1.259 0 C-N-CA 124.685 1.136 . . . . 0.0 113.734 -178.227 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 55.0 p90 -97.52 165.79 11.82 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.881 1.673 . . . . 0.0 112.899 -176.558 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 46.3 t80 -115.94 -36.94 3.99 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 124.82 1.248 . . . . 0.0 111.314 168.74 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 81.0 t80 52.74 98.27 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 127.45 2.3 . . . . 0.0 115.163 169.587 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 92.3 m -111.65 111.17 54.63 Favored Pre-proline 0 N--CA 1.477 0.88 0 C-N-CA 123.953 0.901 . . . . 0.0 110.836 -176.871 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -82.14 -153.21 0.04 OUTLIER 'Trans proline' 0 CA--C 1.539 0.743 0 C-N-CA 124.729 3.619 . . . . 0.0 110.391 169.89 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt . . . . . 0 CA--C 1.549 0.941 0 C-N-CA 124.537 1.135 . . . . 0.0 113.583 170.904 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.592 0 N-CA-C 112.154 -0.378 . . . . 0.0 112.154 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 13.8 tt -59.87 -20.3 19.15 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.188 0 N-CA-C 115.476 1.658 . . . . 0.0 115.476 -169.693 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 18.2 t -52.14 -41.76 33.88 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 C-N-CA 124.224 1.009 . . . . 0.0 110.647 169.036 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 -70.74 -5.24 28.45 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 179.617 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 52.6 tt0 -104.3 -63.08 1.24 Allowed 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.007 0.923 . . . . 0.0 108.938 168.014 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 68.7 m -59.1 -33.51 70.92 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 113.674 0.99 . . . . 0.0 113.674 -170.15 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 13.6 t -77.75 -26.92 50.23 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 113.371 0.878 . . . . 0.0 113.371 -172.358 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 28.5 p -116.2 -35.05 4.47 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 125.718 1.607 . . . . 0.0 112.962 -175.611 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 9.0 t -113.95 -169.04 1.44 Allowed 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 126.449 1.9 . . . . 0.0 110.601 174.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 33.8 mm -92.39 145.55 7.45 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 C-N-CA 125.021 1.328 . . . . 0.0 110.456 179.543 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 15.6 p -141.64 176.84 8.58 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.776 1.23 . . . . 0.0 111.234 169.241 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 91.2 p -153.1 164.0 38.82 Favored 'General case' 0 N--CA 1.47 0.549 0 O-C-N 121.075 -1.016 . . . . 0.0 112.918 -169.661 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 21.5 mt -57.18 -37.13 71.68 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 123.945 0.898 . . . . 0.0 112.599 -173.661 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 87.2 t80 -62.05 -28.37 69.55 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.144 0.978 . . . . 0.0 113.475 175.381 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 46.8 mt-30 -87.5 -29.8 21.09 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.398 1.079 . . . . 0.0 111.04 176.141 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 72.5 mt -67.1 -38.17 85.2 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.969 0.908 . . . . 0.0 112.325 170.536 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -52.82 -31.59 39.71 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.743 1.217 . . . . 0.0 113.392 174.297 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -62.97 -19.32 64.19 Favored 'General case' 0 CA--C 1.548 0.886 0 N-CA-C 113.653 0.983 . . . . 0.0 113.653 178.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 95.4 m-85 -107.57 2.94 24.39 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.747 1.619 . . . . 0.0 113.937 -178.184 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 98.7 m -72.0 141.66 49.35 Favored 'General case' 0 CA--C 1.537 0.461 0 O-C-N 121.148 -0.97 . . . . 0.0 113.005 177.029 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 34.5 t30 . . . . . 0 C--O 1.252 1.208 0 C-N-CA 125.458 1.503 . . . . 0.0 111.327 171.566 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 37.9 t80 . . . . . 0 N--CA 1.49 1.573 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 24.3 t 79.27 -51.33 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 C-N-CA 128.404 2.682 . . . . 0.0 112.645 175.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -141.3 111.21 6.61 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 126.738 2.015 . . . . 0.0 107.896 175.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -170.86 174.73 4.73 Favored 'General case' 0 CA--C 1.543 0.695 0 O-C-N 121.496 -0.753 . . . . 0.0 111.949 -166.043 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 94.4 m-70 -81.41 142.2 33.2 Favored 'General case' 0 CA--C 1.55 0.968 0 N-CA-C 107.283 -1.377 . . . . 0.0 107.283 163.767 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 87.4 mt -145.09 135.98 24.66 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 125.819 1.648 . . . . 0.0 110.495 178.327 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.5 t -149.66 145.48 26.75 Favored 'General case' 0 N--CA 1.471 0.608 0 O-C-N 120.865 -1.147 . . . . 0.0 113.235 178.422 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 59.95 -126.68 42.38 Favored Glycine 0 CA--C 1.528 0.862 0 C-N-CA 124.49 1.043 . . . . 0.0 112.77 176.492 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 20.3 p -52.34 -40.79 62.38 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 124.884 1.274 . . . . 0.0 113.021 176.193 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 27.6 m80 -62.93 -42.27 99.75 Favored 'General case' 0 CA--C 1.543 0.687 0 O-C-N 121.206 -0.934 . . . . 0.0 111.66 178.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 48.6 tp -69.03 -41.36 77.81 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 124.085 0.954 . . . . 0.0 111.376 176.654 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 37.8 t -62.15 -44.71 99.38 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 C-N-CA 124.513 1.125 . . . . 0.0 111.267 175.407 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -66.59 -40.07 88.73 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 118.426 0.557 . . . . 0.0 111.977 175.262 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.48 -41.82 99.06 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 119.55 1.068 . . . . 0.0 111.938 174.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 43.2 mt -59.05 -47.17 86.22 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-O 118.818 -0.611 . . . . 0.0 111.046 171.754 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 24.2 m-85 -62.93 -33.89 76.29 Favored 'General case' 0 CA--C 1.545 0.762 0 CA-C-N 120.01 1.277 . . . . 0.0 113.711 175.359 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 70.2 mt -67.24 -42.44 83.96 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 119.395 0.998 . . . . 0.0 112.054 173.051 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 55.5 t -73.52 -46.67 47.95 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 C-N-CA 123.793 0.837 . . . . 0.0 112.097 -179.462 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 33.6 m -85.37 -18.56 33.39 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 113.758 1.022 . . . . 0.0 113.758 -174.064 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 70.55 -155.22 52.88 Favored Glycine 0 CA--C 1.531 1.067 0 C-N-CA 124.709 1.147 . . . . 0.0 112.434 -174.521 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -61.72 -21.12 64.23 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.072 1.349 . . . . 0.0 113.275 -178.733 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 76.9 mtp85 -62.7 -28.18 69.77 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.22 1.008 . . . . 0.0 113.297 175.051 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.86 -166.48 53.27 Favored Glycine 0 CA--C 1.533 1.193 0 C-N-CA 124.942 1.258 . . . . 0.0 113.801 -178.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 44.1 p90 -121.63 148.42 44.58 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 126.025 1.73 . . . . 0.0 111.411 -179.058 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 27.4 p90 -85.83 -13.75 47.11 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 113.299 0.851 . . . . 0.0 113.299 175.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 71.8 t80 -63.98 154.41 34.2 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 126.081 1.752 . . . . 0.0 114.39 -177.622 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 26.3 p -132.63 134.69 25.02 Favored Pre-proline 0 N--CA 1.477 0.914 0 C-N-CA 126.382 1.873 . . . . 0.0 108.31 170.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -63.12 101.42 0.28 Allowed 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 124.371 3.381 . . . . 0.0 112.891 -168.598 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . 0.311 61.5 pttt 40.83 29.84 0.08 Allowed 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 127.849 2.46 . . . . 0.0 116.83 -174.145 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 96.9 m -100.13 95.92 7.15 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 126.208 1.803 . . . . 0.0 107.747 173.185 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 15.5 tppt? 70.6 -43.79 0.56 Allowed 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 128.491 2.716 . . . . 0.0 113.565 -179.593 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.251 1.163 0 C-N-CA 126.731 2.012 . . . . 0.0 110.96 169.59 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.688 0 N-CA-C 110.918 -0.873 . . . . 0.0 110.918 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 20.3 tt -54.2 -33.29 24.91 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.453 0 N-CA-C 115.656 1.725 . . . . 0.0 115.656 -169.313 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 6.4 p -62.32 -23.46 32.15 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.141 0 C-N-CA 124.124 0.969 . . . . 0.0 112.754 177.226 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -76.04 0.72 17.67 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.224 1.409 . . . . 0.0 112.508 175.336 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 63.4 tp60 -117.93 -54.71 2.31 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 125.042 1.337 . . . . 0.0 109.025 166.868 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 22.8 m -67.72 -26.1 65.99 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 115.419 1.637 . . . . 0.0 115.419 -170.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 37.7 t -103.0 -41.95 5.96 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 119.112 0.869 . . . . 0.0 113.085 -176.547 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 24.1 p -71.42 -33.2 69.22 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 125.986 1.715 . . . . 0.0 112.169 176.359 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.8 t -134.42 -157.81 0.83 Allowed 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.957 1.703 . . . . 0.0 109.606 173.509 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 86.4 mt -100.14 150.11 5.62 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 C-N-CA 125.887 1.675 . . . . 0.0 110.847 -176.003 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.1 p -143.42 -164.02 1.77 Allowed 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 124.148 0.979 . . . . 0.0 112.233 169.387 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 26.5 t -154.84 151.76 28.99 Favored 'General case' 0 N--CA 1.469 0.494 0 O-C-N 120.727 -1.233 . . . . 0.0 111.59 -171.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 62.6 mt -60.77 -28.52 68.8 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.888 0.875 . . . . 0.0 112.22 178.641 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 68.6 t80 -62.15 -31.05 71.49 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.529 1.132 . . . . 0.0 113.049 172.363 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 65.6 mt-30 -81.54 -35.26 30.52 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 123.736 0.814 . . . . 0.0 110.842 175.328 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 17.8 mt -58.71 -41.18 85.71 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 118.924 0.784 . . . . 0.0 111.464 172.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -56.3 -28.46 58.85 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.865 1.666 . . . . 0.0 114.167 176.776 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 15.2 t-20 -66.11 -22.26 66.39 Favored 'General case' 0 CA--C 1.547 0.829 0 O-C-N 121.264 -0.898 . . . . 0.0 112.917 176.658 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 56.7 m-85 -100.88 4.91 43.12 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.404 1.482 . . . . 0.0 113.655 -178.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 77.9 m -73.76 168.35 19.56 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.172 0.989 . . . . 0.0 112.897 171.818 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.248 0.989 0 C-N-CA 125.86 1.664 . . . . 0.0 111.966 -178.863 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 . . . . . 0 N--CA 1.483 1.194 0 CA-C-O 118.313 -0.851 . . . . 0.0 111.078 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 92.5 t -78.72 -39.39 22.61 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.252 0 CA-C-N 120.525 1.511 . . . . 0.0 111.488 -177.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 2.3 t30 59.23 75.05 0.42 Allowed 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 125.564 1.546 . . . . 0.0 112.525 169.145 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -149.51 160.79 43.18 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 124.428 1.091 . . . . 0.0 111.93 -178.146 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 98.0 m-70 -85.02 140.9 30.68 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.494 1.117 . . . . 0.0 111.214 170.833 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 62.0 mt -141.57 137.1 31.71 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 125.941 1.696 . . . . 0.0 110.112 174.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 1.8 t -140.16 143.67 36.27 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 113.132 0.79 . . . . 0.0 113.132 -175.056 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 49.91 -123.03 12.67 Favored Glycine 0 N--CA 1.469 0.896 0 C-N-CA 125.232 1.396 . . . . 0.0 114.175 169.432 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.1 p -56.28 -36.46 68.63 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 124.908 1.283 . . . . 0.0 113.048 177.242 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -73.14 -32.51 64.95 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 120.736 -1.227 . . . . 0.0 112.035 178.235 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 41.9 tp -70.74 -43.3 69.13 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.918 0.887 . . . . 0.0 111.475 172.733 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 39.1 t -59.89 -43.78 92.85 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 C-N-CA 124.497 1.119 . . . . 0.0 110.911 172.524 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -64.08 -43.66 94.76 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.598 0.759 . . . . 0.0 111.088 175.477 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.93 -41.68 99.56 Favored 'General case' 0 CA--C 1.54 0.589 0 O-C-N 121.329 -0.857 . . . . 0.0 112.249 177.009 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 21.6 mt -60.06 -46.38 89.74 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 118.547 0.612 . . . . 0.0 110.662 173.126 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 19.3 m-85 -62.05 -35.72 79.45 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 120.936 -1.102 . . . . 0.0 113.69 173.525 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 62.5 mt -70.24 -41.57 73.37 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 119.49 1.041 . . . . 0.0 111.999 176.091 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 63.0 t -71.7 -42.36 70.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 C-N-CA 123.578 0.751 . . . . 0.0 111.702 179.407 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 36.7 m -86.41 -15.21 41.01 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 114.328 1.233 . . . . 0.0 114.328 -178.144 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 72.9 -162.01 54.61 Favored Glycine 0 CA--C 1.534 1.262 0 C-N-CA 124.963 1.268 . . . . 0.0 112.781 -174.076 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -58.61 -20.72 49.83 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 125.033 1.333 . . . . 0.0 113.354 179.04 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 73.6 mtp85 -61.66 -24.16 66.55 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 125.483 1.513 . . . . 0.0 113.302 175.335 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.42 -178.45 44.76 Favored Glycine 0 CA--C 1.529 0.951 0 C-N-CA 124.74 1.162 . . . . 0.0 113.81 -179.164 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 55.3 p90 -119.01 156.54 29.44 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 125.399 1.48 . . . . 0.0 111.932 -178.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 84.6 t80 -91.38 -40.12 11.63 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.328 1.051 . . . . 0.0 113.042 -177.739 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 8.2 t80 -87.85 112.74 22.81 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 114.162 1.171 . . . . 0.0 114.162 -169.028 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 6.6 t -72.4 144.05 86.21 Favored Pre-proline 0 N--CA 1.476 0.84 0 C-N-CA 124.891 1.276 . . . . 0.0 111.275 179.183 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -73.99 167.03 28.21 Favored 'Trans proline' 0 CA--C 1.537 0.667 0 C-N-CA 123.086 2.524 . . . . 0.0 111.101 169.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 16.1 tptm -67.06 -23.74 65.9 Favored 'General case' 0 CA--C 1.547 0.865 0 O-C-N 121.217 -0.927 . . . . 0.0 113.093 178.225 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 25.2 p -72.4 -20.56 61.41 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 126.85 2.06 . . . . 0.0 112.947 170.163 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 11.3 tmtt? 80.87 119.46 0.05 Allowed 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 129.275 3.03 . . . . 0.0 112.476 170.617 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 44.4 tpt85 . . . . . 0 N--CA 1.48 1.055 0 C-N-CA 125.732 1.613 . . . . 0.0 113.216 178.371 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.572 0 N-CA-C 111.79 -0.524 . . . . 0.0 111.79 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -60.39 -39.06 79.86 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.228 0 C-N-CA 123.8 0.84 . . . . 0.0 112.159 -173.994 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 9.5 p -66.0 -36.69 78.08 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 N-CA-C 112.976 0.732 . . . . 0.0 112.976 -179.253 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 46.8 mp0 -68.6 -45.78 71.07 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 119.158 0.89 . . . . 0.0 110.759 169.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 22.5 tt0 -61.18 -49.99 74.96 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.397 1.079 . . . . 0.0 112.165 -172.87 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 1.5 m -68.99 -17.98 64.0 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 113.726 1.01 . . . . 0.0 113.726 176.503 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 48.7 t -98.83 -42.27 7.25 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 119.245 0.929 . . . . 0.0 113.214 -174.667 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 1.9 t -73.6 -26.56 60.86 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 125.352 1.461 . . . . 0.0 112.712 -179.5 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.5 t -137.34 -173.05 3.36 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 125.475 1.51 . . . . 0.0 110.821 174.525 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 63.0 mt -82.44 139.49 17.77 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 C-N-CA 124.748 1.219 . . . . 0.0 110.462 176.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 16.5 p -129.99 158.07 40.58 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.332 1.053 . . . . 0.0 111.558 168.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 22.6 t -108.63 154.96 21.24 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 124.424 1.09 . . . . 0.0 113.904 -169.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -58.52 -31.15 67.64 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.32 1.048 . . . . 0.0 111.462 174.052 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 90.1 t80 -62.1 -33.07 73.74 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.081 0.952 . . . . 0.0 112.98 173.384 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 57.4 mt-30 -76.23 -42.14 46.93 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 123.433 0.693 . . . . 0.0 109.886 174.613 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 81.3 mt -59.14 -41.96 89.52 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 118.455 0.571 . . . . 0.0 111.876 174.668 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 23.5 mt-10 -63.51 -32.53 74.01 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 171.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.4 t-20 -69.95 -23.51 63.2 Favored 'General case' 0 CA--C 1.546 0.819 0 CA-C-N 119.038 0.836 . . . . 0.0 112.772 173.067 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 13.2 m-85 -86.94 -11.04 51.79 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 124.897 1.279 . . . . 0.0 113.614 174.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 61.3 m -63.1 151.35 40.3 Favored 'General case' 0 N--CA 1.47 0.549 0 O-C-N 120.988 -1.07 . . . . 0.0 111.68 169.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 . . . . . 0 C--O 1.252 1.215 0 C-N-CA 125.072 1.349 . . . . 0.0 112.618 179.383 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 77.7 m-85 . . . . . 0 N--CA 1.486 1.349 0 CA-C-O 118.94 -0.553 . . . . 0.0 112.43 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 27.4 m -129.39 -167.48 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.126 0 C-N-CA 125.816 1.646 . . . . 0.0 110.092 -179.024 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 17.8 p-10 -60.82 117.58 5.59 Favored 'General case' 0 CA--C 1.545 0.773 0 O-C-N 121.183 -0.948 . . . . 0.0 110.484 169.755 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 36.9 mt-30 -146.6 174.95 10.96 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.422 1.489 . . . . 0.0 111.333 -167.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 38.4 m-70 -79.51 135.01 36.52 Favored 'General case' 0 CA--C 1.545 0.776 0 O-C-N 121.366 -0.834 . . . . 0.0 109.249 167.373 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 82.7 mt -136.9 121.16 17.98 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 125.931 1.692 . . . . 0.0 109.688 178.215 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 80.9 m -121.19 132.87 55.09 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.772 1.229 . . . . 0.0 111.957 -174.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 50.28 -117.99 5.55 Favored Glycine 0 N--CA 1.476 1.307 0 C-N-CA 125.349 1.452 . . . . 0.0 114.838 168.827 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.1 p -53.85 -39.58 65.75 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 125.221 1.408 . . . . 0.0 112.91 176.678 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -69.67 -34.29 73.76 Favored 'General case' 0 CA--C 1.54 0.586 0 O-C-N 121.098 -1.001 . . . . 0.0 111.826 178.599 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 59.9 tp -68.89 -44.17 73.76 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 123.574 0.75 . . . . 0.0 111.69 172.19 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 47.6 t -60.87 -43.53 95.84 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 C-N-CA 123.948 0.899 . . . . 0.0 110.741 175.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 29.1 mm-40 -64.79 -41.54 95.75 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.434 0.694 . . . . 0.0 112.062 174.083 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.45 -40.75 97.63 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 119.293 0.952 . . . . 0.0 112.047 175.298 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 43.0 mt -61.22 -43.31 99.08 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.568 0.747 . . . . 0.0 111.608 173.84 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 20.1 m-85 -61.49 -42.65 99.11 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 119.635 1.107 . . . . 0.0 112.327 172.44 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 70.4 mt -67.51 -41.57 84.21 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.933 0.893 . . . . 0.0 112.466 179.489 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 51.5 t -73.1 -47.3 48.18 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 C-N-CA 123.962 0.905 . . . . 0.0 111.478 179.441 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 65.7 m -81.67 -30.11 32.83 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 113.621 0.971 . . . . 0.0 113.621 -174.383 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 66.66 -134.43 32.69 Favored Glycine 0 CA--C 1.527 0.814 0 C-N-CA 124.056 0.836 . . . . 0.0 111.127 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 2.5 pm0 -68.24 -13.94 62.62 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 114.229 1.196 . . . . 0.0 114.229 178.08 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 84.3 mtm180 -65.25 -36.2 83.4 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.943 0.897 . . . . 0.0 112.77 179.045 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.83 177.92 40.06 Favored Glycine 0 CA--C 1.535 1.282 0 C-N-CA 124.154 0.883 . . . . 0.0 112.609 -170.573 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 51.6 p90 -153.37 161.93 41.81 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 114.419 1.266 . . . . 0.0 114.419 -171.462 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -96.39 144.04 26.89 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.634 1.574 . . . . 0.0 110.11 168.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 69.6 t80 -161.28 142.67 11.58 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.882 1.273 . . . . 0.0 111.365 -174.526 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 40.4 p -126.59 108.57 23.13 Favored Pre-proline 0 C--O 1.239 0.512 0 C-N-CA 125.118 1.367 . . . . 0.0 110.903 179.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -67.89 106.2 1.27 Allowed 'Trans proline' 0 N--CA 1.457 -0.665 0 C-N-CA 121.82 1.68 . . . . 0.0 108.117 168.161 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 21.6 ttmm 71.11 -50.72 0.69 Allowed 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 129.076 2.95 . . . . 0.0 114.281 -176.531 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 9.8 t -175.37 -39.42 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 126.481 1.912 . . . . 0.0 112.175 -175.088 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 65.9 pttt -70.17 171.2 10.11 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 124.308 1.043 . . . . 0.0 112.517 173.291 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.153 0 C-N-CA 127.905 2.482 . . . . 0.0 111.132 175.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.659 0 N-CA-C 111.463 -0.655 . . . . 0.0 111.463 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 10.4 tp -63.75 -32.98 59.07 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.044 0 CA-C-N 118.523 1.162 . . . . 0.0 112.485 179.146 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 96.0 t -63.11 -51.88 66.02 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 CA-C-N 118.519 0.6 . . . . 0.0 110.541 174.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -53.21 -48.15 68.37 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 123.571 0.748 . . . . 0.0 111.067 173.036 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 42.1 tp60 -65.64 -55.18 18.91 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.886 0.875 . . . . 0.0 111.354 -172.358 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 72.0 m -69.47 -26.45 64.58 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 -178.014 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 84.9 m -71.88 -50.44 29.3 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 119.453 1.024 . . . . 0.0 111.17 171.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -79.93 -19.34 48.29 Favored 'General case' 0 N--CA 1.478 0.965 0 N-CA-C 114.065 1.135 . . . . 0.0 114.065 -172.291 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 95.8 p -149.82 168.93 22.31 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.254 1.022 . . . . 0.0 113.09 -173.406 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 53.2 mt -69.63 125.27 27.34 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 O-C-N 121.244 -0.91 . . . . 0.0 109.504 170.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 15.3 p -117.13 -159.9 0.75 Allowed 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.693 1.197 . . . . 0.0 110.411 170.427 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 6.7 t -157.19 168.76 26.46 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 120.209 -1.557 . . . . 0.0 111.481 175.161 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 52.0 mt -63.28 -27.46 69.35 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.685 1.194 . . . . 0.0 112.839 -174.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.2 t80 -63.73 -32.43 73.93 Favored 'General case' 0 CA--C 1.546 0.79 0 O-C-N 121.282 -0.886 . . . . 0.0 113.081 169.874 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 44.6 mm-40 -75.07 -23.57 58.07 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 123.569 0.748 . . . . 0.0 111.245 175.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 30.5 mt -77.06 -48.29 18.26 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 123.892 0.877 . . . . 0.0 110.817 172.679 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 -63.11 -22.72 67.05 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 113.639 0.977 . . . . 0.0 113.639 178.026 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 16.8 t30 -54.48 -29.4 49.84 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 123.929 0.892 . . . . 0.0 112.856 169.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 97.3 m-85 -100.8 7.45 43.75 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.316 1.446 . . . . 0.0 113.429 176.807 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 22.8 t -89.76 167.78 12.61 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.885 1.274 . . . . 0.0 111.782 170.029 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 21.7 m-80 . . . . . 0 C--O 1.252 1.192 0 C-N-CA 125.136 1.374 . . . . 0.0 112.561 173.253 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 65.6 m-85 . . . . . 0 N--CA 1.487 1.413 0 N-CA-C 110.779 -0.082 . . . . 0.0 110.779 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 76.2 t -68.62 142.31 16.41 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.239 0 C-N-CA 124.438 1.095 . . . . 0.0 110.606 -179.627 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 6.4 t-20 65.08 64.55 0.62 Allowed 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 126.114 1.766 . . . . 0.0 112.679 173.425 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 47.4 mt-30 -143.33 -170.68 3.33 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 126.037 1.735 . . . . 0.0 110.308 -179.139 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 23.6 m-70 -73.7 146.24 44.59 Favored 'General case' 0 CA--C 1.545 0.761 0 O-C-N 120.897 -1.127 . . . . 0.0 109.815 167.025 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 62.9 mt -143.82 125.56 15.1 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 126.001 1.72 . . . . 0.0 109.072 174.713 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 5.6 t -137.99 149.91 46.53 Favored 'General case' 0 CA--C 1.537 0.475 0 O-C-N 121.275 -0.89 . . . . 0.0 112.993 -176.719 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 54.29 -130.46 44.7 Favored Glycine 0 N--CA 1.468 0.827 0 C-N-CA 125.028 1.299 . . . . 0.0 113.572 174.132 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.9 m -56.54 -32.02 64.71 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.306 1.043 . . . . 0.0 113.128 179.141 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -73.07 -35.91 66.76 Favored 'General case' 0 CA--C 1.543 0.696 0 O-C-N 120.862 -1.149 . . . . 0.0 112.024 177.576 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 58.9 tp -67.25 -44.89 78.29 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 123.66 0.784 . . . . 0.0 110.943 172.106 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 58.3 t -61.45 -42.46 93.94 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 123.907 0.883 . . . . 0.0 110.902 176.006 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -62.67 -44.55 95.96 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 123.329 0.652 . . . . 0.0 112.052 173.687 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.33 -40.47 96.47 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 118.784 0.72 . . . . 0.0 112.22 175.757 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 16.0 mt -59.71 -44.5 93.69 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.025 0.93 . . . . 0.0 111.774 172.68 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 20.7 m-85 -62.93 -40.66 98.32 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 119.499 1.045 . . . . 0.0 112.993 173.322 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 78.7 mt -66.92 -41.97 86.18 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.676 0.79 . . . . 0.0 112.556 177.128 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 38.9 t -71.73 -48.44 51.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 C-N-CA 124.482 1.113 . . . . 0.0 111.949 178.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 28.0 t -86.84 -37.24 17.93 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 113.31 0.856 . . . . 0.0 113.31 -170.124 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 69.63 -146.0 42.96 Favored Glycine 0 CA--C 1.533 1.187 0 C-N-CA 124.201 0.905 . . . . 0.0 112.097 -177.264 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -65.44 -15.63 62.82 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 125.136 1.375 . . . . 0.0 113.44 -178.805 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 80.1 mtm180 -60.83 -29.95 69.8 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.886 1.274 . . . . 0.0 113.734 -178.591 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 80.52 138.91 2.19 Favored Glycine 0 N--CA 1.472 1.077 0 C-N-CA 125.249 1.405 . . . . 0.0 113.336 178.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 44.2 p90 -118.75 153.24 34.74 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 125.284 1.434 . . . . 0.0 113.232 -178.057 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 26.3 p90 -120.31 37.96 4.11 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 127.844 2.458 . . . . 0.0 111.227 -177.016 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -49.34 142.16 7.88 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 125.87 1.668 . . . . 0.0 114.231 -178.892 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 11.2 p -93.13 111.09 50.15 Favored Pre-proline 0 N--CA 1.474 0.766 0 C-N-CA 125.233 1.413 . . . . 0.0 112.806 -175.442 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_endo -79.62 161.08 25.01 Favored 'Trans proline' 0 C--N 1.353 0.807 0 C-N-CA 123.758 2.972 . . . . 0.0 110.597 169.35 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 43.5 tptt -70.37 -14.43 62.56 Favored 'General case' 0 CA--C 1.549 0.908 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 -178.539 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 31.1 p -66.48 -24.74 66.46 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 125.094 1.358 . . . . 0.0 112.233 169.614 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 63.3 mttp -101.75 -49.38 4.0 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.627 1.171 . . . . 0.0 113.191 176.038 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 13.9 mmm180 . . . . . 0 N--CA 1.481 1.117 0 C-N-CA 125.081 1.352 . . . . 0.0 112.654 -173.956 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.212 0 N-CA-C 110.672 -0.971 . . . . 0.0 110.672 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 15.1 tt 156.36 -41.43 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.366 1 C-N-CA 133.089 4.555 . . . . 0.0 109.616 175.443 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 7.1 p -65.56 -23.43 32.69 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.76 0 C-N-CA 124.511 1.124 . . . . 0.0 112.95 -177.661 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 26.0 pm0 -68.96 -11.53 60.8 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.338 1.455 . . . . 0.0 113.951 169.807 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 71.6 tp60 -105.92 -45.96 4.23 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 124.056 0.943 . . . . 0.0 110.542 169.454 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 54.4 m -79.33 -29.25 42.2 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 115.907 1.817 . . . . 0.0 115.907 -171.586 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 42.0 t -98.46 -56.92 2.32 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 119.86 1.209 . . . . 0.0 113.113 -173.436 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 17.0 p -66.47 -46.81 75.12 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.103 1.361 . . . . 0.0 111.074 178.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.9 t -102.15 -161.24 0.84 Allowed 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 124.771 1.228 . . . . 0.0 110.59 168.548 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 49.4 mt -110.01 150.16 12.71 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 C-N-CA 126.59 1.956 . . . . 0.0 110.28 -179.541 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 12.2 p -141.34 158.77 43.43 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 114.571 1.322 . . . . 0.0 114.571 174.153 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 78.6 p -98.3 167.59 10.76 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 126.195 1.798 . . . . 0.0 113.478 175.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 31.4 mt -65.0 -27.63 68.96 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 121.356 -0.84 . . . . 0.0 112.053 173.644 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.5 t80 -67.02 -34.74 78.38 Favored 'General case' 0 CA--C 1.542 0.643 0 O-C-N 121.449 -0.782 . . . . 0.0 112.253 171.456 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 81.7 mt-30 -73.39 -26.5 61.01 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 118.746 -0.645 . . . . 0.0 112.073 172.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 68.7 mt -68.61 -49.45 59.18 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 119.47 1.032 . . . . 0.0 110.523 168.404 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 18.1 mm-40 -56.35 -30.56 62.78 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.71 1.204 . . . . 0.0 113.256 175.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -59.45 -24.19 63.34 Favored 'General case' 0 CA--C 1.55 0.945 0 N-CA-C 113.68 0.993 . . . . 0.0 113.68 178.549 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 78.8 m-85 -100.48 -2.46 33.09 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.224 1.41 . . . . 0.0 114.037 175.462 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 75.1 m -86.99 153.62 21.42 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 121.03 -1.044 . . . . 0.0 113.506 179.395 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 31.6 m120 . . . . . 0 C--O 1.253 1.244 0 C-N-CA 125.277 1.431 . . . . 0.0 113.241 179.46 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 22.8 p90 . . . . . 0 N--CA 1.486 1.339 0 CA-C-O 119.471 -0.3 . . . . 0.0 110.78 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 34.8 m -66.29 -21.36 28.61 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.325 0 N-CA-C 114.757 1.391 . . . . 0.0 114.757 -171.103 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 22.0 t-20 -73.96 111.63 9.31 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 169.358 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -162.97 -179.07 6.48 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 113.158 0.799 . . . . 0.0 113.158 -167.915 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 89.0 m-70 -81.95 136.76 35.26 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 123.502 0.721 . . . . 0.0 110.719 168.588 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 65.7 mt -142.04 135.02 28.79 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 126.411 1.884 . . . . 0.0 108.872 173.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 1.3 t -139.32 145.27 38.87 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 112.878 0.696 . . . . 0.0 112.878 -174.767 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 48.57 -123.34 10.1 Favored Glycine 0 N--CA 1.47 0.948 0 C-N-CA 125.197 1.38 . . . . 0.0 114.146 170.071 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 18.3 m -54.9 -36.74 65.49 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 124.606 1.162 . . . . 0.0 113.393 178.409 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 73.4 m-70 -76.62 -29.41 56.47 Favored 'General case' 0 CA--C 1.538 0.486 0 O-C-N 120.777 -1.202 . . . . 0.0 112.693 177.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 39.4 tp -69.81 -44.59 69.7 Favored 'General case' 0 N--CA 1.468 0.431 0 O-C-N 121.658 -0.651 . . . . 0.0 111.304 170.483 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 42.7 t -60.15 -44.26 94.85 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 125.15 1.38 . . . . 0.0 111.141 173.036 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -59.98 -46.78 88.32 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.993 1.317 . . . . 0.0 111.866 173.305 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.47 -43.03 99.8 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 118.942 0.792 . . . . 0.0 112.093 177.082 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 29.0 mt -58.35 -45.01 89.01 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 123.617 0.767 . . . . 0.0 111.366 174.73 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 11.5 m-85 -61.8 -44.67 96.4 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 123.243 0.617 . . . . 0.0 112.436 173.686 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 73.3 mt -68.14 -41.56 81.46 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 123.852 0.861 . . . . 0.0 112.52 -178.515 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 65.6 t -72.14 -48.79 47.59 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 C-N-CA 123.658 0.783 . . . . 0.0 111.527 -179.461 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 71.3 m -96.97 -17.24 20.2 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 115.013 1.486 . . . . 0.0 115.013 -169.487 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 67.76 -145.48 45.29 Favored Glycine 0 CA--C 1.53 1.017 0 C-N-CA 124.533 1.064 . . . . 0.0 113.834 172.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -61.06 -20.4 62.52 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.363 1.465 . . . . 0.0 113.906 -176.114 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 40.4 mtp180 -56.23 -38.53 71.2 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.032 1.333 . . . . 0.0 112.973 177.262 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.38 175.48 45.42 Favored Glycine 0 CA--C 1.535 1.337 0 C-N-CA 124.729 1.156 . . . . 0.0 113.618 -176.002 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 51.9 p90 -153.1 160.87 42.97 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.315 1.446 . . . . 0.0 113.865 -172.794 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 70.7 t80 -89.06 146.24 24.96 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.607 1.563 . . . . 0.0 110.937 170.038 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 56.4 t80 -155.26 129.36 8.81 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.846 0.858 . . . . 0.0 112.412 -178.482 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 21.3 p -146.49 159.16 45.54 Favored Pre-proline 0 N--CA 1.477 0.899 0 C-N-CA 126.739 2.015 . . . . 0.0 110.343 176.374 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -74.56 -179.83 5.22 Favored 'Trans proline' 0 C--N 1.351 0.699 0 C-N-CA 123.767 2.978 . . . . 0.0 112.202 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 48.5 mtmt -56.1 -32.68 64.39 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 124.811 1.244 . . . . 0.0 113.544 -179.367 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 24.9 p -88.44 -9.25 53.18 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 127.604 2.361 . . . . 0.0 113.934 179.71 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 58.9 tttm 72.47 -31.05 0.22 Allowed 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 128.444 2.698 . . . . 0.0 114.081 -177.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 17.3 ptm180 . . . . . 0 C--O 1.251 1.138 0 C-N-CA 126.859 2.063 . . . . 0.0 112.999 -176.087 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.32 0 CA-C-O 119.455 -0.636 . . . . 0.0 112.398 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 14.1 tt -94.39 -32.04 4.55 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.114 0 CA-C-N 118.563 1.181 . . . . 0.0 114.072 -172.497 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 50.5 t -62.93 -38.19 81.27 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.32 0 CA-C-N 119.488 1.04 . . . . 0.0 111.184 -175.181 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.1 pm0 -67.22 -7.61 25.28 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 114.105 1.15 . . . . 0.0 114.105 176.641 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 13.2 tp60 -105.6 -56.76 2.13 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.295 1.038 . . . . 0.0 110.224 168.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 19.2 m -77.29 -25.37 51.29 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 115.025 1.491 . . . . 0.0 115.025 -170.559 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 34.2 t -96.31 -42.37 8.18 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 119.569 1.077 . . . . 0.0 111.807 178.043 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 33.7 m -62.74 -37.89 88.36 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 125.263 1.425 . . . . 0.0 112.153 176.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.9 t -138.22 -170.49 2.82 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.587 1.155 . . . . 0.0 110.952 178.54 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 55.2 mt -79.0 139.87 17.73 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 C-N-CA 124.713 1.205 . . . . 0.0 110.089 175.801 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 8.7 p -136.05 157.4 46.93 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 121.907 0.86 . . . . 0.0 113.056 169.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.4 m -104.55 164.3 11.85 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 125.168 1.387 . . . . 0.0 111.749 -173.062 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 45.3 mt -56.27 -32.03 64.16 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 121.458 -0.776 . . . . 0.0 112.235 172.177 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.7 t80 -61.58 -29.78 70.24 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 124.113 0.965 . . . . 0.0 113.4 174.221 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 61.6 mm-40 -78.87 -36.43 42.23 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.317 0.647 . . . . 0.0 110.484 175.652 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 87.2 mt -64.13 -43.52 95.03 Favored 'General case' 0 CA--C 1.539 0.546 0 O-C-N 121.813 -0.554 . . . . 0.0 111.467 171.716 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -59.39 -24.19 63.24 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.601 1.56 . . . . 0.0 114.172 173.765 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.4 t30 -77.3 -29.49 53.7 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 123.951 0.901 . . . . 0.0 112.702 176.247 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 27.0 m-85 -86.23 -1.3 57.34 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 124.625 1.17 . . . . 0.0 113.884 175.16 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 57.2 m -73.5 132.2 42.62 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 123.405 0.682 . . . . 0.0 110.36 168.593 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.251 1.161 0 C-N-CA 127.168 2.187 . . . . 0.0 112.765 -172.31 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 12.5 t80 . . . . . 0 N--CA 1.489 1.478 0 CA-C-O 118.757 -0.639 . . . . 0.0 110.301 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 92.1 t -61.67 122.48 12.39 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 CA-C-N 120.224 1.375 . . . . 0.0 111.457 -174.212 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 47.4 t30 -168.27 103.0 0.44 Allowed 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 126.351 1.861 . . . . 0.0 109.312 -174.063 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 3.0 mm-40 -164.21 179.51 6.82 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.802 1.241 . . . . 0.0 111.563 -168.817 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 40.9 m-70 -72.73 138.54 46.61 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 123.775 0.83 . . . . 0.0 110.37 168.173 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 72.6 mt -140.39 126.79 20.03 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 126.925 2.09 . . . . 0.0 109.045 175.613 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 87.4 m -128.0 141.92 51.38 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.61 1.164 . . . . 0.0 112.614 -172.382 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 47.94 -121.04 6.66 Favored Glycine 0 C--N 1.343 0.941 0 C-N-CA 125.273 1.416 . . . . 0.0 114.552 169.11 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 18.1 m -54.65 -37.69 65.99 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.835 1.254 . . . . 0.0 113.105 178.382 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 77.2 m-70 -75.07 -28.52 60.39 Favored 'General case' 0 CA--C 1.543 0.68 0 O-C-N 120.958 -1.089 . . . . 0.0 112.759 176.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 28.5 tp -70.08 -43.54 70.94 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 121.353 -0.842 . . . . 0.0 111.371 170.051 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 60.8 t -61.75 -41.8 91.94 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.094 0 C-N-CA 124.348 1.059 . . . . 0.0 110.891 173.009 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -58.35 -49.87 75.69 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.894 1.277 . . . . 0.0 111.49 173.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.41 -42.4 96.08 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.532 0.733 . . . . 0.0 111.645 179.454 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 47.0 mt -56.69 -51.11 70.04 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-O 118.661 -0.685 . . . . 0.0 111.349 173.685 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -66.47 -35.18 79.65 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 119.897 1.226 . . . . 0.0 112.271 -178.193 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 83.8 mt -68.95 -41.14 78.44 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 123.611 0.765 . . . . 0.0 112.525 176.422 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 41.9 t -71.5 -46.58 62.82 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.984 0 C-N-CA 123.66 0.784 . . . . 0.0 112.002 177.389 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 72.0 m -78.13 -38.34 44.1 Favored 'General case' 0 N--CA 1.466 0.334 0 N-CA-C 113.306 0.854 . . . . 0.0 113.306 -173.072 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 56.36 -123.71 32.34 Favored Glycine 0 CA--C 1.53 1.013 0 C-N-CA 123.659 0.647 . . . . 0.0 111.912 -179.602 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 3.2 pm0 -67.01 -15.45 63.74 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.671 1.588 . . . . 0.0 114.705 178.374 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 81.8 mtp180 -67.99 -26.22 65.81 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 119.106 0.866 . . . . 0.0 112.732 178.607 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.42 168.69 20.11 Favored Glycine 0 CA--C 1.534 1.229 0 C-N-CA 124.616 1.103 . . . . 0.0 112.245 -169.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 34.3 p90 -152.96 165.68 34.78 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 125.026 1.33 . . . . 0.0 112.821 -178.423 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -132.11 104.81 7.0 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 123.933 0.893 . . . . 0.0 110.49 171.141 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 83.7 t80 -73.4 148.98 42.83 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 123.97 0.908 . . . . 0.0 111.394 171.139 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -158.02 115.51 1.81 Allowed Pre-proline 0 N--CA 1.472 0.657 0 C-N-CA 124.997 1.319 . . . . 0.0 109.659 178.694 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_endo -79.71 177.38 8.49 Favored 'Trans proline' 0 CA--C 1.534 0.508 0 C-N-CA 123.982 3.121 . . . . 0.0 112.686 -172.607 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -63.05 -24.64 68.01 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 125.036 1.334 . . . . 0.0 112.605 176.034 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 22.4 p -82.05 -9.07 59.67 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 126.746 2.018 . . . . 0.0 113.793 172.178 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 18.1 ttmm 84.73 143.29 0.06 Allowed 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 129.008 2.923 . . . . 0.0 113.662 170.188 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 13.4 ttp180 . . . . . 0 C--O 1.251 1.16 0 C-N-CA 126.466 1.906 . . . . 0.0 110.869 170.105 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.372 0 N-CA-C 109.79 -1.324 . . . . 0.0 109.79 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 14.2 tt -179.74 -51.79 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.252 0 C-N-CA 128.197 2.599 . . . . 0.0 110.96 170.31 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 2.7 t -65.73 -33.11 61.41 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.127 0 C-N-CA 123.556 0.743 . . . . 0.0 111.184 -171.655 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.5 pm0 -68.67 -8.96 47.2 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.961 1.305 . . . . 0.0 113.879 175.318 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 72.0 tp60 -103.72 -58.42 1.88 Allowed 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.108 0.963 . . . . 0.0 108.951 168.208 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 41.8 m -65.86 -31.17 71.97 Favored 'General case' 0 N--CA 1.469 0.486 0 N-CA-C 115.159 1.54 . . . . 0.0 115.159 -170.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 48.5 t -96.97 -47.34 5.85 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 119.09 0.859 . . . . 0.0 112.167 -178.398 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 32.1 m -69.95 -31.52 69.29 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 125.496 1.518 . . . . 0.0 111.887 -179.504 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.4 t -133.36 -152.87 0.51 Allowed 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.34 1.456 . . . . 0.0 109.974 172.503 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 78.5 mt -101.34 147.55 8.17 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 C-N-CA 126.522 1.929 . . . . 0.0 109.76 179.283 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.0 p -138.5 160.97 38.21 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 113.103 0.779 . . . . 0.0 113.103 169.252 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 76.6 p -105.74 163.01 13.04 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 125.46 1.504 . . . . 0.0 113.626 -174.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 81.6 mt -60.51 -33.24 72.34 Favored 'General case' 0 N--CA 1.471 0.581 0 O-C-N 121.47 -0.769 . . . . 0.0 111.984 170.18 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 91.6 t80 -65.25 -36.17 83.29 Favored 'General case' 0 N--CA 1.47 0.544 0 O-C-N 121.604 -0.685 . . . . 0.0 112.327 174.271 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 87.8 mt-30 -70.18 -40.15 74.81 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 118.563 -0.732 . . . . 0.0 111.054 172.177 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 73.0 mt -58.77 -41.52 86.78 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 119.549 1.068 . . . . 0.0 111.979 172.07 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 18.3 mt-10 -63.21 -35.68 81.13 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 113.527 0.936 . . . . 0.0 113.527 171.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 26.9 t30 -65.37 -24.07 67.14 Favored 'General case' 0 CA--C 1.547 0.837 0 O-C-N 120.94 -1.1 . . . . 0.0 112.429 174.355 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 47.6 m-85 -90.99 0.71 57.47 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 125.163 1.385 . . . . 0.0 114.056 173.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 67.2 m -71.74 149.59 45.25 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 120.93 -1.106 . . . . 0.0 111.307 169.172 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 . . . . . 0 C--O 1.251 1.184 0 C-N-CA 125.342 1.457 . . . . 0.0 112.999 -179.569 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 82.0 m-85 . . . . . 0 N--CA 1.486 1.326 0 CA-C-O 119.34 -0.362 . . . . 0.0 111.359 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 22.8 t 73.83 -50.28 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 C-N-CA 128.252 2.621 . . . . 0.0 113.21 172.633 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 3.6 m120 -99.79 134.03 43.28 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.236 1.415 . . . . 0.0 111.362 -178.671 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 2.4 mm-40 -159.75 169.94 22.57 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.977 1.311 . . . . 0.0 112.508 -178.065 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 97.0 m-70 -88.98 135.29 33.63 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.784 1.233 . . . . 0.0 109.372 167.191 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 77.5 mt -143.81 119.46 10.44 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 125.592 1.557 . . . . 0.0 109.521 -177.555 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 86.4 m -123.78 130.79 53.17 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.818 1.247 . . . . 0.0 112.543 -176.468 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 58.83 -121.12 25.54 Favored Glycine 0 N--CA 1.472 1.063 0 C-N-CA 124.815 1.198 . . . . 0.0 113.998 169.243 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 24.1 p -53.47 -43.15 67.92 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 124.437 1.095 . . . . 0.0 112.501 177.182 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 27.4 m80 -61.08 -40.74 94.84 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.313 1.045 . . . . 0.0 112.031 177.428 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 47.3 tp -66.72 -45.91 77.18 Favored 'General case' 0 C--O 1.223 -0.323 0 C-N-CA 124.117 0.967 . . . . 0.0 111.363 174.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 68.6 t -62.89 -42.16 95.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 C-N-CA 123.903 0.881 . . . . 0.0 111.241 178.339 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.7 mm-40 -59.01 -52.04 67.48 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.677 0.791 . . . . 0.0 111.216 173.436 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.79 -44.74 89.01 Favored 'General case' 0 CA--C 1.538 0.518 0 O-C-N 121.681 -0.637 . . . . 0.0 111.905 -177.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 62.5 tp -58.66 -50.03 75.38 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 125.023 1.329 . . . . 0.0 111.217 178.513 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -68.01 -35.83 78.96 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 119.437 1.017 . . . . 0.0 112.291 179.258 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 78.4 mt -67.47 -36.33 80.93 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 118.864 0.757 . . . . 0.0 112.195 176.129 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 33.4 t -67.04 -45.66 86.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 CA-C-N 118.906 0.776 . . . . 0.0 111.482 171.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 72.2 m -73.6 -34.54 65.11 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 113.655 0.983 . . . . 0.0 113.655 -176.763 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 64.49 -130.93 37.84 Favored Glycine 0 CA--C 1.529 0.931 0 C-N-CA 124.142 0.877 . . . . 0.0 111.041 -177.698 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -65.91 -15.25 62.78 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 114.47 1.285 . . . . 0.0 114.47 178.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 83.4 mtm180 -66.89 -32.75 74.21 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.21 1.004 . . . . 0.0 113.564 -176.641 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.09 176.63 44.36 Favored Glycine 0 CA--C 1.533 1.204 0 C-N-CA 123.867 0.746 . . . . 0.0 112.212 -169.587 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 45.3 p90 -149.14 159.62 44.08 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 114.881 1.437 . . . . 0.0 114.881 -168.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 76.8 t80 -100.35 136.44 40.24 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 126.601 1.961 . . . . 0.0 109.691 169.255 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 64.1 t80 -153.94 122.34 6.18 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.775 0.83 . . . . 0.0 112.283 -179.7 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 9.3 t 170.87 136.17 0.07 OUTLIER Pre-proline 0 N--CA 1.479 1.007 0 C-N-CA 129.316 3.046 . . . . 0.0 109.544 170.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -85.24 166.71 10.85 Favored 'Trans proline' 0 CA--C 1.536 0.624 0 C-N-CA 123.628 2.885 . . . . 0.0 112.07 174.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 94.0 mttt -94.78 -49.44 5.6 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 112.807 0.669 . . . . 0.0 112.807 169.408 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 30.5 p -88.54 -36.23 16.5 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 125.489 1.516 . . . . 0.0 113.499 -173.772 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 30.1 mtpp -81.78 -3.33 53.61 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 124.413 1.085 . . . . 0.0 113.846 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 74.8 ttt-85 . . . . . 0 C--O 1.253 1.247 0 C-N-CA 126.786 2.034 . . . . 0.0 112.672 -177.679 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.541 0 N-CA-C 111.84 -0.504 . . . . 0.0 111.84 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 17.8 tt -60.03 -33.65 53.8 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.256 0 N-CA-C 114.026 1.121 . . . . 0.0 114.026 -170.322 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 41.9 t -66.77 -32.55 58.53 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.99 0 C-N-CA 123.556 0.742 . . . . 0.0 111.745 -178.342 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -69.25 -48.07 62.89 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.398 0.679 . . . . 0.0 110.498 169.799 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 31.7 tt0 -69.1 -45.63 69.76 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 124.005 0.922 . . . . 0.0 111.979 -169.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 61.0 m -64.05 -24.49 67.72 Favored 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 113.617 0.969 . . . . 0.0 113.617 175.475 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 37.3 t -92.95 -42.6 9.38 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 118.746 0.703 . . . . 0.0 112.158 -177.714 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 69.6 p -79.67 -21.95 44.09 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 124.981 1.313 . . . . 0.0 113.64 179.361 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 9.0 t -142.14 -166.89 2.34 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.327 1.451 . . . . 0.0 111.099 175.326 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 71.0 mt -97.76 112.23 29.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 O-C-N 120.57 -1.331 . . . . 0.0 108.172 170.889 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 31.6 p -83.58 156.62 22.66 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 123.694 0.798 . . . . 0.0 111.298 171.036 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 48.7 m -83.59 149.64 26.43 Favored 'General case' 0 N--CA 1.471 0.613 0 O-C-N 120.747 -1.221 . . . . 0.0 111.72 -178.118 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 74.2 mt -60.81 -26.71 67.5 Favored 'General case' 0 CA--C 1.546 0.801 0 O-C-N 121.048 -1.032 . . . . 0.0 111.556 171.008 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 82.7 t80 -65.12 -28.53 69.49 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 124.885 1.274 . . . . 0.0 113.808 169.807 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 94.5 mt-30 -79.56 -36.15 38.72 Favored 'General case' 0 N--CA 1.472 0.628 0 O-C-N 121.048 -1.033 . . . . 0.0 110.279 174.59 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 82.1 mt -61.26 -42.99 99.57 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 118.598 0.635 . . . . 0.0 111.419 169.082 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 45.8 mm-40 -60.75 -34.3 74.23 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.561 1.144 . . . . 0.0 113.312 170.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 17.0 t30 -64.63 -28.65 69.76 Favored 'General case' 0 CA--C 1.546 0.817 0 O-C-N 121.021 -1.049 . . . . 0.0 112.703 179.2 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 23.8 m-85 -87.79 -12.22 45.7 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 124.547 1.139 . . . . 0.0 113.394 173.727 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 35.1 t -80.53 174.01 12.03 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.416 1.486 . . . . 0.0 111.525 168.784 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 12.6 m-80 . . . . . 0 C--O 1.251 1.146 0 C-N-CA 125.126 1.37 . . . . 0.0 112.672 171.336 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 71.1 m-85 . . . . . 0 N--CA 1.489 1.489 0 N-CA-C 111.466 0.173 . . . . 0.0 111.466 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 8.5 p -63.36 150.0 9.94 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.125 0 C-N-CA 124.734 1.214 . . . . 0.0 112.435 178.337 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 43.4 t30 81.24 178.96 0.08 Allowed 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 127.628 2.371 . . . . 0.0 113.421 172.262 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 38.0 mt-30 -134.99 -179.97 5.95 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 127.091 2.156 . . . . 0.0 110.218 -176.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 27.0 m-70 -69.68 135.67 50.13 Favored 'General case' 0 CA--C 1.546 0.821 0 O-C-N 121.202 -0.936 . . . . 0.0 110.246 168.691 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 87.7 mt -137.34 118.59 14.57 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 126.803 2.041 . . . . 0.0 109.601 -176.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 85.9 m -123.7 139.6 53.83 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.213 1.405 . . . . 0.0 111.307 -178.268 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 50.84 -123.88 18.31 Favored Glycine 0 N--CA 1.473 1.14 0 C-N-CA 124.693 1.14 . . . . 0.0 114.582 169.518 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 18.5 m -56.02 -32.74 64.28 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.542 1.137 . . . . 0.0 113.389 178.63 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 1.4 t-80 -72.72 -35.04 67.49 Favored 'General case' 0 CA--C 1.54 0.585 0 O-C-N 120.825 -1.172 . . . . 0.0 111.537 176.711 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 49.8 tp -68.43 -42.1 79.38 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 123.66 0.784 . . . . 0.0 111.474 171.446 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 65.3 t -59.94 -44.07 93.67 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 C-N-CA 123.577 0.751 . . . . 0.0 110.566 173.707 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -63.12 -44.24 96.16 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.52 0.728 . . . . 0.0 112.215 174.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.47 -39.87 94.82 Favored 'General case' 0 CA--C 1.537 0.479 0 O-C-N 121.221 -0.924 . . . . 0.0 112.179 175.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 37.0 mt -62.71 -41.7 99.28 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 123.612 0.765 . . . . 0.0 111.455 173.748 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 19.7 m-85 -61.42 -40.99 96.42 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-N 119.915 1.234 . . . . 0.0 112.376 171.601 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 77.8 mt -68.22 -42.59 79.59 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.772 0.829 . . . . 0.0 112.816 178.188 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 46.8 t -72.71 -47.43 50.23 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 124.005 0.922 . . . . 0.0 111.608 178.512 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 33.9 t -83.35 -41.37 18.29 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 113.432 0.901 . . . . 0.0 113.432 -170.393 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 70.62 -143.07 36.27 Favored Glycine 0 CA--C 1.53 1.025 0 C-N-CA 124.217 0.913 . . . . 0.0 112.514 -176.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -64.67 -18.58 65.09 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 125.234 1.414 . . . . 0.0 113.518 -178.161 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 71.0 mtm180 -60.84 -30.67 70.25 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.664 1.185 . . . . 0.0 114.084 -177.236 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 80.46 142.23 2.98 Favored Glycine 0 CA--C 1.534 1.237 0 C-N-CA 125.57 1.557 . . . . 0.0 113.352 179.628 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 52.7 p90 -129.41 155.85 45.01 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 125.199 1.4 . . . . 0.0 112.579 -177.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -85.83 143.67 28.14 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.485 1.114 . . . . 0.0 110.571 171.248 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 65.0 t80 -158.84 130.61 6.52 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.242 1.017 . . . . 0.0 112.732 -179.775 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 98.6 m -144.25 121.95 6.69 Favored Pre-proline 0 N--CA 1.475 0.803 0 C-N-CA 126.302 1.841 . . . . 0.0 108.065 170.09 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_endo -80.83 153.01 19.52 Favored 'Trans proline' 0 N--CA 1.458 -0.617 0 C-N-CA 123.053 2.502 . . . . 0.0 110.548 177.215 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 5.2 tmtt? -67.52 -14.17 62.7 Favored 'General case' 0 CA--C 1.547 0.865 0 N-CA-C 114.081 1.141 . . . . 0.0 114.081 -178.079 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 27.1 p -69.53 -29.18 66.72 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 125.643 1.577 . . . . 0.0 112.44 170.286 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -86.31 -41.33 14.65 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.436 1.094 . . . . 0.0 112.704 177.833 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 60.0 ttt85 . . . . . 0 C--O 1.252 1.187 0 C-N-CA 125.667 1.587 . . . . 0.0 112.23 -176.929 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.737 0 N-CA-C 111.093 -0.803 . . . . 0.0 111.093 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 9.2 tp -53.39 -35.52 24.94 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.335 0 C-N-CA 125.016 1.326 . . . . 0.0 114.544 -169.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 16.4 t -62.78 -33.25 59.09 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.888 0 C-N-CA 124.467 1.107 . . . . 0.0 111.72 -178.139 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -70.05 -21.53 63.16 Favored 'General case' 0 CA--C 1.544 0.72 0 O-C-N 121.508 -0.745 . . . . 0.0 112.485 176.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 72.0 tp60 -87.56 -59.34 2.28 Favored 'General case' 0 CA--C 1.535 0.375 0 O-C-N 121.516 -0.74 . . . . 0.0 110.025 170.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 63.0 m -70.52 -32.37 69.81 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 114.75 1.389 . . . . 0.0 114.75 -169.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 16.5 t -82.91 -53.62 5.71 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 119.523 1.056 . . . . 0.0 110.936 -176.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 17.7 m -77.95 -24.39 48.2 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 126.278 1.831 . . . . 0.0 112.655 -174.008 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.4 t -137.77 -167.28 2.11 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.085 1.354 . . . . 0.0 111.364 176.308 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 69.9 mt -86.04 145.26 8.01 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 C-N-CA 124.699 1.199 . . . . 0.0 109.946 175.694 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.0 p -137.83 159.27 42.46 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 114.146 1.165 . . . . 0.0 114.146 171.583 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 87.9 p -117.57 168.31 10.52 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.63 1.572 . . . . 0.0 113.394 -176.452 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 79.0 mt -57.11 -34.03 67.95 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 124.214 1.006 . . . . 0.0 112.78 177.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 89.3 t80 -61.43 -32.76 72.73 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.235 1.014 . . . . 0.0 112.583 175.189 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 90.9 mt-30 -82.75 -31.28 28.44 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.815 0.846 . . . . 0.0 111.107 177.699 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 76.1 mt -65.92 -41.35 91.52 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 118.725 0.693 . . . . 0.0 111.55 169.722 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 45.7 mm-40 -60.27 -37.51 80.65 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.911 1.285 . . . . 0.0 112.705 169.724 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.8 t-20 -61.97 -26.22 68.08 Favored 'General case' 0 CA--C 1.55 0.97 0 O-C-N 121.085 -1.009 . . . . 0.0 113.542 -175.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 51.5 m-85 -97.26 -2.0 43.6 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 125.267 1.427 . . . . 0.0 113.874 175.561 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 18.7 t -79.72 172.03 14.34 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.861 1.265 . . . . 0.0 111.394 168.826 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 9.1 m-80 . . . . . 0 C--O 1.256 1.407 0 C-N-CA 124.497 1.119 . . . . 0.0 112.494 171.723 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.48 0 CA-C-O 119.17 -0.443 . . . . 0.0 111.367 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 92.3 t -87.43 110.06 20.15 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 CA-C-N 119.513 1.051 . . . . 0.0 109.273 177.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 37.3 t30 -162.53 98.66 1.01 Allowed 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 127.312 2.245 . . . . 0.0 107.615 -179.279 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 6.1 tt0 -161.04 170.28 20.83 Favored 'General case' 0 N--CA 1.476 0.826 0 O-C-N 121.542 -0.724 . . . . 0.0 112.119 -166.264 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 31.6 m-70 -73.77 141.93 46.25 Favored 'General case' 0 CA--C 1.549 0.906 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 164.268 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 76.5 mt -145.21 133.55 21.78 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 126.884 2.073 . . . . 0.0 108.733 175.569 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.7 t -146.69 154.52 41.53 Favored 'General case' 0 N--CA 1.471 0.62 0 O-C-N 121.363 -0.836 . . . . 0.0 113.209 -178.814 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 54.99 -133.98 48.18 Favored Glycine 0 N--CA 1.471 0.989 0 C-N-CA 124.436 1.017 . . . . 0.0 113.021 176.612 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 18.4 m -54.36 -36.55 63.97 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.207 1.003 . . . . 0.0 113.028 177.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 17.5 t-160 -67.76 -39.05 84.18 Favored 'General case' 0 CA--C 1.544 0.733 0 O-C-N 120.942 -1.099 . . . . 0.0 111.721 179.598 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 39.8 tp -67.62 -42.75 81.87 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 123.569 0.747 . . . . 0.0 111.882 172.017 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 54.2 t -59.99 -43.41 92.41 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 C-N-CA 123.361 0.665 . . . . 0.0 110.867 175.244 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -64.86 -42.42 94.87 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 123.624 0.77 . . . . 0.0 112.4 174.339 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.28 -42.33 98.46 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 119.443 1.02 . . . . 0.0 112.106 174.459 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 51.0 mt -61.91 -43.08 99.57 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.688 0.795 . . . . 0.0 111.489 174.408 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 13.6 m-85 -59.79 -44.09 94.1 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 119.885 1.221 . . . . 0.0 112.329 172.224 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 74.5 mt -66.67 -42.03 87.21 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.829 0.852 . . . . 0.0 112.437 179.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 60.1 t -76.24 -49.38 25.27 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 123.359 0.664 . . . . 0.0 111.977 179.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 48.5 t -79.13 -39.62 33.11 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 113.014 0.746 . . . . 0.0 113.014 -172.209 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 69.39 -142.03 36.51 Favored Glycine 0 CA--C 1.53 1.016 0 C-N-CA 124.326 0.965 . . . . 0.0 112.296 -179.348 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -64.26 -19.08 65.15 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 125.221 1.408 . . . . 0.0 113.637 -176.658 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 80.3 mtm180 -60.73 -32.87 72.12 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.899 1.28 . . . . 0.0 113.797 -178.368 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 80.52 142.79 3.16 Favored Glycine 0 CA--C 1.534 1.263 0 C-N-CA 125.212 1.387 . . . . 0.0 113.419 -178.491 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 50.8 p90 -129.11 158.43 38.98 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.653 1.581 . . . . 0.0 112.766 -175.518 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 81.7 t80 -83.41 140.75 32.19 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.862 0.865 . . . . 0.0 110.893 169.625 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 65.1 t80 -149.46 142.47 24.86 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.714 1.206 . . . . 0.0 111.723 173.52 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 3.5 m -162.42 131.4 3.05 Favored Pre-proline 0 N--CA 1.478 0.938 0 C-N-CA 127.65 2.38 . . . . 0.0 107.325 173.077 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -72.07 113.09 3.58 Favored 'Trans proline' 0 C--N 1.35 0.656 0 C-N-CA 122.712 2.275 . . . . 0.0 110.239 178.376 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 28.4 tptp -93.2 -55.61 3.26 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.765 0.826 . . . . 0.0 111.574 -179.539 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 25.4 p -100.17 -19.16 16.56 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 126.022 1.729 . . . . 0.0 113.153 176.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 26.8 tptp -75.63 -20.2 58.67 Favored 'General case' 0 CA--C 1.553 1.058 0 C-N-CA 124.814 1.246 . . . . 0.0 113.483 174.806 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 51.7 tpt85 . . . . . 0 C--O 1.253 1.275 0 C-N-CA 125.734 1.614 . . . . 0.0 113.292 -178.37 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.408 0 CA-C-O 119.19 -0.784 . . . . 0.0 111.42 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 9.5 tt -177.16 -48.75 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.255 0 C-N-CA 127.812 2.445 . . . . 0.0 111.623 -177.535 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 8.4 p -67.56 -21.92 28.03 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 124.256 1.022 . . . . 0.0 112.445 -174.515 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -64.1 -10.19 20.99 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 125.882 1.673 . . . . 0.0 113.173 171.625 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 11.6 tt0 -113.06 -50.98 2.85 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 126.137 1.775 . . . . 0.0 109.452 168.368 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 61.0 m -67.49 -22.46 65.46 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 115.404 1.631 . . . . 0.0 115.404 -171.249 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 37.2 t -102.58 -33.76 9.35 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 119.398 0.999 . . . . 0.0 113.0 177.436 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 44.5 p -72.35 -34.53 68.08 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 125.211 1.404 . . . . 0.0 111.969 178.694 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 9.1 t -134.05 -161.32 1.13 Allowed 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 126.453 1.901 . . . . 0.0 110.031 172.844 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 66.9 mt -101.86 116.61 45.8 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 C-N-CA 124.628 1.171 . . . . 0.0 108.148 171.223 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 21.7 p -89.58 152.69 21.27 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.294 0.637 . . . . 0.0 111.111 169.777 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 36.9 t -80.61 151.32 29.1 Favored 'General case' 0 N--CA 1.47 0.561 0 O-C-N 120.902 -1.124 . . . . 0.0 112.089 -176.449 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 80.0 mt -57.96 -32.78 68.16 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 121.402 -0.811 . . . . 0.0 111.217 170.268 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 83.4 t80 -64.35 -27.43 69.01 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.053 0.941 . . . . 0.0 113.071 173.654 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 80.2 mt-30 -80.79 -39.0 27.5 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 123.399 0.68 . . . . 0.0 110.551 173.445 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 58.6 mt -57.24 -42.31 81.23 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 119.275 0.943 . . . . 0.0 111.783 172.045 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -60.54 -17.51 46.33 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 114.74 1.385 . . . . 0.0 114.74 174.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 14.6 t-20 -70.04 -24.06 63.2 Favored 'General case' 0 CA--C 1.547 0.843 0 CA-C-N 119.878 1.217 . . . . 0.0 112.963 176.014 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 88.4 m-85 -94.01 -2.06 53.59 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.118 1.367 . . . . 0.0 113.805 -177.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 82.9 m -70.03 132.2 45.52 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.61 1.164 . . . . 0.0 112.112 177.445 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.253 1.261 0 C-N-CA 128.229 2.611 . . . . 0.0 112.313 -172.447 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 72.1 m-85 . . . . . 0 N--CA 1.486 1.366 0 CA-C-O 119.439 -0.315 . . . . 0.0 110.541 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 7.6 p -161.5 144.99 4.23 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 C-N-CA 124.576 1.15 . . . . 0.0 111.245 -178.726 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 53.1 t30 -85.82 -157.8 0.35 Allowed 'General case' 0 CA--C 1.557 1.224 0 C-N-CA 125.423 1.489 . . . . 0.0 111.029 174.483 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 45.8 mm-40 -135.31 173.08 12.11 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 126.083 1.753 . . . . 0.0 110.792 175.247 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 32.4 m-70 -69.0 133.43 48.13 Favored 'General case' 0 CA--C 1.544 0.72 0 O-C-N 121.647 -0.658 . . . . 0.0 109.988 169.469 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 87.2 mt -133.84 120.47 20.49 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 125.871 1.669 . . . . 0.0 109.843 -176.244 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -121.5 140.04 52.71 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 125.05 1.34 . . . . 0.0 111.988 -179.321 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 52.94 -126.46 33.03 Favored Glycine 0 CA--C 1.53 1.006 0 C-N-CA 124.79 1.186 . . . . 0.0 114.484 169.867 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 20.6 m -56.41 -29.59 61.75 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 124.533 1.133 . . . . 0.0 113.325 178.499 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 29.6 m80 -69.47 -40.68 76.95 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 120.877 -1.139 . . . . 0.0 111.335 176.541 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 49.5 tp -65.9 -43.14 89.1 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.307 1.043 . . . . 0.0 111.153 173.657 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 41.5 t -59.87 -46.24 94.06 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 124.469 1.108 . . . . 0.0 111.188 174.364 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -64.24 -44.0 93.18 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 123.502 0.721 . . . . 0.0 111.404 177.151 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.41 -44.12 92.91 Favored 'General case' 0 CA--C 1.539 0.521 0 O-C-N 121.557 -0.715 . . . . 0.0 111.253 175.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 18.1 mt -60.31 -45.34 93.72 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.899 0.879 . . . . 0.0 111.878 175.538 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -57.51 -44.75 85.27 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 119.439 1.018 . . . . 0.0 112.759 174.236 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 10.0 mp -69.69 -41.18 75.78 Favored 'General case' 0 N--CA 1.471 0.575 0 C-N-CA 123.432 0.693 . . . . 0.0 112.454 178.888 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 29.9 t -66.46 -43.53 90.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 124.388 1.075 . . . . 0.0 111.485 178.629 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 71.2 m -72.94 -45.37 58.45 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 118.795 0.725 . . . . 0.0 112.763 -178.586 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.4 -129.68 40.21 Favored Glycine 0 CA--C 1.533 1.198 0 C-N-CA 124.269 0.938 . . . . 0.0 112.0 179.308 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -59.84 -21.16 60.55 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 125.081 1.352 . . . . 0.0 113.557 -179.514 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 83.5 mtm180 -67.94 -16.37 64.03 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.548 1.139 . . . . 0.0 113.841 177.226 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.87 159.93 25.4 Favored Glycine 0 CA--C 1.53 1.006 0 C-N-CA 125.35 1.452 . . . . 0.0 113.35 -179.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 68.8 t80 -159.15 148.27 18.48 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.482 1.113 . . . . 0.0 112.346 178.114 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 90.2 t80 -174.82 114.8 0.16 Allowed 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 127.778 2.431 . . . . 0.0 109.624 168.318 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 35.5 t80 -167.84 143.28 3.84 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 126.004 1.722 . . . . 0.0 110.439 178.558 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 10.3 p -103.4 129.21 25.89 Favored Pre-proline 0 N--CA 1.475 0.817 0 C-N-CA 124.825 1.25 . . . . 0.0 112.15 -169.71 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -85.82 150.11 9.81 Favored 'Trans proline' 0 C--N 1.352 0.734 0 C-N-CA 123.762 2.974 . . . . 0.0 111.403 176.178 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 81.7 tttt -60.79 -17.69 50.81 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 124.833 1.253 . . . . 0.0 113.867 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 7.0 m -57.83 -39.92 78.8 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 126.868 2.067 . . . . 0.0 112.52 176.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 20.5 pttp -136.46 -0.38 2.42 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 115.813 1.783 . . . . 0.0 115.813 -172.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 7.0 tpm_? . . . . . 0 C--O 1.251 1.158 0 C-N-CA 125.027 1.331 . . . . 0.0 111.361 169.49 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.644 0 N-CA-C 111.116 -0.793 . . . . 0.0 111.116 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 15.1 tt -59.16 -31.13 45.31 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 N-CA-C 115.537 1.68 . . . . 0.0 115.537 -169.204 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 4.7 p -59.64 -34.01 53.79 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.248 0 CA-C-N 119.87 1.214 . . . . 0.0 112.562 176.585 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -69.61 -14.71 62.97 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 123.982 0.913 . . . . 0.0 112.648 178.625 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 27.6 tt0 -99.89 -55.69 2.57 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.816 0.846 . . . . 0.0 111.098 171.683 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 59.6 m -59.08 -27.77 65.85 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 114.578 1.325 . . . . 0.0 114.578 -171.78 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 68.2 m -70.44 -29.86 66.56 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 113.641 0.978 . . . . 0.0 113.641 -179.086 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 33.5 p -122.66 -37.57 2.75 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 125.003 1.321 . . . . 0.0 112.781 -170.124 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 50.8 m -100.46 163.99 12.12 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.319 1.447 . . . . 0.0 110.992 171.072 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 16.0 tt -81.46 132.07 32.39 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 O-C-N 121.542 -0.724 . . . . 0.0 109.534 174.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 13.9 p -128.2 165.92 19.52 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.6 1.16 . . . . 0.0 111.975 -176.764 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 38.1 t -116.03 151.39 35.6 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 -169.456 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 9.6 mp -58.26 -28.89 65.34 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 123.707 0.803 . . . . 0.0 111.742 169.817 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 87.7 t80 -60.36 -32.37 71.22 Favored 'General case' 0 CA--C 1.541 0.622 0 O-C-N 121.623 -0.673 . . . . 0.0 112.567 171.583 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 56.9 mt-30 -80.49 -35.24 35.01 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 123.953 0.901 . . . . 0.0 111.017 176.676 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 82.4 mt -59.27 -43.12 92.52 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-N 118.459 0.572 . . . . 0.0 111.189 171.294 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -68.5 -33.68 74.57 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 123.675 0.79 . . . . 0.0 112.972 172.779 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 22.7 t-20 -66.22 -33.19 75.2 Favored 'General case' 0 CA--C 1.546 0.801 0 O-C-N 120.606 -1.309 . . . . 0.0 112.356 176.287 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 19.2 m-85 -82.59 -1.46 50.9 Favored 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 125.513 1.525 . . . . 0.0 113.658 171.161 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 10.6 t -86.78 179.5 6.74 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 124.844 1.257 . . . . 0.0 112.17 170.02 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 . . . . . 0 C--O 1.253 1.244 0 C-N-CA 125.578 1.551 . . . . 0.0 113.235 179.776 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 34.0 t80 . . . . . 0 N--CA 1.49 1.557 0 CA-C-O 119.435 -0.317 . . . . 0.0 110.829 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 7.0 p -60.76 -23.96 30.75 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 C-N-CA 124.731 1.212 . . . . 0.0 114.054 -173.742 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 2.9 p30 -137.99 136.65 37.13 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.949 1.3 . . . . 0.0 109.646 167.718 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 5.0 tt0 -169.23 169.31 9.32 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.163 0.985 . . . . 0.0 111.246 -167.336 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 99.6 m-70 -85.12 142.77 29.28 Favored 'General case' 0 CA--C 1.543 0.703 0 O-C-N 121.381 -0.825 . . . . 0.0 108.782 165.5 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 86.0 mt -148.66 132.15 16.7 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 125.827 1.651 . . . . 0.0 109.65 -179.039 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.7 t -145.16 136.09 24.68 Favored 'General case' 0 N--CA 1.469 0.522 0 O-C-N 121.346 -0.846 . . . . 0.0 113.068 -178.348 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 58.56 -122.8 31.2 Favored Glycine 0 N--CA 1.469 0.862 0 C-N-CA 124.564 1.078 . . . . 0.0 112.962 174.795 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 25.8 p -54.36 -34.77 61.83 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.767 1.227 . . . . 0.0 113.281 176.8 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 35.1 m80 -68.49 -40.77 80.78 Favored 'General case' 0 CA--C 1.543 0.708 0 O-C-N 120.909 -1.12 . . . . 0.0 111.599 177.311 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 63.4 tp -67.92 -43.43 79.21 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 123.807 0.843 . . . . 0.0 110.999 175.06 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 44.9 t -59.49 -46.02 93.26 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 124.131 0.973 . . . . 0.0 110.647 174.625 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -63.37 -43.31 97.99 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.524 0.729 . . . . 0.0 111.65 176.179 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.65 -42.89 97.91 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 118.911 0.778 . . . . 0.0 112.192 174.679 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 49.0 mt -62.16 -39.54 92.98 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 118.718 0.69 . . . . 0.0 111.879 175.474 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 30.4 m-85 -67.58 -38.32 83.87 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 119.407 1.003 . . . . 0.0 113.104 172.665 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 75.4 mt -69.33 -44.28 71.99 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 119.295 0.952 . . . . 0.0 112.079 176.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 73.9 t -77.54 -41.05 29.02 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 C-N-CA 124.49 1.116 . . . . 0.0 112.171 -177.297 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -139.43 8.77 2.44 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 115.925 1.824 . . . . 0.0 115.925 -168.75 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -61.95 -31.04 77.1 Favored Glycine 0 N--CA 1.476 1.359 0 CA-C-N 120.135 1.334 . . . . 0.0 114.725 -171.654 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -78.48 -33.96 47.88 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 118.198 0.999 . . . . 0.0 112.623 176.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 81.2 mtm180 -72.71 -29.01 63.02 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 124.079 0.952 . . . . 0.0 111.806 170.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 83.19 109.03 0.5 Allowed Glycine 0 CA--C 1.529 0.911 0 C-N-CA 126.549 2.023 . . . . 0.0 111.196 -179.262 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 50.6 p90 -86.83 145.27 26.67 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.44 0.696 . . . . 0.0 112.209 175.526 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -82.74 -28.57 30.33 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.205 1.002 . . . . 0.0 112.643 -177.176 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 49.6 t80 -66.04 151.63 46.42 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 114.822 1.416 . . . . 0.0 114.822 -171.49 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 49.0 m -138.45 122.48 11.5 Favored Pre-proline 0 CA--C 1.539 0.531 0 C-N-CA 125.957 1.703 . . . . 0.0 107.687 169.029 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 78.3 Cg_exo -56.58 156.92 20.49 Favored 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 123.729 2.953 . . . . 0.0 113.778 177.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 58.3 tptt -59.68 -29.89 68.39 Favored 'General case' 0 CA--C 1.549 0.92 0 N-CA-C 113.032 0.753 . . . . 0.0 113.032 173.211 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 21.7 p -81.36 -19.88 41.77 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 126.91 2.084 . . . . 0.0 113.583 173.187 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 54.2 mtmt 71.15 164.35 0.28 Allowed 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 128.814 2.846 . . . . 0.0 114.234 175.546 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 86.8 mtm-85 . . . . . 0 C--O 1.255 1.383 0 C-N-CA 125.464 1.506 . . . . 0.0 111.781 173.618 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.52 0 N-CA-C 111.818 -0.513 . . . . 0.0 111.818 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 12.3 tt -87.72 -28.7 5.53 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 N-CA-C 114.056 1.132 . . . . 0.0 114.056 -175.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 9.3 p -63.83 -35.62 73.82 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.265 0 CA-C-N 120.458 1.481 . . . . 0.0 112.566 -177.847 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -72.04 -8.9 57.2 Favored 'General case' 0 CA--C 1.547 0.835 0 N-CA-C 113.471 0.915 . . . . 0.0 113.471 176.262 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 21.7 tt0 -93.73 -58.51 2.24 Favored 'General case' 0 N--CA 1.464 0.246 0 C-N-CA 124.788 1.235 . . . . 0.0 109.083 168.607 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 71.4 m -72.33 -22.3 61.2 Favored 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 114.555 1.317 . . . . 0.0 114.555 -169.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 4.7 t -77.51 -18.25 57.21 Favored 'General case' 0 N--CA 1.473 0.72 0 O-C-N 121.453 -0.779 . . . . 0.0 112.471 171.853 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 31.7 m -103.78 -42.56 5.58 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 126.663 1.985 . . . . 0.0 111.463 -173.216 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 67.3 m -124.54 168.7 12.75 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 126.795 2.038 . . . . 0.0 111.856 -179.478 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 31.8 mm -66.54 133.73 30.87 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 O-C-N 120.749 -1.219 . . . . 0.0 109.638 171.224 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.7 m -116.32 158.78 22.88 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 122.645 1.212 . . . . 0.0 113.534 175.614 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 20.9 t -122.43 162.29 21.94 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 126.443 1.897 . . . . 0.0 112.443 -176.244 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.4 mp -64.12 -32.96 74.71 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 124.707 1.203 . . . . 0.0 111.923 -176.414 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 82.3 t80 -61.67 -30.79 70.96 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 123.701 0.8 . . . . 0.0 112.773 175.828 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 -78.21 -33.92 49.69 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.817 0.847 . . . . 0.0 110.667 176.766 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 90.2 mt -66.49 -46.49 76.11 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 118.644 0.656 . . . . 0.0 111.678 171.47 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 -64.11 -20.87 66.27 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 113.803 1.038 . . . . 0.0 113.803 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.7 t30 -57.01 -28.26 62.31 Favored 'General case' 0 CA--C 1.548 0.878 0 CA-C-N 119.356 0.98 . . . . 0.0 112.978 172.676 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 98.0 m-85 -98.61 -2.78 37.69 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.395 1.478 . . . . 0.0 113.487 178.547 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 12.3 t -84.65 -149.56 0.11 Allowed 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 125.989 1.716 . . . . 0.0 111.025 173.71 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 41.1 m-80 . . . . . 0 C--O 1.255 1.364 0 C-N-CA 127.045 2.138 . . . . 0.0 112.177 176.758 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 50.9 t80 . . . . . 0 N--CA 1.484 1.262 0 CA-C-O 119.627 -0.225 . . . . 0.0 111.019 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 7.1 p -70.18 -38.21 74.02 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.3 0 C-N-CA 124.023 0.929 . . . . 0.0 113.37 -173.541 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -74.23 111.68 9.64 Favored 'General case' 0 CA--C 1.544 0.718 0 N-CA-C 108.218 -1.03 . . . . 0.0 108.218 169.186 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 -170.64 172.34 5.89 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 123.932 0.893 . . . . 0.0 110.965 -165.219 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 95.1 m-70 -68.29 138.83 55.81 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 107.261 -1.385 . . . . 0.0 107.261 163.277 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 92.7 mt -138.2 126.39 22.95 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 125.177 1.391 . . . . 0.0 109.204 -178.334 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 6.3 t -146.42 145.11 30.13 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 123.312 0.645 . . . . 0.0 111.665 -174.651 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 51.92 -128.13 32.97 Favored Glycine 0 N--CA 1.472 1.091 0 C-N-CA 124.457 1.027 . . . . 0.0 112.75 175.822 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 36.2 m -58.73 -31.42 68.27 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 113.275 0.843 . . . . 0.0 113.275 179.277 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -72.05 -36.82 69.71 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 119.16 0.891 . . . . 0.0 111.641 176.571 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 57.5 tp -65.95 -47.29 75.14 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 118.591 0.632 . . . . 0.0 110.74 171.336 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 54.1 t -60.99 -43.76 96.76 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 C-N-CA 123.525 0.73 . . . . 0.0 110.618 -179.724 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -64.4 -46.25 84.11 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.602 0.761 . . . . 0.0 112.056 175.153 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.4 -42.3 99.32 Favored 'General case' 0 CA--C 1.539 0.548 0 O-C-N 121.408 -0.808 . . . . 0.0 111.857 177.5 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 46.0 tp -63.5 -41.22 98.55 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.652 1.181 . . . . 0.0 111.252 177.238 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 7.2 m-85 -60.41 -45.9 91.95 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 119.253 0.933 . . . . 0.0 112.435 169.831 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 72.2 mt -65.94 -43.5 87.86 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 123.305 0.642 . . . . 0.0 112.377 -179.378 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 53.2 t -76.97 -37.77 27.29 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 123.877 0.871 . . . . 0.0 112.327 -177.723 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 44.1 t -77.2 -41.82 39.92 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 118.779 0.718 . . . . 0.0 112.569 177.72 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 73.07 -148.21 40.8 Favored Glycine 0 CA--C 1.529 0.951 0 C-N-CA 124.646 1.117 . . . . 0.0 112.744 179.587 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -62.49 -19.98 64.13 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.257 1.423 . . . . 0.0 113.733 -177.522 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 86.9 mtm180 -57.32 -35.1 69.44 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 125.237 1.415 . . . . 0.0 114.043 179.153 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.07 144.9 2.42 Favored Glycine 0 CA--C 1.532 1.123 0 C-N-CA 125.272 1.415 . . . . 0.0 113.4 -178.148 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 48.0 p90 -113.23 151.2 31.34 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.186 1.395 . . . . 0.0 112.007 177.886 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 37.9 p90 -93.43 -10.09 36.32 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 114.34 1.237 . . . . 0.0 114.34 -178.646 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 74.7 t80 -70.2 148.25 48.84 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.934 1.294 . . . . 0.0 114.283 -177.761 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 85.7 m -127.47 131.2 23.71 Favored Pre-proline 0 N--CA 1.478 0.938 0 C-N-CA 126.389 1.876 . . . . 0.0 107.862 170.231 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -67.2 133.04 29.4 Favored 'Trans proline' 0 C--N 1.351 0.677 0 C-N-CA 122.888 2.392 . . . . 0.0 112.337 -173.14 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 84.0 tttt -66.49 -22.5 66.19 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 124.163 0.985 . . . . 0.0 112.971 177.875 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 34.5 p -81.28 -6.79 59.27 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 127.297 2.239 . . . . 0.0 113.521 171.534 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 57.5 tttm 75.0 -28.49 0.19 Allowed 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 128.679 2.792 . . . . 0.0 114.31 176.784 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 1.4 ttp180 . . . . . 0 C--O 1.252 1.2 0 C-N-CA 128.47 2.708 . . . . 0.0 111.729 176.762 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.622 0 N-CA-C 111.138 -0.785 . . . . 0.0 111.138 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 8.7 tp -51.43 -34.97 15.89 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.202 0 C-N-CA 125.761 1.624 . . . . 0.0 114.114 -170.567 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 5.7 p -62.58 -29.67 47.44 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 C-N-CA 123.556 0.742 . . . . 0.0 112.89 -179.522 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -76.86 -8.24 56.97 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 119.566 1.075 . . . . 0.0 112.855 179.188 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 79.7 mm-40 -97.19 -59.95 1.68 Allowed 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.985 0.914 . . . . 0.0 108.869 169.039 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 94.5 m -69.09 -29.03 67.04 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 114.923 1.453 . . . . 0.0 114.923 -170.538 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 7.9 t -80.65 -43.26 20.73 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 119.392 0.996 . . . . 0.0 111.03 176.847 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 23.2 m -68.97 -38.14 79.19 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 127.011 2.124 . . . . 0.0 112.917 -175.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.4 t -146.79 -172.04 3.89 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.949 1.299 . . . . 0.0 111.146 179.459 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 50.1 mt -76.64 124.0 34.11 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 O-C-N 120.893 -1.129 . . . . 0.0 109.0 170.72 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 23.8 p -103.25 157.76 16.79 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.062 0.945 . . . . 0.0 111.453 170.635 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 34.4 t -92.8 156.21 17.14 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.57 0.748 . . . . 0.0 111.847 179.687 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 59.2 mt -58.4 -29.36 66.01 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 123.398 0.679 . . . . 0.0 111.719 172.684 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.3 t80 -62.84 -33.04 74.41 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 113.16 0.8 . . . . 0.0 113.16 172.289 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 60.6 mm-40 -77.02 -34.55 57.33 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 123.281 0.633 . . . . 0.0 110.721 175.919 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 95.6 mt -65.1 -44.37 89.05 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 118.552 0.614 . . . . 0.0 111.186 171.772 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.427 ' HA ' ' SG ' ' A' ' 20' ' ' CYS . 24.6 mt-10 -63.85 -25.5 68.19 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 113.907 1.077 . . . . 0.0 113.907 175.929 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 -63.05 -21.25 66.04 Favored 'General case' 0 CA--C 1.547 0.832 0 CA-C-N 119.14 0.882 . . . . 0.0 112.87 175.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 73.7 m-85 -102.01 -0.21 34.02 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.161 1.384 . . . . 0.0 114.389 177.024 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.427 ' SG ' ' HA ' ' A' ' 17' ' ' GLU . 67.4 m -65.31 144.75 56.93 Favored 'General case' 0 CA--C 1.544 0.746 0 CA-C-N 119.373 0.988 . . . . 0.0 110.473 169.132 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 21.4 t-20 . . . . . 0 C--O 1.255 1.347 0 C-N-CA 124.867 1.267 . . . . 0.0 113.105 -175.643 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 68.5 t80 . . . . . 0 N--CA 1.484 1.23 0 CA-C-O 119.931 -0.081 . . . . 0.0 110.898 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 16.9 m -67.66 148.82 11.78 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.025 0 C-N-CA 124.181 0.993 . . . . 0.0 112.566 -178.422 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 42.9 54.9 4.6 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 126.123 1.769 . . . . 0.0 114.483 174.696 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 3.1 mm-40 -145.54 -177.21 5.45 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.963 1.705 . . . . 0.0 110.832 -175.258 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 27.6 m-70 -64.48 131.21 46.47 Favored 'General case' 0 CA--C 1.546 0.809 0 O-C-N 121.312 -0.868 . . . . 0.0 109.836 168.238 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 78.4 mt -141.77 127.02 18.6 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 126.2 1.8 . . . . 0.0 109.07 -177.79 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.7 t -145.14 143.43 30.35 Favored 'General case' 0 N--CA 1.472 0.653 0 O-C-N 121.357 -0.839 . . . . 0.0 112.327 -175.322 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 56.68 -127.43 44.24 Favored Glycine 0 CA--C 1.531 1.081 0 C-N-CA 124.165 0.888 . . . . 0.0 113.252 175.293 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 31.6 p -56.82 -33.7 67.0 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.731 1.213 . . . . 0.0 113.706 177.277 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 19.1 t-160 -70.89 -37.32 73.01 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 121.119 -0.988 . . . . 0.0 111.576 176.377 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 43.1 tp -69.97 -41.68 74.14 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 123.78 0.832 . . . . 0.0 111.747 172.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 37.8 t -58.16 -46.14 88.52 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 C-N-CA 124.152 0.981 . . . . 0.0 110.472 172.812 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -64.48 -42.61 95.79 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.829 0.852 . . . . 0.0 112.219 176.517 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.35 -40.69 95.2 Favored 'General case' 0 CA--C 1.538 0.516 0 O-C-N 121.347 -0.846 . . . . 0.0 112.14 174.477 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 47.8 mt -65.16 -39.06 92.43 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.522 -0.736 . . . . 0.0 112.047 174.896 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 15.7 m-85 -59.56 -44.3 93.33 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 119.568 1.076 . . . . 0.0 112.037 170.052 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 80.8 mt -68.9 -43.2 75.73 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.95 0.9 . . . . 0.0 112.62 179.615 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 42.2 t -72.29 -48.23 49.38 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 124.204 1.002 . . . . 0.0 111.821 -179.048 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 84.6 m -77.54 -34.39 53.91 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 121.432 -0.793 . . . . 0.0 113.0 -177.344 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 65.02 -132.26 36.57 Favored Glycine 0 CA--C 1.527 0.821 0 C-N-CA 124.06 0.838 . . . . 0.0 111.748 179.079 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -63.12 -20.16 65.11 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 124.533 1.133 . . . . 0.0 113.257 178.874 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 85.3 mtm180 -63.83 -35.32 80.23 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.795 0.838 . . . . 0.0 113.022 179.127 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.53 179.14 34.37 Favored Glycine 0 CA--C 1.537 1.452 0 C-N-CA 124.488 1.042 . . . . 0.0 112.9 -169.868 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 46.6 p90 -158.29 169.47 24.41 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 125.416 1.486 . . . . 0.0 113.658 -172.572 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 69.6 t80 -121.85 112.95 18.97 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.302 1.441 . . . . 0.0 110.252 173.093 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 45.7 t80 -74.93 138.22 42.21 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 123.552 0.741 . . . . 0.0 111.739 177.814 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 23.2 p -128.09 108.03 19.87 Favored Pre-proline 0 N--CA 1.478 0.957 0 C-N-CA 124.375 1.07 . . . . 0.0 111.825 179.507 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 31.0 Cg_exo -66.85 171.06 11.6 Favored 'Trans proline' 0 CA--C 1.538 0.681 0 C-N-CA 124.237 3.291 . . . . 0.0 112.072 168.853 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 60.4 tttp -73.79 -27.4 61.12 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 112.847 0.684 . . . . 0.0 112.847 169.635 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 23.7 p -75.22 -34.77 61.5 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 125.682 1.593 . . . . 0.0 113.08 -176.512 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 51.3 mtpt -78.97 133.33 36.87 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 123.374 0.67 . . . . 0.0 111.622 177.451 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 7.1 tpm_? . . . . . 0 C--O 1.252 1.235 0 C-N-CA 127.072 2.149 . . . . 0.0 111.196 -173.753 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.777 0 N-CA-C 112.423 -0.271 . . . . 0.0 112.423 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 10.8 tp -59.86 -33.71 53.49 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 O-C-N 121.487 -1.007 . . . . 0.0 113.516 -172.287 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 58.2 t -68.64 -23.89 28.41 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 C-N-CA 123.71 0.804 . . . . 0.0 112.241 179.064 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -80.74 -46.47 15.42 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.639 -0.663 . . . . 0.0 110.063 168.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 13.2 tp60 -68.31 -46.69 69.57 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.191 0.996 . . . . 0.0 112.853 -169.509 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 61.5 m -72.15 -21.13 61.5 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 113.12 0.785 . . . . 0.0 113.12 176.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 10.8 t -88.11 -48.62 7.6 Favored 'General case' 0 N--CA 1.467 0.395 0 O-C-N 121.407 -0.808 . . . . 0.0 111.632 -176.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 68.2 p -75.75 -22.44 56.5 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 125.03 1.332 . . . . 0.0 113.558 -178.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.3 t -150.24 -175.28 5.01 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.652 1.181 . . . . 0.0 111.743 178.19 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 62.4 mt -76.79 134.53 28.6 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 C-N-CA 124.551 1.141 . . . . 0.0 110.019 176.248 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.9 p -126.31 160.63 29.82 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.964 1.306 . . . . 0.0 110.973 170.271 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 90.3 p -110.82 165.36 11.91 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.44 1.096 . . . . 0.0 112.714 -179.103 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 10.2 mp -58.29 -28.34 64.91 Favored 'General case' 0 N--CA 1.473 0.681 0 O-C-N 121.609 -0.682 . . . . 0.0 112.515 173.602 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 78.3 t80 -64.31 -33.92 76.95 Favored 'General case' 0 CA--C 1.542 0.666 0 O-C-N 121.59 -0.694 . . . . 0.0 112.857 172.521 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 65.7 mm-40 -75.66 -24.24 56.36 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.623 0.769 . . . . 0.0 111.984 173.209 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 81.2 mt -75.93 -47.24 26.02 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 119.238 0.926 . . . . 0.0 111.447 172.268 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -65.29 -20.42 66.4 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 113.192 0.812 . . . . 0.0 113.192 177.146 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.5 t30 -54.79 -30.29 56.52 Favored 'General case' 0 CA--C 1.549 0.92 0 CA-C-N 119.144 0.884 . . . . 0.0 113.235 171.732 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 98.2 m-85 -98.18 -2.06 40.72 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.583 1.553 . . . . 0.0 113.646 178.567 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 11.3 t -78.31 169.5 18.16 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.465 1.506 . . . . 0.0 111.533 171.192 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 9.9 m-80 . . . . . 0 C--O 1.252 1.233 0 C-N-CA 124.857 1.263 . . . . 0.0 112.409 173.943 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 67.6 t80 . . . . . 0 N--CA 1.486 1.347 0 CA-C-O 119.681 -0.2 . . . . 0.0 110.697 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 13.0 m -80.71 68.56 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 C-N-CA 125.042 1.337 . . . . 0.0 111.144 177.149 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 39.7 p-10 -156.2 147.9 22.86 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.47 1.508 . . . . 0.0 113.426 -174.49 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 1.6 mm-40 -176.44 177.26 1.49 Allowed 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 126.982 2.113 . . . . 0.0 110.569 -177.551 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 27.0 m-70 -77.44 141.45 39.72 Favored 'General case' 0 CA--C 1.548 0.885 0 O-C-N 120.948 -1.095 . . . . 0.0 109.603 166.458 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 69.8 mt -144.12 135.56 25.77 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 126.521 1.928 . . . . 0.0 109.119 174.141 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 5.5 t -149.33 142.7 25.23 Favored 'General case' 0 N--CA 1.473 0.676 0 O-C-N 121.138 -0.976 . . . . 0.0 112.944 -177.464 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 62.57 -131.1 43.87 Favored Glycine 0 CA--C 1.529 0.941 0 C-N-CA 124.613 1.102 . . . . 0.0 113.321 175.46 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 26.1 p -56.02 -35.26 66.66 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 124.734 1.214 . . . . 0.0 113.026 177.6 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 23.6 m80 -64.48 -42.15 96.06 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.193 0.997 . . . . 0.0 111.613 176.541 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 48.0 tp -70.41 -42.51 71.56 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 123.928 0.891 . . . . 0.0 111.68 176.583 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 55.9 t -60.37 -44.28 95.68 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 123.293 0.637 . . . . 0.0 110.694 174.829 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -64.45 -43.09 95.35 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.819 0.848 . . . . 0.0 111.999 175.343 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.37 -44.01 96.02 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 118.609 0.64 . . . . 0.0 111.684 174.449 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 31.8 mt -59.9 -43.67 94.68 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 118.87 0.759 . . . . 0.0 111.345 175.606 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 20.8 m-85 -60.59 -44.87 95.76 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 119.131 0.878 . . . . 0.0 112.624 173.546 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 81.3 mt -69.36 -43.92 72.62 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 123.694 0.797 . . . . 0.0 112.493 -179.502 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 69.6 t -78.03 -40.92 26.9 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 124.766 1.226 . . . . 0.0 111.796 -174.074 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 48.7 t -78.19 -41.43 34.58 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 118.781 0.718 . . . . 0.0 112.282 176.459 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 72.25 -146.83 39.96 Favored Glycine 0 CA--C 1.531 1.064 0 C-N-CA 124.325 0.964 . . . . 0.0 112.741 178.524 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -60.79 -21.1 62.75 Favored 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 125.465 1.506 . . . . 0.0 113.561 -176.663 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 89.1 mtm180 -56.8 -36.12 69.53 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.968 1.307 . . . . 0.0 113.029 175.889 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 80.07 140.71 2.41 Favored Glycine 0 CA--C 1.534 1.273 0 C-N-CA 125.352 1.453 . . . . 0.0 112.935 -178.482 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 38.7 p90 -119.04 162.91 17.78 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.819 1.248 . . . . 0.0 112.258 179.857 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 4.1 t80 -145.31 85.1 1.71 Allowed 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.891 1.276 . . . . 0.0 109.452 175.373 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -78.4 169.4 18.31 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 115.614 1.709 . . . . 0.0 115.614 -173.089 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 87.7 m -106.31 100.92 32.18 Favored Pre-proline 0 N--CA 1.476 0.857 0 C-N-CA 125.572 1.549 . . . . 0.0 109.53 173.824 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -92.55 143.55 2.44 Favored 'Trans proline' 0 C--N 1.35 0.647 0 C-N-CA 123.406 2.738 . . . . 0.0 113.162 -177.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt 70.78 -45.89 0.62 Allowed 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 128.801 2.84 . . . . 0.0 115.761 168.607 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 10.9 t -176.08 -143.88 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 128.895 2.878 . . . . 0.0 107.268 -170.037 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -63.49 148.42 48.7 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 124.949 1.3 . . . . 0.0 112.148 172.339 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 81.3 mtt180 . . . . . 0 C--O 1.252 1.201 0 C-N-CA 124.609 1.164 . . . . 0.0 112.624 178.623 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.765 0 N-CA-C 111.952 -0.459 . . . . 0.0 111.952 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 11.2 tp -58.73 -38.52 72.45 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.174 0 N-CA-C 114.25 1.204 . . . . 0.0 114.25 -169.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 47.9 t -62.24 -35.66 70.31 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.134 0 CA-C-N 118.624 0.647 . . . . 0.0 111.334 176.267 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -76.67 -7.66 55.73 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.463 1.105 . . . . 0.0 112.91 -179.454 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 35.9 tp60 -103.01 -57.52 2.03 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.935 1.294 . . . . 0.0 109.861 173.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 83.4 m -74.34 -25.55 59.61 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 115.16 1.541 . . . . 0.0 115.16 -169.522 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 72.3 m -77.24 -23.31 51.32 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 119.373 0.988 . . . . 0.0 113.019 -179.692 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 18.0 p -114.09 -48.13 2.91 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 125.966 1.707 . . . . 0.0 111.747 -171.315 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 73.2 m -96.67 169.91 9.56 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.505 1.522 . . . . 0.0 111.437 172.087 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 61.8 mt -77.69 130.1 36.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 O-C-N 120.939 -1.101 . . . . 0.0 109.034 172.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.3 m -97.56 155.81 16.79 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 122.343 1.068 . . . . 0.0 112.756 173.223 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 90.5 p -118.33 162.76 17.76 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 126.665 1.986 . . . . 0.0 110.996 177.504 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 58.3 mt -62.55 -28.13 69.65 Favored 'General case' 0 CA--C 1.536 0.437 0 O-C-N 121.884 -0.51 . . . . 0.0 111.797 175.484 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 89.4 t80 -65.01 -38.87 92.34 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 123.795 0.838 . . . . 0.0 112.766 172.204 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -72.74 -28.37 62.59 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 123.074 0.55 . . . . 0.0 112.011 175.631 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 86.3 mt -72.39 -44.63 62.22 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-N 118.531 0.605 . . . . 0.0 111.971 169.89 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.0 mm-40 -55.38 -38.4 68.82 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.041 1.336 . . . . 0.0 112.569 172.394 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 -60.09 -22.55 62.9 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 113.554 0.946 . . . . 0.0 113.554 177.351 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 18.7 m-85 -103.39 1.69 32.93 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.672 1.589 . . . . 0.0 114.288 175.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 86.4 m -71.97 154.22 41.32 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 120.566 -1.334 . . . . 0.0 111.765 169.07 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 21.4 t-20 . . . . . 0 C--O 1.254 1.313 0 C-N-CA 124.496 1.118 . . . . 0.0 112.933 176.98 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . 0.251 23.4 p90 . . . . . 0 N--CA 1.488 1.448 0 CA-C-O 118.249 -0.881 . . . . 0.0 111.209 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 18.6 m -69.7 161.62 4.33 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.281 0 CA-C-N 120.569 1.532 . . . . 0.0 111.98 170.66 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 8.5 p-10 -55.46 135.85 50.2 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.735 1.214 . . . . 0.0 112.401 171.837 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -166.73 163.23 16.57 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 124.991 1.316 . . . . 0.0 110.979 -169.344 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 98.4 m-70 -69.77 136.47 50.92 Favored 'General case' 0 CA--C 1.545 0.778 0 O-C-N 121.224 -0.922 . . . . 0.0 110.385 168.663 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 72.4 mt -140.67 131.45 25.8 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 124.808 1.243 . . . . 0.0 109.518 -177.472 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.6 t -145.6 147.18 31.78 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -176.71 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 56.1 -123.52 31.33 Favored Glycine 0 CA--C 1.528 0.873 0 C-N-CA 124.742 1.163 . . . . 0.0 113.174 172.441 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 23.8 p -55.85 -41.38 74.24 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.299 1.04 . . . . 0.0 112.986 176.263 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 14.7 m-70 -70.28 -32.21 69.91 Favored 'General case' 0 CA--C 1.541 0.63 0 O-C-N 120.682 -1.261 . . . . 0.0 112.575 178.619 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 46.5 tp -68.14 -41.18 82.04 Favored 'General case' 0 N--CA 1.471 0.59 0 O-C-N 121.581 -0.699 . . . . 0.0 111.003 171.221 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 25.5 t -61.57 -45.74 98.01 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 C-N-CA 124.23 1.012 . . . . 0.0 110.774 173.321 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -59.59 -46.29 89.37 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 123.97 0.908 . . . . 0.0 111.652 174.299 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.89 -41.32 99.38 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 121.505 -0.747 . . . . 0.0 112.215 178.372 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 73.6 mt -64.18 -41.25 97.18 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 118.768 -0.634 . . . . 0.0 111.521 174.542 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 -59.31 -44.55 92.55 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-N 119.798 1.181 . . . . 0.0 112.286 171.0 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 67.8 mt -67.16 -42.28 84.59 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.172 0.989 . . . . 0.0 112.965 -179.636 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 53.8 t -74.93 -49.39 29.03 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 123.419 0.688 . . . . 0.0 111.659 178.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 58.1 m -78.03 -33.46 51.06 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 113.267 0.84 . . . . 0.0 113.267 -172.352 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 64.8 -135.33 38.02 Favored Glycine 0 CA--C 1.53 1.006 0 C-N-CA 124.024 0.821 . . . . 0.0 112.125 179.095 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -62.05 -23.21 66.34 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 124.539 1.136 . . . . 0.0 113.554 -178.423 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 88.2 mtm180 -59.79 -38.29 81.48 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.087 0.955 . . . . 0.0 112.876 176.893 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 76.78 178.22 46.12 Favored Glycine 0 CA--C 1.533 1.215 0 C-N-CA 124.12 0.867 . . . . 0.0 112.117 -168.606 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 54.4 p90 -141.41 157.46 45.15 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 113.898 1.073 . . . . 0.0 113.898 -171.612 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -96.42 158.36 15.47 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 126.304 1.841 . . . . 0.0 108.943 167.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 26.2 t80 -148.1 143.77 27.38 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 121.403 -0.811 . . . . 0.0 111.906 -173.861 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 18.6 m -141.33 115.54 7.0 Favored Pre-proline 0 N--CA 1.475 0.82 0 C-N-CA 124.725 1.21 . . . . 0.0 109.676 179.592 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -83.55 166.06 13.88 Favored 'Trans proline' 0 CA--C 1.538 0.701 0 C-N-CA 124.316 3.344 . . . . 0.0 111.97 179.496 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 40.6 ttpt -68.82 -32.21 71.75 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 123.692 0.797 . . . . 0.0 112.667 170.628 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 16.7 p -127.9 -77.01 0.57 Allowed 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 126.904 2.082 . . . . 0.0 110.314 -177.885 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 15.0 ttpp -162.96 168.35 21.26 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 126.524 1.93 . . . . 0.0 111.275 -177.398 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 1.6 mmp_? . . . . . 0 C--O 1.254 1.304 0 C-N-CA 126.447 1.899 . . . . 0.0 110.61 168.801 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.652 0 N-CA-C 111.719 -0.553 . . . . 0.0 111.719 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 8.3 tt -56.88 -34.4 43.92 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.141 0 C-N-CA 124.447 1.099 . . . . 0.0 113.63 -172.364 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 55.6 t -62.52 -30.51 49.33 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 CA-C-N 119.069 0.85 . . . . 0.0 111.176 178.862 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -69.5 -36.89 76.9 Favored 'General case' 0 CA--C 1.541 0.608 0 O-C-N 120.813 -1.18 . . . . 0.0 111.009 174.94 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 19.8 tp60 -77.73 -36.47 50.85 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.757 0.823 . . . . 0.0 112.219 -179.754 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 56.2 m -97.47 -27.26 14.52 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 115.069 1.507 . . . . 0.0 115.069 -175.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 22.8 t -102.01 -58.0 1.96 Allowed 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 120.006 1.275 . . . . 0.0 111.964 -176.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 15.5 m -65.8 -55.62 16.21 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 124.413 1.085 . . . . 0.0 109.498 177.32 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 74.8 m -89.89 176.0 6.99 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 124.112 0.965 . . . . 0.0 111.035 167.329 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 11.3 tt -92.65 147.09 5.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 124.033 0.933 . . . . 0.0 110.466 171.453 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.6 p -130.3 154.73 47.32 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 114.034 1.124 . . . . 0.0 114.034 176.643 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 47.0 t -92.95 153.94 18.47 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.698 1.599 . . . . 0.0 112.824 178.59 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 10.8 mp -59.36 -28.49 66.91 Favored 'General case' 0 N--CA 1.47 0.548 0 O-C-N 121.321 -0.862 . . . . 0.0 111.824 172.214 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.8 t80 -60.85 -36.22 78.57 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 121.466 -0.772 . . . . 0.0 112.529 170.647 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -76.22 -37.5 57.66 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 123.809 0.844 . . . . 0.0 110.392 177.637 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 93.7 mt -59.48 -43.13 93.35 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 123.288 0.635 . . . . 0.0 111.539 172.708 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -67.64 -33.05 74.19 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 113.412 0.894 . . . . 0.0 113.412 172.578 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 -70.59 -27.48 64.14 Favored 'General case' 0 CA--C 1.544 0.749 0 CA-C-N 119.652 1.115 . . . . 0.0 113.504 177.04 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 17.2 m-85 -79.0 -5.38 53.77 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 124.069 0.948 . . . . 0.0 113.482 169.351 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 2.8 t -82.04 168.35 17.89 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.785 1.234 . . . . 0.0 112.367 171.065 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.251 1.177 0 C-N-CA 125.34 1.456 . . . . 0.0 113.0 -174.303 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 65.6 m-85 . . . . . 0 N--CA 1.487 1.416 0 CA-C-O 119.642 -0.218 . . . . 0.0 110.525 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 26.8 t -84.97 115.76 27.37 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 N-CA-C 106.742 -1.577 . . . . 0.0 106.742 168.689 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -154.89 146.25 22.98 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.352 1.061 . . . . 0.0 112.92 -169.554 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 29.3 tt0 -158.62 160.36 36.45 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.13 0.972 . . . . 0.0 111.144 -169.831 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 70.7 m-70 -86.56 128.74 35.0 Favored 'General case' 0 CA--C 1.545 0.762 0 O-C-N 121.509 -0.745 . . . . 0.0 110.578 168.89 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 66.3 mt -143.03 133.91 25.44 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 126.604 1.962 . . . . 0.0 109.582 -173.224 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -137.76 140.08 40.44 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 123.89 0.876 . . . . 0.0 112.24 -172.074 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 52.94 -123.35 24.07 Favored Glycine 0 N--CA 1.474 1.171 0 C-N-CA 124.387 0.994 . . . . 0.0 114.39 169.536 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 25.2 p -58.64 -36.38 74.01 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.174 0.989 . . . . 0.0 113.119 177.109 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 93.3 m-70 -66.87 -36.83 83.2 Favored 'General case' 0 CA--C 1.54 0.559 0 O-C-N 120.739 -1.225 . . . . 0.0 111.791 175.001 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 40.2 tp -67.97 -41.75 81.9 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 123.721 0.808 . . . . 0.0 111.753 173.506 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 50.9 t -59.44 -47.67 89.88 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.137 0 C-N-CA 124.329 1.051 . . . . 0.0 111.038 172.808 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -63.57 -40.45 97.0 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 123.116 0.567 . . . . 0.0 112.042 176.336 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.1 -42.65 99.64 Favored 'General case' 0 CA--C 1.534 0.342 0 O-C-N 121.273 -0.892 . . . . 0.0 112.292 174.807 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 49.2 mt -58.94 -43.1 91.15 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 118.887 0.767 . . . . 0.0 111.566 174.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 23.7 m-85 -61.19 -47.29 86.81 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 118.479 0.581 . . . . 0.0 112.319 172.641 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 72.3 mt -68.85 -42.29 77.3 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.587 0.755 . . . . 0.0 112.807 -177.713 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 74.0 t -79.17 -41.79 23.21 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 C-N-CA 124.403 1.081 . . . . 0.0 111.821 -173.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 21.7 t -85.8 -33.2 21.43 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 113.809 1.04 . . . . 0.0 113.809 178.607 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 83.84 -153.78 30.08 Favored Glycine 0 CA--C 1.53 1.023 0 C-N-CA 124.468 1.032 . . . . 0.0 112.464 -174.768 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -68.56 -7.34 31.76 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 115.296 1.591 . . . . 0.0 115.296 -172.815 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 85.0 mtm180 -58.96 -36.58 75.05 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 124.906 1.282 . . . . 0.0 113.29 -178.579 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 86.48 147.16 10.5 Favored Glycine 0 CA--C 1.534 1.273 0 C-N-CA 125.2 1.381 . . . . 0.0 113.748 175.085 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 54.0 p90 -138.72 175.2 9.76 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.96 1.704 . . . . 0.0 112.594 -170.714 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -136.65 109.71 7.72 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.12 1.368 . . . . 0.0 109.236 169.46 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -88.68 149.72 23.36 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 113.215 0.82 . . . . 0.0 113.215 -179.292 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 19.0 p -120.39 73.25 21.15 Favored Pre-proline 0 N--CA 1.475 0.79 0 C-N-CA 125.868 1.667 . . . . 0.0 112.543 -172.356 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_endo -72.12 144.84 43.03 Favored 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 123.338 2.692 . . . . 0.0 110.789 169.48 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 70.3 tttt -72.63 -10.24 59.56 Favored 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 124.046 0.938 . . . . 0.0 113.517 -175.883 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 30.1 p -82.9 -20.01 36.24 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 126.589 1.955 . . . . 0.0 114.199 -176.639 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 62.1 pttt -149.27 29.07 0.8 Allowed 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 114.7 1.37 . . . . 0.0 114.7 -170.344 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 2.9 mpt_? . . . . . 0 N--CA 1.482 1.161 0 C-N-CA 126.47 1.908 . . . . 0.0 110.386 169.087 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.433 0 N-CA-C 112.015 -0.434 . . . . 0.0 112.015 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 16.6 tt -81.34 -28.69 10.62 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 N-CA-C 113.954 1.094 . . . . 0.0 113.954 -175.522 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 23.5 t -61.08 -39.97 84.13 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.062 0 CA-C-N 118.924 0.784 . . . . 0.0 110.408 -177.962 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -64.7 -16.62 63.15 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 126.07 1.748 . . . . 0.0 113.138 176.551 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 40.2 tt0 -90.68 -59.58 2.14 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 123.535 0.734 . . . . 0.0 109.247 168.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 76.0 m -55.91 -35.39 66.52 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 114.612 1.338 . . . . 0.0 114.612 -171.379 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 74.1 m -81.29 -20.8 40.07 Favored 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 113.885 1.068 . . . . 0.0 113.885 -178.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 38.3 m -114.83 -36.9 4.34 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 124.886 1.275 . . . . 0.0 112.534 -168.406 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 7.6 t -125.61 -164.91 1.35 Allowed 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 126.207 1.803 . . . . 0.0 109.911 171.343 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 13.9 tt -86.36 145.9 7.12 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.676 0 C-N-CA 124.387 1.075 . . . . 0.0 110.79 174.528 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 13.7 p -137.08 156.1 48.82 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.144 0.978 . . . . 0.0 112.334 174.389 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 14.5 m -107.24 149.21 28.0 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 113.953 1.094 . . . . 0.0 113.953 -167.749 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 27.4 mt -61.45 -29.93 70.26 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 121.272 -0.892 . . . . 0.0 111.696 174.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 91.7 t80 -59.95 -30.87 69.37 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.304 1.441 . . . . 0.0 113.05 170.693 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 59.1 mt-30 -80.88 -36.26 31.54 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 123.617 0.767 . . . . 0.0 110.921 174.731 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 59.7 mt -62.69 -40.54 97.46 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 118.656 0.662 . . . . 0.0 112.354 173.478 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 26.8 mt-10 -60.29 -20.38 58.86 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 114.814 1.413 . . . . 0.0 114.814 175.204 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 26.6 t30 -59.69 -27.39 66.38 Favored 'General case' 0 CA--C 1.546 0.813 0 CA-C-N 119.579 1.081 . . . . 0.0 112.723 174.343 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 76.9 m-85 -100.8 -0.06 37.78 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.331 1.452 . . . . 0.0 114.293 -174.495 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 65.8 m -75.18 126.59 31.33 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.431 0.692 . . . . 0.0 111.822 176.503 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.252 1.228 0 C-N-CA 129.169 2.988 . . . . 0.0 112.154 -171.925 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 5.9 p90 . . . . . 0 N--CA 1.483 1.221 0 N-CA-C 111.587 0.217 . . . . 0.0 111.587 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 72.3 t -90.26 146.51 6.1 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.222 0 C-N-CA 124.874 1.27 . . . . 0.0 109.503 171.333 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 53.1 p-10 -149.89 151.32 33.24 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 124.761 1.224 . . . . 0.0 113.568 -178.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 2.9 mm-40 -163.71 172.23 14.49 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.359 1.464 . . . . 0.0 111.944 -170.075 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 99.8 m-70 -90.62 135.05 33.95 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.615 1.166 . . . . 0.0 109.905 168.523 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 78.6 mt -149.41 139.44 22.06 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 124.775 1.23 . . . . 0.0 110.359 -174.607 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 2.4 t -151.57 152.36 32.8 Favored 'General case' 0 C--O 1.237 0.402 0 O-C-N 121.072 -1.018 . . . . 0.0 113.405 177.029 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 56.31 -128.1 45.22 Favored Glycine 0 CA--C 1.53 0.988 0 C-N-CA 124.738 1.161 . . . . 0.0 113.743 171.602 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 29.6 p -57.29 -37.53 72.57 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 124.36 1.064 . . . . 0.0 112.91 177.38 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 66.9 m-70 -72.31 -29.03 63.47 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 119.589 1.086 . . . . 0.0 113.027 176.665 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 50.8 tp -72.08 -45.27 61.35 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 119.035 0.834 . . . . 0.0 110.926 170.51 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 45.1 t -58.59 -40.91 80.55 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.159 0 C-N-CA 124.205 1.002 . . . . 0.0 111.231 174.184 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . 0.415 ' HA ' ' CE2' ' B' ' 16' ' ' TYR . 39.9 tt0 -61.25 -46.38 90.6 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 125.234 1.414 . . . . 0.0 112.036 171.092 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.23 -41.36 96.73 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 121.55 -0.719 . . . . 0.0 111.799 176.637 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -55.96 -51.98 65.79 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 119.138 0.881 . . . . 0.0 110.728 172.011 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . 0.415 ' CE2' ' HA ' ' B' ' 13' ' ' GLU 0.265 1.0 OUTLIER -69.47 -29.41 67.06 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 113.819 1.044 . . . . 0.0 113.819 -177.718 . . . . . . . . 4 4 . 1 . 017 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 82.4 mt -74.33 -41.74 60.6 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.161 0.984 . . . . 0.0 112.551 173.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 38.8 t -67.84 -47.91 77.56 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 C-N-CA 123.698 0.799 . . . . 0.0 110.786 177.81 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 86.2 m -73.75 -39.12 64.45 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 112.682 0.623 . . . . 0.0 112.682 -177.619 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.25 -129.0 40.06 Favored Glycine 0 CA--C 1.528 0.876 0 C-N-CA 123.913 0.768 . . . . 0.0 111.687 -179.624 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -60.37 -23.97 64.73 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.905 1.282 . . . . 0.0 113.182 177.527 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 85.3 mtm180 -65.39 -30.15 70.94 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.042 0.937 . . . . 0.0 113.248 178.738 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.89 175.99 11.76 Favored Glycine 0 CA--C 1.536 1.372 0 C-N-CA 124.889 1.233 . . . . 0.0 113.164 -173.766 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 15.9 p90 -143.15 161.12 39.05 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.759 1.224 . . . . 0.0 111.669 174.448 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 9.0 t80 -127.78 -13.7 5.23 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 113.822 1.045 . . . . 0.0 113.822 -176.115 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 88.3 t80 -61.18 127.12 29.99 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 124.198 0.999 . . . . 0.0 113.622 -179.569 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 12.2 p -92.49 128.71 43.39 Favored Pre-proline 0 CA--C 1.54 0.569 0 C-N-CA 125.466 1.507 . . . . 0.0 110.212 174.539 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_endo -67.38 131.47 24.91 Favored 'Trans proline' 0 C--N 1.35 0.655 0 C-N-CA 123.273 2.649 . . . . 0.0 111.421 -169.94 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 96.8 mttt 63.46 -2.25 0.5 Allowed 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 126.787 2.035 . . . . 0.0 114.281 -179.028 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 85.0 m -111.77 -46.87 3.2 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 126.268 1.827 . . . . 0.0 111.376 -169.765 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 81.4 tttt 76.57 134.56 0.06 Allowed 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 128.264 2.626 . . . . 0.0 112.482 -178.133 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.254 1.339 0 C-N-CA 125.011 1.324 . . . . 0.0 114.497 -174.463 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.811 0 N-CA-C 111.349 -0.7 . . . . 0.0 111.349 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 44.6 pt -66.44 -19.36 25.56 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.061 0 N-CA-C 115.5 1.667 . . . . 0.0 115.5 -169.2 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 75.2 t -56.07 -35.98 43.44 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.313 0 CA-C-N 120.462 1.483 . . . . 0.0 111.193 178.23 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 18.4 tt0 -70.81 -17.92 62.75 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 123.735 0.814 . . . . 0.0 112.769 179.102 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 37.5 tt0 -88.69 -51.76 5.5 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 124.816 1.246 . . . . 0.0 109.434 168.826 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 88.5 m -55.92 -38.77 70.72 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.444 1.098 . . . . 0.0 112.747 -176.231 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 96.0 m -76.14 -27.87 57.19 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 113.74 1.015 . . . . 0.0 113.74 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 82.0 p -102.95 -22.85 13.77 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 124.829 1.252 . . . . 0.0 113.161 -172.783 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 10.6 t -151.2 -166.2 2.46 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.289 1.836 . . . . 0.0 110.371 -174.868 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 56.7 mt -81.1 139.36 18.17 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 O-C-N 120.448 -1.407 . . . . 0.0 110.594 174.658 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 11.8 p -133.81 161.08 35.72 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 124.532 1.133 . . . . 0.0 111.207 168.628 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 24.2 p -103.1 159.28 15.67 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 113.669 0.989 . . . . 0.0 113.669 -171.552 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 56.4 mt -68.04 -27.46 66.55 Favored 'General case' 0 CA--C 1.537 0.451 0 O-C-N 121.193 -0.942 . . . . 0.0 111.86 174.805 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.9 t80 -66.05 -34.03 77.14 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 123.595 0.758 . . . . 0.0 112.766 171.471 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 70.1 mt-30 -67.12 -43.29 82.81 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 118.834 -0.603 . . . . 0.0 110.804 170.704 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 36.9 mt -58.65 -45.9 88.3 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 118.932 0.787 . . . . 0.0 111.852 175.502 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 11.3 tt0 -65.47 -23.01 66.81 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 113.78 1.03 . . . . 0.0 113.78 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 13.8 t-20 -62.55 -22.4 66.3 Favored 'General case' 0 CA--C 1.549 0.91 0 O-C-N 120.983 -1.073 . . . . 0.0 113.089 176.8 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -98.55 2.86 47.88 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 125.626 1.571 . . . . 0.0 113.794 175.57 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 11.5 t -76.64 169.93 17.36 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.627 1.171 . . . . 0.0 111.46 169.534 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 8.2 m-80 . . . . . 0 C--O 1.251 1.165 0 C-N-CA 124.036 0.934 . . . . 0.0 112.109 172.343 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 44.0 t80 . . . . . 0 N--CA 1.484 1.225 0 CA-C-O 119.784 -0.15 . . . . 0.0 110.876 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 13.8 p -66.54 150.55 10.95 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 C-N-CA 124.539 1.136 . . . . 0.0 111.708 175.337 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . 0.269 0.8 OUTLIER 47.98 59.03 4.5 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 126.244 1.818 . . . . 0.0 113.861 -179.998 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 -129.85 162.44 28.53 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.327 1.451 . . . . 0.0 111.028 -172.744 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 15.8 m-70 -76.44 135.41 39.41 Favored 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 164.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 82.3 mt -141.76 126.83 18.4 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 124.993 1.317 . . . . 0.0 109.856 -176.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 3.7 t -144.89 151.2 38.34 Favored 'General case' 0 N--CA 1.468 0.456 0 O-C-N 121.383 -0.823 . . . . 0.0 112.851 176.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.13 -124.93 34.36 Favored Glycine 0 CA--C 1.53 0.973 0 C-N-CA 125.018 1.294 . . . . 0.0 112.847 172.025 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 11.4 p -50.16 -48.64 53.74 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 125.361 1.464 . . . . 0.0 112.981 175.69 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -67.07 -34.56 77.93 Favored 'General case' 0 CA--C 1.541 0.63 0 O-C-N 121.171 -0.956 . . . . 0.0 112.216 -178.261 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 52.2 tp -70.91 -42.57 69.77 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.623 0.769 . . . . 0.0 111.723 175.007 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 50.9 t -62.1 -43.09 97.3 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.858 0 C-N-CA 124.063 0.945 . . . . 0.0 110.547 174.531 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 27.1 mm-40 -63.82 -42.07 97.74 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 123.25 0.62 . . . . 0.0 112.175 173.573 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.03 -41.68 99.59 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 119.512 1.051 . . . . 0.0 111.811 175.571 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 28.0 mt -58.67 -44.54 90.21 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.822 0.849 . . . . 0.0 111.438 172.804 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 20.0 m-85 -63.01 -41.74 99.65 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 119.243 0.929 . . . . 0.0 112.952 173.268 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 64.7 mt -67.52 -41.09 84.97 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 123.919 0.887 . . . . 0.0 112.274 179.268 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 41.8 t -72.25 -48.56 48.09 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 C-N-CA 124.05 0.94 . . . . 0.0 111.934 177.583 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 48.6 t -81.62 -37.31 27.76 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 112.887 0.699 . . . . 0.0 112.887 -171.839 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 69.65 -144.27 40.02 Favored Glycine 0 CA--C 1.529 0.964 0 C-N-CA 124.111 0.862 . . . . 0.0 112.567 178.364 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -62.59 -21.52 65.68 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 125.091 1.356 . . . . 0.0 113.384 -177.211 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 90.4 mtm180 -58.76 -35.96 73.6 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.866 1.266 . . . . 0.0 113.262 178.82 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.12 142.42 1.92 Allowed Glycine 0 CA--C 1.535 1.313 0 C-N-CA 125.519 1.533 . . . . 0.0 113.517 -178.937 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 52.8 p90 -113.36 147.54 37.49 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.102 1.361 . . . . 0.0 111.077 176.397 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 45.4 p90 -94.97 -14.83 24.04 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.378 1.071 . . . . 0.0 113.709 -176.105 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 25.4 t80 -87.26 107.07 18.33 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.139 1.376 . . . . 0.0 113.506 -169.627 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 20.8 p -76.38 145.63 76.34 Favored Pre-proline 0 N--CA 1.475 0.802 0 C-N-CA 124.657 1.183 . . . . 0.0 110.064 168.831 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -72.6 151.84 53.05 Favored 'Trans proline' 0 CA--C 1.537 0.651 0 C-N-CA 122.612 2.208 . . . . 0.0 112.59 -172.406 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 22.2 tptm -61.78 -28.78 69.7 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 123.956 0.903 . . . . 0.0 112.26 171.584 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 22.7 p -92.3 40.05 1.04 Allowed 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 128.261 2.624 . . . . 0.0 111.954 177.917 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 81.0 tttt -57.72 143.42 41.86 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 125.431 1.493 . . . . 0.0 113.496 -176.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 78.3 ttt180 . . . . . 0 C--O 1.253 1.259 0 C-N-CA 125.912 1.685 . . . . 0.0 112.756 178.781 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.477 0 N-CA-C 110.921 -0.871 . . . . 0.0 110.921 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 10.8 tp -99.39 -26.54 3.71 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.988 0 N-CA-C 114.179 1.177 . . . . 0.0 114.179 175.711 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 5.4 p -66.32 -44.25 91.08 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.102 0 CA-C-N 120.394 1.452 . . . . 0.0 112.621 -172.7 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -75.06 -32.96 61.65 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 118.778 0.717 . . . . 0.0 111.468 174.826 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -65.96 -29.93 70.41 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 124.424 1.09 . . . . 0.0 112.35 -179.858 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 65.6 m -100.6 -26.53 13.79 Favored 'General case' 0 CA--C 1.543 0.703 0 N-CA-C 114.987 1.477 . . . . 0.0 114.987 174.141 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 15.1 t -96.14 -43.97 7.51 Favored 'General case' 0 N--CA 1.479 1.021 0 CA-C-N 120.021 1.282 . . . . 0.0 112.814 -174.974 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 25.5 m -86.18 -44.81 11.9 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 124.652 1.181 . . . . 0.0 110.167 176.898 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 75.4 m -101.36 175.4 5.59 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.976 1.31 . . . . 0.0 111.801 170.109 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 7.7 mt -96.98 141.88 14.94 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 C-N-CA 125.157 1.383 . . . . 0.0 109.468 -179.409 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 12.8 p -136.6 156.29 48.76 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 115.155 1.539 . . . . 0.0 115.155 -177.913 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 34.4 t -101.09 160.85 14.04 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 127.121 2.168 . . . . 0.0 111.334 173.916 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 54.9 mt -58.06 -27.5 63.68 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 123.844 0.858 . . . . 0.0 112.094 171.484 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 86.6 t80 -61.53 -32.11 72.16 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.292 1.037 . . . . 0.0 113.465 172.354 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 37.4 mt-30 -80.31 -33.29 37.7 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 123.901 0.88 . . . . 0.0 110.958 176.625 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 55.5 mt -61.3 -43.94 98.04 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.143 0.577 . . . . 0.0 111.679 169.469 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.3 tt0 -55.58 -28.75 56.81 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.721 1.608 . . . . 0.0 113.849 179.918 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 -63.04 -20.99 65.85 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 113.551 0.945 . . . . 0.0 113.551 178.213 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 73.3 m-85 -102.8 -1.23 30.18 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 125.527 1.531 . . . . 0.0 113.449 -179.165 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 72.0 m -69.47 148.9 48.9 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.162 0.985 . . . . 0.0 113.162 174.443 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 28.4 m120 . . . . . 0 C--O 1.251 1.176 0 C-N-CA 125.024 1.33 . . . . 0.0 112.35 169.325 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 54.8 p90 . . . . . 0 N--CA 1.482 1.168 0 CA-C-O 119.761 -0.161 . . . . 0.0 110.867 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 13.4 p -70.61 122.17 21.9 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.975 0 C-N-CA 123.585 0.754 . . . . 0.0 111.582 -178.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 55.7 t30 -169.49 118.21 0.63 Allowed 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.876 1.67 . . . . 0.0 109.901 -177.33 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 2.7 mm-40 -161.25 171.62 18.07 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.816 1.246 . . . . 0.0 111.301 -171.065 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 82.4 m-70 -83.19 141.32 32.0 Favored 'General case' 0 CA--C 1.545 0.782 0 O-C-N 121.51 -0.744 . . . . 0.0 110.829 169.054 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 72.6 mt -141.88 138.88 32.41 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 126.349 1.859 . . . . 0.0 109.049 174.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 2.7 t -151.77 148.0 27.34 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 123.176 0.59 . . . . 0.0 112.232 -175.786 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.19 -130.63 47.69 Favored Glycine 0 N--CA 1.472 1.043 0 C-N-CA 124.501 1.048 . . . . 0.0 113.128 174.43 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 18.6 m -53.93 -37.11 63.51 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 124.829 1.252 . . . . 0.0 113.121 177.838 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 88.9 m-70 -68.57 -39.29 81.06 Favored 'General case' 0 CA--C 1.543 0.687 0 O-C-N 121.116 -0.99 . . . . 0.0 111.685 178.612 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 58.3 tp -65.96 -44.5 84.78 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 123.645 0.778 . . . . 0.0 111.462 173.365 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 50.2 t -60.48 -44.89 97.36 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 C-N-CA 124.178 0.991 . . . . 0.0 111.141 176.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 27.3 mm-40 -65.28 -42.72 92.87 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.161 0.584 . . . . 0.0 111.943 175.003 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.58 -40.16 96.24 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 119.401 1.0 . . . . 0.0 112.295 177.19 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 32.1 mt -58.46 -50.53 73.4 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 123.217 0.607 . . . . 0.0 110.422 171.671 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 23.5 m-85 -61.86 -33.47 74.24 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 119.637 1.108 . . . . 0.0 113.453 176.52 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 69.4 mt -69.05 -41.9 77.02 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 119.174 0.897 . . . . 0.0 112.419 173.866 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 56.0 t -70.66 -44.36 76.67 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 CA-C-N 118.781 0.719 . . . . 0.0 111.872 177.951 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 34.9 m -81.32 -18.77 44.6 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 114.094 1.146 . . . . 0.0 114.094 -176.281 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 66.99 -146.78 48.64 Favored Glycine 0 CA--C 1.531 1.042 0 C-N-CA 124.229 0.919 . . . . 0.0 111.703 -174.247 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 2.5 pm0 -67.22 -15.51 63.74 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.926 1.291 . . . . 0.0 113.95 179.659 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 76.9 mtp85 -68.71 -31.43 70.51 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.848 0.859 . . . . 0.0 112.52 177.216 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.61 -177.03 49.96 Favored Glycine 0 CA--C 1.533 1.206 0 C-N-CA 125.191 1.377 . . . . 0.0 113.831 -179.156 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 42.4 p90 -123.22 161.95 23.53 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.058 1.343 . . . . 0.0 111.861 178.348 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 82.7 t80 -128.08 115.34 18.29 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.194 0.998 . . . . 0.0 110.056 172.925 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 49.0 t80 -169.28 153.52 5.4 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 125.478 1.511 . . . . 0.0 112.635 -175.089 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 17.4 p -128.29 106.94 19.46 Favored Pre-proline 0 N--CA 1.473 0.714 0 C-N-CA 126.424 1.889 . . . . 0.0 109.933 173.845 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -56.4 142.81 88.54 Favored 'Trans proline' 0 C--N 1.351 0.71 0 C-N-CA 124.255 3.303 . . . . 0.0 112.75 173.451 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 62.1 pttt -65.64 -15.19 62.53 Favored 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 114.852 1.427 . . . . 0.0 114.852 -175.82 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 14.2 t -73.58 -36.37 65.56 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 125.206 1.402 . . . . 0.0 112.17 177.043 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 19.4 ptpt -95.08 -13.75 24.87 Favored 'General case' 0 N--CA 1.477 0.883 0 N-CA-C 114.591 1.33 . . . . 0.0 114.591 178.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.252 1.22 0 C-N-CA 125.804 1.642 . . . . 0.0 111.369 -176.839 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.729 0 N-CA-C 111.089 -0.804 . . . . 0.0 111.089 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -53.0 -40.62 37.87 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.068 0 C-N-CA 124.925 1.29 . . . . 0.0 114.477 -169.329 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 84.2 t -65.76 -52.91 44.32 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 CA-C-N 118.75 0.705 . . . . 0.0 110.452 -175.328 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -64.25 -36.95 85.74 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 117.842 0.292 . . . . 0.0 111.131 178.156 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 52.5 tt0 -62.85 -53.97 45.99 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.812 1.245 . . . . 0.0 111.671 -179.199 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 51.9 m -70.24 -26.52 63.88 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 113.13 0.789 . . . . 0.0 113.13 178.008 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 89.8 m -71.14 -53.29 15.07 Favored 'General case' 0 N--CA 1.472 0.662 0 O-C-N 120.965 -1.085 . . . . 0.0 111.274 173.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 82.4 p -83.97 -16.92 42.3 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 124.599 1.16 . . . . 0.0 114.11 -171.308 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 77.6 p -143.48 168.33 20.1 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.904 0.882 . . . . 0.0 112.677 -179.011 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 20.4 mt -68.2 131.57 33.32 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 O-C-N 121.265 -0.897 . . . . 0.0 110.038 172.555 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 13.6 p -126.23 179.12 5.41 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.505 1.122 . . . . 0.0 111.914 171.789 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 88.2 p -139.78 165.14 28.08 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 125.258 1.423 . . . . 0.0 111.759 -171.547 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 11.2 mp -61.5 -29.42 69.97 Favored 'General case' 0 CA--C 1.54 0.562 0 O-C-N 121.29 -0.881 . . . . 0.0 112.306 -179.409 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 81.9 t80 -63.51 -37.48 87.47 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 112.872 0.693 . . . . 0.0 112.872 170.92 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 60.1 mt-30 -74.43 -33.74 63.04 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 124.063 0.945 . . . . 0.0 111.403 175.45 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 89.2 mt -63.28 -51.5 65.83 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 118.604 0.638 . . . . 0.0 110.988 171.601 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 25.0 mt-10 -66.28 -27.94 68.32 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 113.483 0.92 . . . . 0.0 113.483 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 16.1 t30 -58.84 -28.72 66.34 Favored 'General case' 0 CA--C 1.546 0.822 0 CA-C-N 119.317 0.962 . . . . 0.0 112.84 176.9 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 52.0 m-85 -98.09 5.69 48.38 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.615 1.566 . . . . 0.0 113.308 176.606 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 81.1 m -98.7 163.84 12.47 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.837 1.255 . . . . 0.0 112.62 170.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 73.4 m-80 . . . . . 0 C--O 1.251 1.17 0 CA-C-O 117.935 -1.031 . . . . 0.0 112.779 177.223 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 26.6 t80 . . . . . 0 N--CA 1.487 1.383 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 4.3 p -60.89 148.75 8.64 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 CA-C-N 120.409 1.459 . . . . 0.0 112.482 -178.803 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 1.9 t30 65.45 52.63 1.36 Allowed 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 125.319 1.447 . . . . 0.0 111.586 172.562 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 2.9 mm-40 -149.21 167.6 25.55 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.32 1.048 . . . . 0.0 111.7 -177.725 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 28.0 m-70 -78.55 143.84 36.15 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 123.35 0.66 . . . . 0.0 109.382 167.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 60.8 mt -140.86 126.25 18.74 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 125.596 1.558 . . . . 0.0 109.483 174.425 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 5.2 t -142.53 149.62 39.36 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 121.598 -0.689 . . . . 0.0 112.414 -175.687 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 59.5 -132.06 51.49 Favored Glycine 0 CA--C 1.529 0.955 0 C-N-CA 124.392 0.996 . . . . 0.0 113.488 172.362 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 24.4 p -57.15 -36.22 70.47 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.81 1.244 . . . . 0.0 113.11 177.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 67.5 m-70 -71.97 -29.65 64.47 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 119.665 1.12 . . . . 0.0 113.001 175.643 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 58.3 tp -70.75 -42.75 70.06 Favored 'General case' 0 N--CA 1.471 0.581 0 O-C-N 121.287 -0.883 . . . . 0.0 111.403 170.367 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 43.5 t -58.95 -48.39 86.65 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 124.415 1.086 . . . . 0.0 110.533 173.909 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -55.96 -49.7 72.83 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.354 1.462 . . . . 0.0 111.692 173.611 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.27 -47.91 83.86 Favored 'General case' 0 CA--C 1.534 0.359 0 O-C-N 121.618 -0.676 . . . . 0.0 111.937 178.487 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 50.4 mt -60.23 -40.9 91.83 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 118.884 0.765 . . . . 0.0 111.524 178.568 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 11.8 m-85 -63.63 -47.13 82.63 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-N 119.139 0.881 . . . . 0.0 112.716 173.575 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 9.2 mp -69.7 -38.23 76.9 Favored 'General case' 0 N--CA 1.472 0.632 0 O-C-N 121.614 -0.679 . . . . 0.0 112.463 -178.373 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 73.8 t -76.08 -43.76 37.94 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 C-N-CA 124.391 1.077 . . . . 0.0 111.633 -177.559 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 64.5 m -96.71 -20.62 18.12 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 114.763 1.394 . . . . 0.0 114.763 -173.81 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 71.68 -143.56 35.47 Favored Glycine 0 CA--C 1.533 1.2 0 C-N-CA 124.584 1.087 . . . . 0.0 112.466 179.243 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -63.67 -17.7 63.22 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 125.012 1.325 . . . . 0.0 113.65 -178.531 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 61.6 mtm180 -61.23 -31.2 70.99 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.354 1.062 . . . . 0.0 113.729 -179.516 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.18 171.81 29.66 Favored Glycine 0 CA--C 1.533 1.173 0 C-N-CA 124.192 0.901 . . . . 0.0 113.872 178.634 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 51.7 p90 -137.67 155.98 48.54 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 125.682 1.593 . . . . 0.0 113.333 -169.793 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 2.8 t80 -100.43 114.17 27.52 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.548 1.539 . . . . 0.0 108.944 169.108 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 15.6 t80 -85.36 57.2 4.32 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 124.953 1.301 . . . . 0.0 112.245 -173.285 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 2.7 m -65.89 122.69 82.18 Favored Pre-proline 0 N--CA 1.476 0.869 0 C-N-CA 125.255 1.422 . . . . 0.0 112.413 -169.598 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -80.01 -171.84 1.36 Allowed 'Trans proline' 0 CA--C 1.537 0.655 0 C-N-CA 124.165 3.244 . . . . 0.0 111.305 175.151 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 61.4 tttm -60.66 -35.64 76.71 Favored 'General case' 0 CA--C 1.547 0.842 0 O-C-N 121.273 -0.892 . . . . 0.0 113.284 174.025 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 30.5 p -130.75 -95.47 0.37 Allowed 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 126.315 1.846 . . . . 0.0 110.78 -169.896 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 23.1 pttp -155.77 24.48 0.39 Allowed 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 126.377 1.871 . . . . 0.0 113.093 -170.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 70.5 mtt180 . . . . . 0 C--O 1.252 1.224 0 C-N-CA 126.994 2.118 . . . . 0.0 113.44 -176.252 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.739 0 N-CA-C 111.872 -0.491 . . . . 0.0 111.872 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 18.1 tt -53.66 -31.23 19.56 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.144 0 N-CA-C 115.921 1.823 . . . . 0.0 115.921 -169.341 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 5.4 p -62.24 -27.21 42.14 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 O-C-N 121.294 -0.879 . . . . 0.0 112.492 176.105 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -73.71 -1.25 18.35 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 124.808 1.243 . . . . 0.0 112.862 174.821 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 12.2 tt0 -111.3 -57.46 2.24 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.046 1.338 . . . . 0.0 108.978 168.129 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 67.2 m -67.0 -27.61 67.58 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 114.802 1.408 . . . . 0.0 114.802 -170.604 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 11.9 t -92.64 -30.65 15.48 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.459 0.703 . . . . 0.0 112.819 -177.592 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 37.8 p -87.85 -31.65 19.42 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 126.344 1.857 . . . . 0.0 112.251 -178.965 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 9.1 t -142.59 -164.81 1.9 Allowed 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 126.268 1.827 . . . . 0.0 109.997 179.798 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 23.1 mm -86.52 144.66 8.94 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 C-N-CA 125.28 1.432 . . . . 0.0 110.469 177.057 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 15.0 p -137.29 172.81 12.43 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.119 1.368 . . . . 0.0 111.337 169.087 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 46.3 t -120.1 151.32 39.22 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 124.249 1.019 . . . . 0.0 112.354 -175.846 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 26.1 mt -60.77 -27.38 67.94 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.76 0.824 . . . . 0.0 112.116 175.431 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 87.1 t80 -60.87 -32.29 71.73 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 123.885 0.874 . . . . 0.0 113.178 170.262 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 68.6 mt-30 -77.73 -31.77 52.42 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.785 0.834 . . . . 0.0 110.934 176.989 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 41.2 mt -59.96 -50.37 74.0 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 122.95 0.5 . . . . 0.0 110.309 169.707 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -60.96 -28.92 69.34 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 113.294 0.85 . . . . 0.0 113.294 175.333 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 31.6 t30 -73.28 -33.88 65.46 Favored 'General case' 0 CA--C 1.545 0.778 0 CA-C-N 118.859 0.754 . . . . 0.0 112.415 176.674 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -70.81 -48.59 53.36 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.972 0.909 . . . . 0.0 112.09 171.937 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 85.0 m -54.13 134.61 44.23 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.067 1.347 . . . . 0.0 113.244 179.399 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 5.4 p30 . . . . . 0 C--O 1.252 1.189 0 C-N-CA 126.13 1.772 . . . . 0.0 113.518 -174.999 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 60.5 t80 . . . . . 0 N--CA 1.486 1.361 0 CA-C-O 119.618 -0.23 . . . . 0.0 110.527 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 10.3 t 78.37 -34.65 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 C-N-CA 128.346 2.658 . . . . 0.0 111.336 -175.99 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 11.4 p-10 -71.19 135.08 47.38 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 125.863 1.665 . . . . 0.0 112.459 169.594 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 3.3 tt0 -167.85 169.88 11.16 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.881 1.272 . . . . 0.0 111.701 179.705 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 98.5 m-70 -86.75 147.48 25.83 Favored 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 165.02 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 64.5 mt -149.22 141.26 23.86 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.784 1.634 . . . . 0.0 109.632 174.91 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.7 t -147.88 144.35 28.04 Favored 'General case' 0 N--CA 1.474 0.75 0 O-C-N 120.97 -1.081 . . . . 0.0 112.997 -178.076 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 50.04 -125.23 19.24 Favored Glycine 0 N--CA 1.471 1.003 0 C-N-CA 125.123 1.344 . . . . 0.0 113.841 171.496 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 20.0 m -56.83 -33.15 66.47 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.568 1.147 . . . . 0.0 113.248 178.492 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -73.25 -36.27 66.36 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.075 -1.016 . . . . 0.0 111.802 176.727 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 26.8 tp -68.49 -43.41 76.95 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 123.889 0.876 . . . . 0.0 111.041 173.253 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 50.4 t -60.45 -44.25 95.87 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.984 0 C-N-CA 124.731 1.212 . . . . 0.0 111.253 173.277 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -64.56 -43.88 92.52 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 123.446 0.698 . . . . 0.0 111.537 175.68 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.07 -45.18 94.65 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 123.33 0.652 . . . . 0.0 111.677 176.594 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 18.9 mt -53.66 -51.0 64.56 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.196 0.999 . . . . 0.0 111.118 172.869 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 21.1 m-85 -60.46 -46.52 89.77 Favored 'General case' 0 CA--C 1.542 0.662 0 O-C-N 121.479 -0.763 . . . . 0.0 113.025 177.207 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 84.4 mt -67.72 -40.72 84.22 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 123.672 0.789 . . . . 0.0 112.907 -178.998 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 49.5 t -75.21 -44.56 43.0 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 C-N-CA 123.826 0.85 . . . . 0.0 111.598 -178.599 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 78.3 m -87.53 -23.79 24.27 Favored 'General case' 0 N--CA 1.466 0.348 0 N-CA-C 114.413 1.264 . . . . 0.0 114.413 -171.619 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 52.35 -103.88 0.14 Allowed Glycine 0 CA--C 1.533 1.18 0 C-N-CA 124.428 1.013 . . . . 0.0 114.04 169.43 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -80.1 -16.11 55.7 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 126.181 1.792 . . . . 0.0 114.729 -177.468 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -70.76 -31.05 67.72 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 119.077 0.853 . . . . 0.0 112.385 175.753 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 82.64 142.16 4.26 Favored Glycine 0 CA--C 1.535 1.314 0 C-N-CA 125.027 1.299 . . . . 0.0 112.213 -173.913 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -80.62 173.39 12.65 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 114.197 1.184 . . . . 0.0 114.197 -175.387 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 19.3 t80 -156.37 39.82 0.35 Allowed 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.444 1.097 . . . . 0.0 112.033 -174.388 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 60.3 t80 -54.66 140.56 35.08 Favored 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 113.74 1.015 . . . . 0.0 113.74 -177.861 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 38.6 m -140.02 117.79 8.39 Favored Pre-proline 0 N--CA 1.474 0.765 0 C-N-CA 125.119 1.368 . . . . 0.0 109.651 177.688 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_exo -56.36 -178.71 0.08 OUTLIER 'Trans proline' 0 C--N 1.353 0.8 1 C-N-CA 125.668 4.245 . . . . 0.0 115.427 170.136 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 45.1 mttm -50.35 -51.65 43.88 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 125.373 1.469 . . . . 0.0 113.387 -179.038 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 19.3 p -125.91 109.0 11.97 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 126.812 2.045 . . . . 0.0 108.781 -179.078 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . 0.272 65.1 pttt 45.42 -144.0 0.21 Allowed 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 126.822 2.049 . . . . 0.0 113.993 -178.082 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 97.1 mtt180 . . . . . 0 C--O 1.253 1.272 0 C-N-CA 126.613 1.965 . . . . 0.0 111.012 -179.891 . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.315 0 N-CA-C 111.239 -0.744 . . . . 0.0 111.239 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -86.26 -19.72 8.19 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 N-CA-C 114.875 1.435 . . . . 0.0 114.875 -177.576 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 23.2 t -59.45 -41.58 85.03 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.171 0 CA-C-N 119.879 1.218 . . . . 0.0 110.618 -174.248 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -70.3 -9.2 55.37 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.93 1.692 . . . . 0.0 113.472 -179.569 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 54.8 tt0 -103.54 -62.98 1.23 Allowed 'General case' 0 C--O 1.226 -0.178 0 C-N-CA 124.38 1.072 . . . . 0.0 109.24 169.815 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 86.8 m -55.48 -32.67 63.01 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 114.656 1.354 . . . . 0.0 114.656 -169.547 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 84.1 m -76.0 -20.59 57.72 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 113.889 1.07 . . . . 0.0 113.889 -176.456 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 39.5 p -126.09 -43.49 1.81 Allowed 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 125.564 1.545 . . . . 0.0 112.251 -171.053 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 67.5 m -102.84 176.51 5.13 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 127.136 2.174 . . . . 0.0 110.963 171.527 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 69.1 mt -82.24 145.57 8.44 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 O-C-N 120.619 -1.3 . . . . 0.0 110.077 173.781 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 15.0 p -136.57 -179.9 5.97 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.113 1.365 . . . . 0.0 111.432 170.492 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 93.4 p -138.49 159.86 41.02 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 121.149 -0.969 . . . . 0.0 112.02 -171.798 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 39.7 mt -62.42 -30.94 71.59 Favored 'General case' 0 CA--C 1.541 0.597 0 O-C-N 122.043 -0.411 . . . . 0.0 111.516 174.956 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.3 t80 -63.93 -34.15 77.32 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 123.784 0.833 . . . . 0.0 113.17 172.168 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 36.1 mt-30 -76.82 -26.59 54.54 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 123.639 0.776 . . . . 0.0 111.914 172.888 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 38.0 mt -71.05 -41.67 70.46 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 119.427 1.012 . . . . 0.0 111.901 169.673 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -53.55 -33.1 53.46 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.401 1.08 . . . . 0.0 113.182 175.055 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.0 t-20 -60.08 -22.44 62.73 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 178.075 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 70.1 m-85 -107.91 9.26 28.75 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.718 1.607 . . . . 0.0 114.184 177.357 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 75.9 m -83.39 147.31 27.96 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 121.113 -0.992 . . . . 0.0 111.795 169.545 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 83.4 m-20 . . . . . 0 C--O 1.254 1.3 0 CA-C-O 117.774 -1.107 . . . . 0.0 112.074 173.086 . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . 0.277 8.8 p90 . . . . . 0 N--CA 1.496 1.83 0 CA-C-O 117.978 -1.011 . . . . 0.0 108.984 . . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 48.8 t -140.76 91.46 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 C-N-CA 126.33 1.852 . . . . 0.0 106.718 169.523 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 -162.36 152.1 16.15 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.617 1.167 . . . . 0.0 113.088 -167.836 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -174.98 177.68 1.92 Allowed 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 126.646 1.978 . . . . 0.0 110.688 -174.977 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -83.19 145.25 29.28 Favored 'General case' 0 CA--C 1.546 0.794 0 O-C-N 120.983 -1.073 . . . . 0.0 109.692 167.454 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 77.2 mt -147.99 138.43 22.93 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 125.892 1.677 . . . . 0.0 110.106 177.261 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 3.6 t -148.0 155.45 41.53 Favored 'General case' 0 CA--C 1.535 0.401 0 O-C-N 120.977 -1.077 . . . . 0.0 113.117 175.342 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 53.93 -130.6 43.69 Favored Glycine 0 N--CA 1.469 0.894 0 C-N-CA 124.874 1.226 . . . . 0.0 113.402 171.791 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.8 m -52.3 -39.35 60.42 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 124.529 1.132 . . . . 0.0 112.768 178.667 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 12.9 t60 -76.19 -30.67 58.12 Favored 'General case' 0 CA--C 1.541 0.626 0 O-C-N 121.097 -1.002 . . . . 0.0 112.578 -177.209 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 50.2 tp -67.94 -41.2 82.87 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 121.54 -0.725 . . . . 0.0 110.899 169.091 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 53.8 t -63.43 -43.1 98.31 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 C-N-CA 124.267 1.027 . . . . 0.0 111.389 174.64 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 57.0 mt-10 -56.88 -50.33 72.83 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.64 0.776 . . . . 0.0 111.341 170.58 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.63 -43.69 93.72 Favored 'General case' 0 CA--C 1.539 0.546 0 O-C-N 121.693 -0.629 . . . . 0.0 111.715 179.628 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 31.3 mt -59.02 -45.11 91.53 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.656 0.782 . . . . 0.0 111.842 173.682 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 18.4 m-85 -62.01 -42.33 99.04 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-N 119.585 1.084 . . . . 0.0 112.918 174.328 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 8.9 mp -68.41 -40.88 81.12 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 118.673 0.67 . . . . 0.0 112.029 178.472 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 54.7 t -70.7 -45.37 74.19 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 123.78 0.832 . . . . 0.0 111.852 179.46 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 57.2 m -80.38 -27.86 38.08 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 113.632 0.975 . . . . 0.0 113.632 -177.859 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 67.42 -138.94 34.7 Favored Glycine 0 CA--C 1.53 0.992 0 C-N-CA 123.891 0.758 . . . . 0.0 111.711 -176.426 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 2.4 pm0 -69.37 -15.49 63.32 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.786 1.234 . . . . 0.0 113.757 178.104 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 54.6 mtm180 -69.06 -34.36 75.04 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.296 1.039 . . . . 0.0 112.646 179.706 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.09 177.64 36.97 Favored Glycine 0 CA--C 1.533 1.175 0 C-N-CA 124.453 1.025 . . . . 0.0 113.711 -175.415 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 7.3 p90 -117.26 166.44 12.28 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 126.485 1.914 . . . . 0.0 112.922 -176.529 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 47.0 p90 -128.7 8.99 5.87 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.276 1.43 . . . . 0.0 113.731 175.145 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 5.2 p90 -55.13 147.43 16.15 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 115.167 1.543 . . . . 0.0 115.167 -171.951 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 23.6 p -89.25 134.75 32.37 Favored Pre-proline 0 N--CA 1.47 0.529 0 C-N-CA 124.596 1.158 . . . . 0.0 110.041 170.015 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -80.06 177.54 8.18 Favored 'Trans proline' 0 CA--C 1.538 0.712 0 C-N-CA 123.145 2.564 . . . . 0.0 111.397 176.859 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 40.6 ttpt -59.04 -34.71 72.23 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 123.751 0.82 . . . . 0.0 113.06 177.156 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 27.0 m -122.96 82.51 2.0 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.904 1.682 . . . . 0.0 108.481 178.958 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -63.33 131.51 48.54 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 124.092 0.957 . . . . 0.0 111.954 179.008 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 77.5 ttt180 . . . . . 0 C--O 1.252 1.223 0 C-N-CA 125.576 1.551 . . . . 0.0 111.985 177.109 . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.486 0 N-CA-C 111.121 -0.792 . . . . 0.0 111.121 . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 10.2 tt -96.56 -31.72 4.07 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 N-CA-C 112.902 0.705 . . . . 0.0 112.902 172.77 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 87.4 t -65.83 -46.19 89.43 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 CA-C-N 119.418 1.008 . . . . 0.0 112.151 -169.244 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -73.69 -29.59 62.38 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 119.235 0.925 . . . . 0.0 112.084 174.474 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 -67.95 -35.77 78.95 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.586 1.155 . . . . 0.0 112.219 179.398 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 14.8 m -97.48 -25.57 15.13 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 114.992 1.479 . . . . 0.0 114.992 176.842 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 27.8 t -95.06 -59.18 1.96 Allowed 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 120.014 1.279 . . . . 0.0 112.157 -176.305 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 20.9 m -71.26 -50.48 32.34 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.39 1.076 . . . . 0.0 109.847 179.265 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 75.2 m -91.22 171.16 9.43 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 124.203 1.001 . . . . 0.0 111.129 168.623 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 12.3 tt -91.87 147.38 5.34 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 124.124 0.97 . . . . 0.0 110.893 175.411 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 18.9 p -135.71 150.98 49.72 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 113.568 0.951 . . . . 0.0 113.568 177.325 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 13.2 t -106.53 164.14 12.31 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 125.262 1.425 . . . . 0.0 111.206 176.092 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 78.0 mt -59.39 -25.88 64.65 Favored 'General case' 0 CA--C 1.541 0.617 0 O-C-N 121.355 -0.841 . . . . 0.0 113.037 -177.755 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.8 t80 -60.01 -32.53 70.96 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 123.832 0.853 . . . . 0.0 113.224 170.397 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -81.08 -30.51 34.7 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.452 1.101 . . . . 0.0 110.927 176.181 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -64.89 -44.49 89.44 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 119.546 1.066 . . . . 0.0 110.626 169.238 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -59.84 -28.59 67.63 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 124.449 1.1 . . . . 0.0 113.822 176.421 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 22.4 t30 -59.36 -28.24 66.68 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 123.764 0.825 . . . . 0.0 113.095 177.446 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 97.6 m-85 -99.99 2.2 43.27 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.848 1.259 . . . . 0.0 113.899 -179.292 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 64.8 m -72.28 170.08 14.88 Favored 'General case' 0 CA--C 1.549 0.907 0 O-C-N 120.959 -1.088 . . . . 0.0 111.951 169.642 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.253 1.261 0 C-N-CA 125.374 1.469 . . . . 0.0 112.678 176.402 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 64.2 m-85 . . . . . 0 N--CA 1.488 1.469 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 8.0 t -85.92 57.48 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.369 0 CA-C-N 120.228 1.376 . . . . 0.0 109.223 174.456 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -97.32 130.36 44.5 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.535 1.534 . . . . 0.0 113.027 -170.749 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 41.1 mt-30 -148.01 163.77 35.85 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.872 1.669 . . . . 0.0 111.124 -174.903 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 57.5 m-70 -94.44 129.55 41.14 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 167.439 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 69.8 mt -137.06 135.1 37.21 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 126.184 1.794 . . . . 0.0 109.03 -176.36 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 1.4 t -143.02 142.95 31.72 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.256 0.622 . . . . 0.0 111.87 -171.918 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 51.17 -121.6 12.12 Favored Glycine 0 CA--C 1.53 0.973 0 C-N-CA 124.567 1.08 . . . . 0.0 113.957 170.439 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 16.3 t -55.51 -39.82 70.98 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.13 0.972 . . . . 0.0 112.701 178.199 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 72.6 m-70 -73.56 -27.93 61.59 Favored 'General case' 0 CA--C 1.542 0.661 0 O-C-N 120.455 -1.403 . . . . 0.0 113.348 178.013 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 41.8 tp -72.86 -41.79 64.39 Favored 'General case' 0 N--CA 1.467 0.415 0 O-C-N 121.437 -0.789 . . . . 0.0 111.654 170.836 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 24.9 t -60.67 -43.31 94.66 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.851 0 C-N-CA 124.495 1.118 . . . . 0.0 111.0 172.084 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -60.34 -46.8 88.65 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.312 1.445 . . . . 0.0 111.68 173.011 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.15 -40.99 95.91 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 121.461 -0.774 . . . . 0.0 112.23 175.907 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 59.6 mt -63.14 -42.18 99.42 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 118.915 0.779 . . . . 0.0 111.846 174.51 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 21.7 m-85 -61.58 -40.04 93.34 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 119.269 0.94 . . . . 0.0 112.521 172.309 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 79.0 mt -69.46 -44.51 71.07 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 123.824 0.849 . . . . 0.0 112.28 177.997 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 79.3 t -74.66 -44.46 46.56 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 C-N-CA 123.921 0.888 . . . . 0.0 112.095 -177.63 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 40.5 m -87.55 -26.61 23.05 Favored 'General case' 0 N--CA 1.474 0.772 0 N-CA-C 113.599 0.963 . . . . 0.0 113.599 -176.159 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 73.48 -153.09 47.29 Favored Glycine 0 CA--C 1.531 1.069 0 C-N-CA 125.188 1.375 . . . . 0.0 112.998 -179.698 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -59.14 -22.12 60.4 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.372 1.469 . . . . 0.0 113.867 -176.741 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.97 -26.98 68.82 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.759 1.223 . . . . 0.0 113.087 178.009 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 79.09 -172.62 55.27 Favored Glycine 0 CA--C 1.53 0.969 0 C-N-CA 124.543 1.068 . . . . 0.0 113.657 -176.098 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 40.4 p90 -148.92 161.02 42.7 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.011 1.324 . . . . 0.0 113.658 -169.321 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 57.3 m-85 -88.48 149.19 23.78 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 125.35 1.46 . . . . 0.0 109.364 167.89 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 48.4 t80 -138.5 130.36 28.08 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 121.455 -0.778 . . . . 0.0 112.864 -176.097 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 78.5 m -141.13 108.18 6.27 Favored Pre-proline 0 N--CA 1.472 0.666 0 C-N-CA 124.688 1.195 . . . . 0.0 110.267 -179.348 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_endo -80.88 168.65 17.25 Favored 'Trans proline' 0 N--CA 1.455 -0.756 0 C-N-CA 123.528 2.819 . . . . 0.0 110.908 169.487 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 39.7 ttpt -57.11 -29.94 63.95 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 123.351 0.66 . . . . 0.0 112.291 172.009 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 4.2 m -59.49 -26.52 65.35 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 127.869 2.468 . . . . 0.0 113.696 -179.808 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 36.7 ttmt -71.94 -20.94 61.68 Favored 'General case' 0 CA--C 1.551 1.008 0 N-CA-C 113.334 0.864 . . . . 0.0 113.334 178.796 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.23 0 C-N-CA 125.514 1.526 . . . . 0.0 112.968 -177.665 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.611 0 N-CA-C 111.718 -0.553 . . . . 0.0 111.718 . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 9.8 tt -109.14 -10.33 11.28 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.251 0 C-N-CA 124.978 1.311 . . . . 0.0 114.332 -172.112 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 9.0 p -58.9 -35.67 57.63 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 O-C-N 121.106 -0.996 . . . . 0.0 113.636 -169.809 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 55.1 mt-10 -73.13 -10.46 59.8 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 119.178 0.899 . . . . 0.0 113.325 175.864 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 -93.26 -60.34 1.81 Allowed 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 108.565 -0.902 . . . . 0.0 108.565 169.053 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 56.1 m -62.83 -29.97 71.13 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 115.304 1.594 . . . . 0.0 115.304 -173.461 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 13.9 t -89.7 -29.0 19.05 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.581 0.752 . . . . 0.0 112.802 -175.847 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 28.1 m -97.07 -39.09 9.49 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 125.835 1.654 . . . . 0.0 111.502 -176.171 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 70.2 m -124.96 -173.21 2.75 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.247 1.819 . . . . 0.0 110.017 176.062 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 11.6 tt -88.41 143.47 11.15 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 O-C-N 120.336 -1.478 . . . . 0.0 110.577 176.281 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 18.9 p -130.92 166.08 21.69 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.438 1.095 . . . . 0.0 111.754 175.677 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 44.9 p -108.08 159.98 16.15 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 113.718 1.007 . . . . 0.0 113.718 -174.199 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 77.0 mt -64.53 -30.83 71.86 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 121.332 -0.855 . . . . 0.0 111.433 172.369 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 87.6 t80 -65.63 -34.67 78.76 Favored 'General case' 0 CA--C 1.542 0.645 0 O-C-N 121.481 -0.762 . . . . 0.0 112.816 174.153 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -71.46 -26.53 62.75 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 123.6 0.76 . . . . 0.0 112.07 172.837 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 98.5 mt -74.49 -41.82 60.05 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 119.143 0.883 . . . . 0.0 112.01 169.769 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -55.97 -29.07 59.66 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 124.21 1.004 . . . . 0.0 113.237 176.735 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 17.8 t30 -52.88 -32.04 42.92 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.729 1.211 . . . . 0.0 113.511 174.376 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 87.4 m-85 -97.69 2.03 49.26 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 125.398 1.479 . . . . 0.0 114.695 -175.766 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 73.0 m -78.43 150.83 32.99 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.005 0.922 . . . . 0.0 113.239 178.575 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 . . . . . 0 C--O 1.25 1.101 0 C-N-CA 124.31 1.044 . . . . 0.0 112.243 170.535 . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 52.8 p90 . . . . . 0 N--CA 1.485 1.288 0 CA-C-O 118.832 -0.604 . . . . 0.0 110.721 . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . 0.3 24.0 m 58.59 -37.3 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 C-N-CA 130.39 3.476 . . . . 0.0 116.44 -173.809 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 17.6 m120 -126.95 138.53 53.29 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 127.329 2.251 . . . . 0.0 109.209 169.011 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 33.0 tp60 -158.95 160.43 36.02 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 123.51 0.724 . . . . 0.0 111.483 -169.365 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 95.9 m-70 -98.13 133.03 43.14 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 123.881 0.872 . . . . 0.0 109.017 167.724 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 88.5 mt -146.57 141.88 27.42 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 124.986 1.314 . . . . 0.0 110.383 -171.799 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 2.0 t -153.25 146.26 24.55 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.157 0.583 . . . . 0.0 111.823 -177.247 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 52.3 -126.47 30.93 Favored Glycine 0 N--CA 1.475 1.263 0 C-N-CA 124.766 1.174 . . . . 0.0 114.086 171.952 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 31.4 p -58.97 -33.87 71.15 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.628 1.171 . . . . 0.0 113.142 178.301 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 22.4 t-160 -71.55 -37.22 71.13 Favored 'General case' 0 CA--C 1.544 0.731 0 O-C-N 121.036 -1.04 . . . . 0.0 111.57 176.497 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 64.0 tp -65.15 -44.99 86.8 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 123.587 0.755 . . . . 0.0 111.525 171.689 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 40.4 t -60.82 -43.85 96.32 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 C-N-CA 124.286 1.034 . . . . 0.0 111.177 175.414 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -64.42 -42.75 95.88 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 123.59 0.756 . . . . 0.0 111.725 175.628 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.37 -41.61 98.76 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 121.677 -0.639 . . . . 0.0 111.885 175.782 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 36.6 mt -58.78 -47.84 83.34 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 118.46 0.573 . . . . 0.0 110.852 172.906 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 26.2 m-85 -59.47 -41.54 89.98 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 119.679 1.127 . . . . 0.0 112.876 175.252 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 77.6 mt -67.0 -41.32 86.94 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.998 0.919 . . . . 0.0 112.424 177.511 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 44.3 t -69.86 -42.37 79.88 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 C-N-CA 124.239 1.016 . . . . 0.0 111.798 178.62 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 61.4 m -81.6 -32.0 32.23 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 113.837 1.051 . . . . 0.0 113.837 -176.003 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 82.04 -148.21 26.84 Favored Glycine 0 CA--C 1.53 1.01 0 C-N-CA 124.616 1.103 . . . . 0.0 112.686 -177.832 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 3.8 pm0 -62.88 -23.43 67.33 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 126.292 1.837 . . . . 0.0 115.494 -169.032 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 18.1 mtm-85 -83.7 -20.18 33.96 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 124.663 1.185 . . . . 0.0 113.221 -177.951 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.9 -161.63 54.3 Favored Glycine 0 CA--C 1.532 1.155 0 C-N-CA 124.611 1.101 . . . . 0.0 113.38 -174.96 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 9.9 p90 -125.73 164.83 19.8 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 126.252 1.821 . . . . 0.0 112.993 -172.947 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 43.0 p90 -101.58 3.71 40.26 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 124.793 1.237 . . . . 0.0 112.394 168.301 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 79.8 t80 -48.86 141.91 6.99 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 126.623 1.969 . . . . 0.0 115.438 -177.166 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 24.1 p -136.77 137.2 22.86 Favored Pre-proline 0 N--CA 1.472 0.659 0 C-N-CA 126.084 1.753 . . . . 0.0 109.247 168.322 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -77.06 162.47 31.77 Favored 'Trans proline' 0 N--CA 1.459 -0.531 0 C-N-CA 123.358 2.705 . . . . 0.0 110.915 173.989 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 52.3 mtpt -68.73 -12.0 60.93 Favored 'General case' 0 CA--C 1.547 0.858 0 N-CA-C 114.057 1.132 . . . . 0.0 114.057 -177.779 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 24.0 p -76.86 -24.1 52.64 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 126.069 1.748 . . . . 0.0 112.937 171.163 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -110.45 5.36 21.32 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 125.388 1.475 . . . . 0.0 114.049 -177.154 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.242 0 C-N-CA 125.832 1.653 . . . . 0.0 112.845 177.545 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.397 0 N-CA-C 111.957 -0.457 . . . . 0.0 111.957 . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 10.0 tp -89.69 -34.33 6.64 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 N-CA-C 113.265 0.839 . . . . 0.0 113.265 -177.383 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 10.6 p -69.53 -38.76 77.46 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 C-N-CA 123.534 0.734 . . . . 0.0 112.503 -171.185 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 21.3 pm0 -72.51 -2.51 19.95 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 123.964 0.906 . . . . 0.0 113.333 174.855 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -105.17 -57.46 2.03 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.77 1.228 . . . . 0.0 110.417 172.23 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 21.4 m -68.22 -28.33 67.15 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 114.58 1.326 . . . . 0.0 114.58 -175.462 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 73.5 m -73.62 -47.15 42.43 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-N 119.644 1.111 . . . . 0.0 111.078 170.941 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 27.4 m -71.3 -37.17 71.84 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 126.538 1.935 . . . . 0.0 112.291 -170.737 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 48.2 m -137.2 167.7 21.05 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 125.326 1.45 . . . . 0.0 111.572 -176.313 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 39.2 mt -63.31 132.88 29.29 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 O-C-N 121.289 -0.882 . . . . 0.0 109.958 170.774 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 7.1 p -135.12 156.63 48.67 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.179 0.992 . . . . 0.0 112.635 176.254 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 34.2 t -108.79 160.83 15.66 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 126.138 1.775 . . . . 0.0 111.558 -175.229 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 23.7 mt -57.46 -28.01 62.98 Favored 'General case' 0 N--CA 1.469 0.504 0 O-C-N 121.62 -0.675 . . . . 0.0 111.838 173.17 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 85.9 t80 -61.85 -31.16 71.4 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 124.237 1.015 . . . . 0.0 113.665 173.06 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 34.5 mt-30 -79.16 -32.0 44.17 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.725 0.81 . . . . 0.0 111.015 174.381 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 55.0 mt -67.58 -41.14 84.62 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.36 0.664 . . . . 0.0 112.255 171.578 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -55.31 -33.15 63.06 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 124.866 1.266 . . . . 0.0 113.099 175.184 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 17.3 t30 -61.27 -26.5 67.81 Favored 'General case' 0 CA--C 1.547 0.839 0 N-CA-C 113.141 0.793 . . . . 0.0 113.141 176.811 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 49.2 m-85 -99.6 -1.77 37.31 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.409 1.484 . . . . 0.0 114.168 -179.293 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 73.5 m -67.26 151.03 48.23 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 120.867 -1.146 . . . . 0.0 112.957 173.202 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 90.0 m-20 . . . . . 0 C--O 1.252 1.208 0 C-N-CA 124.376 1.07 . . . . 0.0 111.95 169.754 . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 43.8 p90 . . . . . 0 N--CA 1.487 1.378 0 CA-C-O 119.11 -0.471 . . . . 0.0 110.7 . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 15.4 m -77.78 63.94 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.444 0 C-N-CA 125.513 1.525 . . . . 0.0 112.914 -173.17 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 38.8 t30 -157.87 109.7 2.31 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.917 1.687 . . . . 0.0 109.654 -175.35 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 2.6 mm-40 -168.09 175.65 6.51 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 125.291 1.436 . . . . 0.0 110.713 -169.626 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 49.0 m-70 -68.22 134.73 50.91 Favored 'General case' 0 CA--C 1.544 0.728 0 O-C-N 120.7 -1.25 . . . . 0.0 109.485 168.017 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 76.4 mt -135.31 126.89 28.87 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 125.631 1.572 . . . . 0.0 109.119 176.083 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.7 t -143.76 150.16 38.19 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 113.093 0.775 . . . . 0.0 113.093 -174.041 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 54.98 -128.27 43.14 Favored Glycine 0 N--CA 1.469 0.86 0 C-N-CA 124.68 1.133 . . . . 0.0 113.059 173.755 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 15.8 m -54.78 -36.17 64.61 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.518 1.127 . . . . 0.0 113.282 177.832 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 73.9 m-70 -76.76 -29.21 56.02 Favored 'General case' 0 CA--C 1.539 0.526 0 O-C-N 120.895 -1.128 . . . . 0.0 113.036 178.061 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 56.3 tp -69.54 -44.75 70.3 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 118.888 0.767 . . . . 0.0 110.689 169.908 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 25.3 t -60.22 -43.72 93.93 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.981 0 C-N-CA 124.904 1.282 . . . . 0.0 111.017 175.027 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -59.45 -50.44 73.92 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 125.142 1.377 . . . . 0.0 111.45 172.317 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.59 -40.75 97.91 Favored 'General case' 0 CA--C 1.537 0.466 0 O-C-N 121.397 -0.815 . . . . 0.0 111.978 179.683 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 40.0 mt -61.27 -42.66 99.02 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 123.661 0.784 . . . . 0.0 111.683 173.771 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 19.3 m-85 -61.97 -42.0 98.63 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-N 119.885 1.221 . . . . 0.0 112.678 172.702 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 9.0 mp -68.3 -42.39 79.5 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 118.613 0.642 . . . . 0.0 112.145 178.676 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 54.5 t -71.19 -45.31 71.7 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 C-N-CA 123.622 0.769 . . . . 0.0 111.809 -179.806 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 43.9 m -89.33 -20.01 24.57 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 114.027 1.121 . . . . 0.0 114.027 -173.023 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 66.91 -149.52 51.35 Favored Glycine 0 CA--C 1.532 1.132 0 C-N-CA 124.544 1.068 . . . . 0.0 113.078 177.956 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -61.26 -23.3 65.56 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 125.248 1.419 . . . . 0.0 113.531 -177.062 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 78.2 mtp85 -64.14 -29.44 70.56 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.34 1.056 . . . . 0.0 112.921 177.441 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.42 -169.69 54.64 Favored Glycine 0 CA--C 1.531 1.093 0 C-N-CA 124.464 1.031 . . . . 0.0 113.14 -175.238 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 54.9 p90 -147.07 157.71 43.7 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.503 1.121 . . . . 0.0 113.684 -171.164 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 60.1 t80 -88.77 147.36 24.49 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.89 1.676 . . . . 0.0 109.869 169.192 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 65.1 t80 -151.02 139.92 20.92 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.816 0.846 . . . . 0.0 111.997 -175.975 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 15.4 t -168.12 141.51 2.65 Favored Pre-proline 0 N--CA 1.472 0.65 0 C-N-CA 126.421 1.889 . . . . 0.0 109.681 -178.318 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -87.8 -163.69 0.17 Allowed 'Trans proline' 0 CA--C 1.54 0.819 0 C-N-CA 124.15 3.234 . . . . 0.0 111.821 178.099 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 39.8 ttmt -60.96 -36.23 78.83 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.861 1.264 . . . . 0.0 113.924 -175.407 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 9.0 t -156.87 -133.97 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 125.998 1.719 . . . . 0.0 109.152 -174.817 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 64.8 pttt -66.9 -4.9 10.54 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 125.627 1.571 . . . . 0.0 114.028 170.372 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 41.5 ptt180 . . . . . 0 C--O 1.255 1.374 0 C-N-CA 129.859 3.263 . . . . 0.0 110.581 -175.558 . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.671 0 N-CA-C 111.922 -0.471 . . . . 0.0 111.922 . . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 12.4 tt -53.38 -34.57 23.04 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.174 0 C-N-CA 125.162 1.385 . . . . 0.0 113.687 -173.099 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 5.4 p -63.11 -27.92 44.08 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 O-C-N 121.518 -0.738 . . . . 0.0 112.92 178.901 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -72.14 -11.97 60.98 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 123.633 0.773 . . . . 0.0 112.833 176.27 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 22.6 tt0 -95.16 -66.49 0.91 Allowed 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 123.855 0.862 . . . . 0.0 109.144 169.165 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 57.0 m -68.94 -26.73 65.22 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 115.797 1.777 . . . . 0.0 115.797 -168.803 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 15.4 t -84.14 -43.26 15.18 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 119.631 1.105 . . . . 0.0 111.179 176.696 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 24.2 m -69.4 -32.33 71.27 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 126.116 1.766 . . . . 0.0 112.609 -179.245 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 91.8 p -147.26 169.12 20.07 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.946 1.298 . . . . 0.0 112.498 -174.967 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 38.7 mt -64.73 134.14 29.58 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.864 0 O-C-N 120.935 -1.103 . . . . 0.0 110.52 174.144 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 9.7 p -133.34 177.37 7.74 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 125.079 1.351 . . . . 0.0 111.195 169.907 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.4 t -139.69 167.33 22.35 Favored 'General case' 0 N--CA 1.466 0.366 0 O-C-N 120.927 -1.108 . . . . 0.0 112.786 179.433 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 46.8 mt -62.59 -30.11 71.09 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.445 1.098 . . . . 0.0 112.71 -169.658 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 83.3 t80 -63.61 -28.14 69.72 Favored 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 172.918 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 60.9 mt-30 -82.83 -23.18 33.86 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 123.84 0.856 . . . . 0.0 111.674 175.804 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 47.7 mt -67.83 -43.57 79.27 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 118.905 0.775 . . . . 0.0 110.742 171.661 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -56.13 -24.99 44.36 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 113.894 1.072 . . . . 0.0 113.894 175.707 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 29.4 t30 -60.47 -27.83 67.86 Favored 'General case' 0 CA--C 1.548 0.871 0 CA-C-N 119.628 1.104 . . . . 0.0 113.072 175.242 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 89.1 m-85 -96.71 2.33 51.92 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.505 1.522 . . . . 0.0 112.874 177.865 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 70.4 m -98.55 161.03 13.89 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.973 1.309 . . . . 0.0 112.535 177.357 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 75.7 m-20 . . . . . 0 C--O 1.25 1.126 0 C-N-CA 123.629 0.772 . . . . 0.0 112.355 175.911 . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 55.0 t80 . . . . . 0 N--CA 1.491 1.609 0 N-CA-C 110.077 -0.342 . . . . 0.0 110.077 . . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 15.4 m -64.27 144.61 14.55 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 O-C-N 121.05 -1.031 . . . . 0.0 111.864 176.303 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 5.3 t30 54.49 60.29 3.64 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 125.517 1.527 . . . . 0.0 113.268 174.419 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 29.8 mm-40 -145.69 171.05 15.3 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 125.853 1.661 . . . . 0.0 111.601 -178.852 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 25.3 m-70 -81.02 143.19 32.68 Favored 'General case' 0 CA--C 1.545 0.776 0 O-C-N 120.956 -1.09 . . . . 0.0 109.607 167.356 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 67.0 mt -140.73 130.45 24.26 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 126.123 1.769 . . . . 0.0 109.148 175.26 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.6 t -135.68 144.31 45.9 Favored 'General case' 0 N--CA 1.472 0.645 0 O-C-N 121.53 -0.731 . . . . 0.0 112.784 -174.826 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 49.78 -123.33 13.11 Favored Glycine 0 N--CA 1.471 1.0 0 C-N-CA 125.287 1.423 . . . . 0.0 114.043 170.955 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 20.2 m -55.12 -38.25 67.94 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.322 1.049 . . . . 0.0 112.55 177.92 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 1.4 t-80 -70.04 -34.2 72.94 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 120.881 -1.137 . . . . 0.0 111.748 179.023 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 43.2 tp -69.99 -41.43 74.4 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 123.889 0.876 . . . . 0.0 111.507 173.653 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 55.0 t -62.15 -42.69 96.08 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 124.755 1.222 . . . . 0.0 110.91 173.313 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -64.39 -41.22 96.78 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.596 0.759 . . . . 0.0 112.233 173.071 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.1 -42.84 99.62 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 119.661 1.119 . . . . 0.0 111.792 174.977 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 26.2 mt -59.36 -44.75 92.67 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 123.362 0.665 . . . . 0.0 111.893 173.166 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 6.1 m-85 -57.76 -48.32 79.99 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.605 0.762 . . . . 0.0 112.208 172.999 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 7.9 mp -67.87 -41.27 83.11 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 123.704 0.801 . . . . 0.0 112.321 -178.077 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 61.5 t -74.33 -46.77 42.95 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.693 0 CA-C-N 118.188 0.449 . . . . 0.0 111.774 -177.061 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 86.3 m -99.96 -25.95 14.15 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 114.178 1.177 . . . . 0.0 114.178 -169.931 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 55.05 -121.64 22.79 Favored Glycine 0 CA--C 1.531 1.051 0 C-N-CA 124.386 0.993 . . . . 0.0 113.477 169.85 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -62.18 -22.9 66.28 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.721 1.608 . . . . 0.0 113.365 -177.073 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 24.6 mmm180 -62.31 -37.34 85.2 Favored 'General case' 0 N--CA 1.472 0.674 0 O-C-N 121.438 -0.788 . . . . 0.0 112.255 175.848 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.2 164.91 9.04 Favored Glycine 0 CA--C 1.535 1.296 0 C-N-CA 124.462 1.029 . . . . 0.0 112.911 -171.105 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 54.7 p90 -146.99 155.09 41.98 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.467 1.107 . . . . 0.0 113.689 -172.483 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 53.7 t80 -105.38 84.17 2.06 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.659 1.584 . . . . 0.0 109.672 175.197 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 66.5 t80 -68.12 140.18 56.19 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.675 -0.641 . . . . 0.0 111.11 172.632 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 15.7 p -133.29 119.22 15.31 Favored Pre-proline 0 CA--C 1.539 0.543 0 C-N-CA 125.132 1.373 . . . . 0.0 110.647 179.583 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -77.58 -179.13 5.14 Favored 'Trans proline' 0 CA--C 1.538 0.7 0 C-N-CA 123.287 2.658 . . . . 0.0 111.023 173.944 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 28.9 ttpp -60.23 -27.1 66.93 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 124.258 1.023 . . . . 0.0 112.804 170.725 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 1.4 m -75.13 -12.79 60.38 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 127.278 2.231 . . . . 0.0 112.6 174.453 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 37.9 ttpt 75.69 -42.82 0.47 Allowed 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 129.059 2.944 . . . . 0.0 113.525 177.899 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 51.0 tpt85 . . . . . 0 C--O 1.251 1.181 0 C-N-CA 126.276 1.83 . . . . 0.0 112.563 -177.907 . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.512 0 N-CA-C 111.106 -0.798 . . . . 0.0 111.106 . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 7.8 tp -164.62 -48.65 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.069 0 C-N-CA 125.999 1.72 . . . . 0.0 113.039 178.592 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 10.0 p -66.85 -34.9 72.99 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.19 0 CA-C-N 119.873 1.215 . . . . 0.0 111.297 179.962 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -69.38 -11.46 60.84 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.941 1.296 . . . . 0.0 113.535 172.103 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 27.2 tt0 -91.07 -61.18 1.72 Allowed 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 123.681 0.792 . . . . 0.0 108.973 168.751 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 59.9 m -66.31 -21.5 66.27 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 114.647 1.351 . . . . 0.0 114.647 -169.961 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 7.6 t -86.87 -19.1 29.41 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 124.592 1.157 . . . . 0.0 113.008 176.232 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 34.4 m -104.11 -45.96 4.58 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 125.996 1.719 . . . . 0.0 111.28 -174.816 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 66.9 m -120.89 178.1 4.85 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 127.26 2.224 . . . . 0.0 110.11 177.087 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 10.7 tt -84.28 137.13 21.41 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 O-C-N 120.679 -1.263 . . . . 0.0 110.708 178.178 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.8 m -106.75 172.5 6.78 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 125.249 1.419 . . . . 0.0 111.586 176.989 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 34.6 t -122.13 149.17 43.96 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 125.32 1.448 . . . . 0.0 112.08 176.98 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 82.6 mt -60.08 -29.12 68.36 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 121.422 -0.799 . . . . 0.0 111.747 171.076 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 79.1 t80 -63.98 -28.15 69.61 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 113.272 0.842 . . . . 0.0 113.272 173.776 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 90.3 mt-30 -76.26 -37.68 57.27 Favored 'General case' 0 CA--C 1.534 0.328 0 O-C-N 121.621 -0.675 . . . . 0.0 110.466 172.689 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 31.7 mt -64.09 -40.33 96.0 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 118.668 0.667 . . . . 0.0 112.13 175.181 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -54.92 -34.26 62.97 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.297 1.039 . . . . 0.0 113.309 171.631 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 -69.03 -21.43 64.12 Favored 'General case' 0 CA--C 1.549 0.912 0 O-C-N 121.309 -0.869 . . . . 0.0 113.158 179.005 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 75.0 m-85 -96.45 -0.96 48.38 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.186 1.394 . . . . 0.0 114.009 175.758 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 72.7 m -71.31 150.32 45.25 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 119.237 0.926 . . . . 0.0 112.88 173.565 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 . . . . . 0 C--O 1.255 1.383 0 C-N-CA 125.259 1.424 . . . . 0.0 112.762 176.243 . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 46.2 t80 . . . . . 0 N--CA 1.486 1.365 0 CA-C-O 119.752 -0.166 . . . . 0.0 111.398 . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 21.0 t 74.98 -57.29 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.325 0 C-N-CA 128.321 2.648 . . . . 0.0 111.114 -175.996 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 25.1 m120 -111.99 134.99 53.2 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.729 1.212 . . . . 0.0 112.326 177.864 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -151.63 155.52 38.56 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 125.28 1.432 . . . . 0.0 111.646 -175.569 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 95.4 m-70 -93.15 133.37 36.4 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 108.004 -1.109 . . . . 0.0 108.004 166.148 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 84.0 mt -143.52 134.71 25.78 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 124.687 1.195 . . . . 0.0 110.538 -170.972 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.6 t -149.49 132.41 16.13 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 123.399 0.68 . . . . 0.0 111.883 -175.107 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 58.65 -124.41 36.46 Favored Glycine 0 N--CA 1.472 1.047 0 C-N-CA 124.356 0.979 . . . . 0.0 112.861 177.295 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.8 m -52.02 -37.77 54.54 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.789 1.236 . . . . 0.0 112.827 177.454 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 40.8 m80 -66.21 -40.18 90.16 Favored 'General case' 0 CA--C 1.543 0.684 0 O-C-N 121.084 -1.01 . . . . 0.0 111.582 -179.143 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 53.3 tp -66.86 -41.62 87.01 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.056 0.942 . . . . 0.0 111.171 174.636 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 40.1 t -62.63 -43.06 98.21 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 C-N-CA 124.337 1.055 . . . . 0.0 111.457 175.313 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -61.05 -49.33 77.81 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.565 0.746 . . . . 0.0 111.259 173.797 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.99 -42.15 98.83 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 123.493 0.717 . . . . 0.0 111.501 -179.397 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 29.9 mt -57.37 -52.11 66.7 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 118.613 -0.708 . . . . 0.0 111.339 173.561 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -66.87 -31.83 72.7 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 120.118 1.326 . . . . 0.0 112.484 -178.627 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 79.5 mt -69.64 -39.09 77.33 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 123.903 0.881 . . . . 0.0 112.475 174.82 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 42.4 t -70.73 -44.6 76.24 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 C-N-CA 123.904 0.882 . . . . 0.0 111.954 175.285 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 59.2 m -80.52 -26.45 38.11 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 113.575 0.954 . . . . 0.0 113.575 -174.399 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 71.1 -147.81 43.42 Favored Glycine 0 CA--C 1.532 1.097 0 C-N-CA 124.437 1.018 . . . . 0.0 111.535 -173.256 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -63.24 -14.99 55.62 Favored 'General case' 0 CA--C 1.544 0.732 0 N-CA-C 114.451 1.278 . . . . 0.0 114.451 -178.559 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 59.1 mtm180 -65.36 -35.59 81.43 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.891 1.277 . . . . 0.0 112.742 177.092 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.04 -178.69 51.0 Favored Glycine 0 CA--C 1.533 1.202 0 C-N-CA 124.234 0.921 . . . . 0.0 113.611 -172.852 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 45.7 p90 -124.99 165.86 17.38 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.791 1.636 . . . . 0.0 112.709 -175.056 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 34.6 t80 -142.19 41.99 1.65 Allowed 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 126.669 1.987 . . . . 0.0 110.081 -179.281 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -64.59 156.08 31.12 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 124.685 1.194 . . . . 0.0 114.161 -177.79 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 22.9 p -122.68 67.22 29.39 Favored Pre-proline 0 N--CA 1.48 1.062 0 C-N-CA 125.041 1.336 . . . . 0.0 112.807 -170.618 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -72.76 157.23 52.29 Favored 'Trans proline' 0 C--N 1.348 0.509 0 C-N-CA 123.103 2.536 . . . . 0.0 111.672 176.237 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 94.1 mttt 87.66 119.44 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 129.114 2.965 . . . . 0.0 112.455 172.075 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 31.3 p -59.44 -22.19 61.12 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 126.36 1.864 . . . . 0.0 113.998 173.464 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 83.3 tttt -69.6 -17.68 63.55 Favored 'General case' 0 CA--C 1.553 1.07 0 C-N-CA 125.197 1.399 . . . . 0.0 113.815 177.105 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 59.7 ttm-85 . . . . . 0 C--O 1.252 1.232 0 C-N-CA 126.472 1.909 . . . . 0.0 113.12 -177.974 . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.801 0 N-CA-C 111.582 -0.607 . . . . 0.0 111.582 . . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 17.2 tt -58.79 -27.73 35.68 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.221 0 N-CA-C 115.972 1.841 . . . . 0.0 115.972 -168.82 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 3.7 p -58.88 -29.54 40.86 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 CA-C-N 120.413 1.46 . . . . 0.0 112.17 173.399 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -73.04 -10.4 59.76 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.567 1.147 . . . . 0.0 112.693 177.033 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -99.74 -58.92 1.81 Allowed 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 124.387 1.075 . . . . 0.0 109.115 168.831 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 90.8 m -62.46 -29.85 70.82 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 115.085 1.513 . . . . 0.0 115.085 -172.74 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 8.1 t -87.93 -27.52 22.08 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 123.829 0.851 . . . . 0.0 112.562 179.188 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 23.1 m -90.47 -34.51 15.56 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 126.251 1.821 . . . . 0.0 111.992 -175.418 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.7 t -145.65 -163.68 1.78 Allowed 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 126.356 1.862 . . . . 0.0 110.18 178.654 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 17.8 mm -80.35 146.1 8.11 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 C-N-CA 124.927 1.291 . . . . 0.0 110.713 173.598 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 18.1 p -135.1 170.43 15.91 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.31 1.444 . . . . 0.0 111.886 169.433 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 74.7 m -124.89 153.43 42.64 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.184 1.394 . . . . 0.0 112.627 -170.05 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 43.1 mt -60.36 -31.65 70.53 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 113.619 0.97 . . . . 0.0 113.619 -173.87 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 91.9 t80 -62.43 -31.63 72.36 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 123.886 0.874 . . . . 0.0 113.243 172.909 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 68.5 mt-30 -75.44 -34.94 61.02 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.754 0.822 . . . . 0.0 110.53 176.014 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 57.9 mt -64.05 -48.17 77.32 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 123.334 0.654 . . . . 0.0 110.938 173.344 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -56.35 -28.87 60.42 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.802 1.241 . . . . 0.0 113.715 176.06 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 27.7 t30 -58.25 -26.97 63.55 Favored 'General case' 0 CA--C 1.546 0.823 0 O-C-N 120.931 -1.105 . . . . 0.0 113.523 178.3 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -97.86 -2.81 39.99 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.284 1.434 . . . . 0.0 113.606 179.614 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 80.3 m -82.83 161.3 22.0 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.456 1.103 . . . . 0.0 113.022 177.698 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 16.5 t-20 . . . . . 0 C--O 1.253 1.257 0 C-N-CA 124.911 1.284 . . . . 0.0 113.453 -175.727 . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 36.9 p90 . . . . . 0 N--CA 1.487 1.402 0 N-CA-C 111.914 0.338 . . . . 0.0 111.914 . . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 49.0 t 71.69 -58.68 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.342 0 C-N-CA 128.463 2.705 . . . . 0.0 113.871 171.431 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 34.6 m120 -78.48 125.46 29.39 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.388 1.475 . . . . 0.0 111.911 -174.71 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -150.79 159.94 44.2 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.281 1.032 . . . . 0.0 112.165 -179.352 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 86.2 m-70 -97.71 136.31 38.25 Favored 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 107.066 -1.457 . . . . 0.0 107.066 165.365 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 87.0 mt -147.2 137.2 23.17 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.505 1.122 . . . . 0.0 110.814 -177.16 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.8 t -152.38 138.76 18.51 Favored 'General case' 0 N--CA 1.47 0.559 0 O-C-N 121.318 -0.864 . . . . 0.0 113.024 -177.901 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 58.32 -128.16 46.91 Favored Glycine 0 N--CA 1.47 0.965 0 C-N-CA 124.35 0.976 . . . . 0.0 113.334 174.303 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.7 m -55.25 -32.54 62.41 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.528 1.131 . . . . 0.0 113.046 176.993 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 25.0 m80 -69.85 -41.41 74.93 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 121.16 -0.962 . . . . 0.0 111.325 177.328 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 64.1 tp -64.89 -45.92 83.91 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.132 0.973 . . . . 0.0 110.782 173.763 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 38.6 t -57.55 -46.31 86.13 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.928 0 C-N-CA 124.717 1.207 . . . . 0.0 111.229 175.494 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -64.84 -42.99 94.48 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.429 0.691 . . . . 0.0 111.811 176.0 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.22 -41.62 98.56 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 121.574 -0.704 . . . . 0.0 112.21 176.766 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -56.66 -46.79 80.86 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.533 0.733 . . . . 0.0 110.963 173.51 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 31.6 m-85 -65.37 -36.51 84.22 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 113.453 0.909 . . . . 0.0 113.453 175.534 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 77.9 mt -71.31 -42.34 68.74 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 118.98 0.809 . . . . 0.0 112.684 177.4 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 54.8 t -72.07 -47.82 52.73 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.726 0 C-N-CA 124.334 1.054 . . . . 0.0 111.292 -177.885 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 81.4 m -93.75 -9.63 36.99 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 114.243 1.201 . . . . 0.0 114.243 -174.734 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 70.82 -154.33 52.12 Favored Glycine 0 CA--C 1.532 1.122 0 C-N-CA 124.998 1.285 . . . . 0.0 112.929 177.387 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -64.03 -9.07 13.92 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.972 1.309 . . . . 0.0 114.335 176.252 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 14.6 ttp180 -61.53 -30.99 70.99 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.668 1.587 . . . . 0.0 113.038 179.195 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 82.09 173.97 49.21 Favored Glycine 0 CA--C 1.53 1.024 0 C-N-CA 125.31 1.433 . . . . 0.0 114.17 174.639 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 23.4 p90 -151.16 155.22 38.43 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.26 1.424 . . . . 0.0 113.42 -176.159 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 74.9 t80 -90.99 -29.85 17.15 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.367 1.067 . . . . 0.0 113.71 -170.924 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 85.3 t80 -70.21 153.32 43.23 Favored 'General case' 0 CA--C 1.546 0.808 0 N-CA-C 114.915 1.45 . . . . 0.0 114.915 -170.266 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 24.3 p -136.02 142.75 41.4 Favored Pre-proline 0 N--CA 1.476 0.829 0 C-N-CA 126.903 2.081 . . . . 0.0 108.784 169.045 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -70.29 124.29 10.73 Favored 'Trans proline' 0 C--N 1.35 0.619 0 C-N-CA 122.78 2.32 . . . . 0.0 111.099 -170.658 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 25.3 mmmt -64.22 -14.56 56.27 Favored 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 -178.198 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 19.4 m -62.92 -33.0 74.41 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 126.503 1.921 . . . . 0.0 111.95 169.953 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 80.8 tttt -122.09 -19.25 6.65 Favored 'General case' 0 CA--C 1.547 0.839 0 N-CA-C 114.514 1.301 . . . . 0.0 114.514 -171.475 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 80.7 mmt-85 . . . . . 0 C--O 1.249 1.053 0 C-N-CA 125.713 1.605 . . . . 0.0 112.346 -178.477 . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.67 0 CA-C-O 119.582 -0.565 . . . . 0.0 112.085 . . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . 0.417 HG23 ' H ' ' B' ' 27' ' ' THR . 9.0 tp -57.24 -34.58 46.11 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.204 0 CA-C-N 119.1 1.45 . . . . 0.0 113.626 -171.301 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 5.0 p -63.74 -26.92 41.79 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 O-C-N 121.088 -1.008 . . . . 0.0 112.982 176.651 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 65.4 tt0 -72.05 -13.61 61.64 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.857 1.263 . . . . 0.0 112.351 175.154 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 31.9 tt0 -104.97 -45.32 4.58 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.223 1.409 . . . . 0.0 110.946 176.269 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 29.7 m -80.95 -25.91 37.03 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 115.502 1.667 . . . . 0.0 115.502 -175.672 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 49.4 t -87.99 -55.25 3.84 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 120.249 1.386 . . . . 0.0 112.6 -173.416 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 25.9 p -77.86 -20.23 53.41 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 125.471 1.508 . . . . 0.0 113.371 -176.574 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.4 t -132.83 -173.36 3.16 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.533 1.533 . . . . 0.0 111.257 171.723 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 71.0 mt -87.5 139.72 16.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 124.785 1.234 . . . . 0.0 110.209 178.241 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.3 p -131.26 153.8 49.14 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 122.081 0.943 . . . . 0.0 112.125 169.424 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 41.5 t -95.24 153.91 17.44 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 125.802 1.641 . . . . 0.0 112.77 -178.695 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 11.1 mp -58.99 -27.85 65.79 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 121.466 -0.771 . . . . 0.0 111.613 169.305 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 74.5 t80 -62.41 -31.72 72.45 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 123.884 0.873 . . . . 0.0 113.093 171.729 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 35.4 mt-30 -77.28 -42.39 37.15 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 123.961 0.905 . . . . 0.0 110.49 174.34 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 80.7 mt -56.71 -52.72 63.85 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 123.764 0.826 . . . . 0.0 111.612 174.565 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -60.54 -34.66 74.45 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 123.841 0.857 . . . . 0.0 112.854 178.428 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -71.38 -32.19 68.18 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 123.688 0.795 . . . . 0.0 112.627 175.483 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -72.8 -43.4 62.8 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.117 0.967 . . . . 0.0 111.811 175.284 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 87.9 m -55.49 136.35 49.94 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 125.695 1.598 . . . . 0.0 112.229 170.92 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 4.4 p30 . . . . . 0 C--O 1.252 1.237 0 C-N-CA 126.945 2.098 . . . . 0.0 112.882 -171.399 . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 82.7 m-85 . . . . . 0 N--CA 1.485 1.307 0 N-CA-C 111.125 0.046 . . . . 0.0 111.125 . . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 57.4 t -66.77 137.59 24.55 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 C-N-CA 123.723 0.809 . . . . 0.0 109.334 171.884 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -158.48 150.48 21.48 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.451 1.101 . . . . 0.0 112.504 -170.64 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -175.85 176.9 1.75 Allowed 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 125.994 1.718 . . . . 0.0 110.703 -178.277 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 53.9 m-70 -77.94 135.72 37.88 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 124.5 1.12 . . . . 0.0 109.672 166.155 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 49.5 mt -141.81 135.82 30.02 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 126.607 1.963 . . . . 0.0 109.779 175.731 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 2.1 t -139.27 145.23 38.91 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 -174.315 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 50.21 -125.02 19.48 Favored Glycine 0 N--CA 1.471 0.976 0 C-N-CA 125.102 1.334 . . . . 0.0 114.277 169.957 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 18.9 m -55.65 -37.24 67.98 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.777 1.231 . . . . 0.0 113.09 178.223 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 70.3 m-70 -74.69 -30.29 61.51 Favored 'General case' 0 CA--C 1.541 0.599 0 O-C-N 120.79 -1.194 . . . . 0.0 112.79 176.99 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 39.2 tp -68.38 -44.68 74.62 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 118.805 0.73 . . . . 0.0 111.296 169.687 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 53.4 t -60.0 -46.21 94.43 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.014 0 C-N-CA 124.023 0.929 . . . . 0.0 110.919 173.993 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -58.61 -47.18 85.21 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 125.038 1.335 . . . . 0.0 111.869 174.33 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.53 -46.39 88.61 Favored 'General case' 0 CA--C 1.532 0.271 0 O-C-N 121.674 -0.641 . . . . 0.0 111.799 176.731 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 28.7 mt -54.84 -45.81 74.54 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 123.837 0.855 . . . . 0.0 111.138 175.788 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 11.0 m-85 -60.61 -51.51 69.11 Favored 'General case' 0 CA--C 1.544 0.722 0 O-C-N 121.041 -1.037 . . . . 0.0 112.819 173.972 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 91.9 mt -68.67 -40.23 80.26 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.133 0.973 . . . . 0.0 113.348 -175.395 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 54.3 t -73.58 -43.98 54.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 124.858 1.263 . . . . 0.0 111.365 -177.209 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 69.3 m -87.93 -27.91 21.84 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 114.705 1.372 . . . . 0.0 114.705 -170.147 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 56.17 -121.56 24.33 Favored Glycine 0 CA--C 1.531 1.045 0 C-N-CA 124.114 0.864 . . . . 0.0 112.799 174.575 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 3.7 pm0 -64.78 -14.62 59.69 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.809 1.643 . . . . 0.0 115.045 -177.064 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 61.1 mtp85 -62.77 -28.43 69.98 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 119.012 0.824 . . . . 0.0 112.655 172.621 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.84 133.05 1.57 Allowed Glycine 0 CA--C 1.53 1.014 0 C-N-CA 125.023 1.297 . . . . 0.0 110.661 -170.59 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -78.17 164.26 25.1 Favored 'General case' 0 CA--C 1.536 0.441 0 O-C-N 122.05 -0.676 . . . . 0.0 112.601 -177.697 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 53.4 t80 -155.75 134.63 11.99 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.398 1.079 . . . . 0.0 110.573 170.706 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 40.6 t80 -135.68 146.37 47.72 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 125.834 1.654 . . . . 0.0 111.849 -175.988 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 27' ' ' THR . . . . . 0.417 ' H ' HG23 ' A' ' 2' ' ' ILE . 27.1 p -141.32 139.68 19.43 Favored Pre-proline 0 CA--C 1.544 0.727 0 C-N-CA 126.108 1.763 . . . . 0.0 110.43 175.721 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -84.7 -177.43 2.87 Favored 'Trans proline' 0 CA--C 1.539 0.759 0 C-N-CA 124.01 3.14 . . . . 0.0 112.55 -174.744 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 33.0 ttpt -78.68 37.54 0.29 Allowed 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 126.437 1.895 . . . . 0.0 112.921 174.855 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 6.2 m 66.06 51.81 1.27 Allowed 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 127.061 2.145 . . . . 0.0 110.137 -176.951 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt -65.64 -26.94 68.03 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 124.63 1.172 . . . . 0.0 113.372 -177.614 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 80.6 ttt180 . . . . . 0 C--O 1.25 1.086 0 C-N-CA 127.002 2.121 . . . . 0.0 110.971 -178.732 . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.649 0 N-CA-C 111.545 -0.622 . . . . 0.0 111.545 . . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 9.0 tp -54.11 -36.54 32.39 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.283 0 N-CA-C 114.971 1.471 . . . . 0.0 114.971 -169.437 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 6.3 p -64.96 -24.72 36.1 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 O-C-N 121.342 -0.849 . . . . 0.0 112.985 178.855 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -75.93 0.28 18.92 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 124.067 0.947 . . . . 0.0 112.319 175.466 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 31.9 tt0 -124.46 -48.21 1.83 Allowed 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.221 1.408 . . . . 0.0 111.216 174.992 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 17.1 m -71.02 -27.39 63.64 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 114.736 1.384 . . . . 0.0 114.736 179.735 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 12.3 t -83.79 -42.07 16.88 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 119.492 1.042 . . . . 0.0 111.449 179.295 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 19.7 p -76.8 -33.94 57.97 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 126.955 2.102 . . . . 0.0 112.911 -177.159 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 73.8 m -134.27 170.8 15.16 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.468 1.507 . . . . 0.0 111.885 179.827 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 58.7 mt -68.47 136.12 27.08 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 O-C-N 120.8 -1.188 . . . . 0.0 110.13 170.833 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.0 p -133.07 162.98 30.28 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.462 1.105 . . . . 0.0 112.975 175.167 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 6.2 t -128.76 172.7 11.01 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 125.479 1.511 . . . . 0.0 112.566 -175.983 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -59.03 -31.65 69.03 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.133 1.373 . . . . 0.0 113.1 -169.855 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 87.9 t80 -63.5 -33.5 75.71 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 123.608 0.763 . . . . 0.0 113.008 175.951 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 38.0 mt-30 -76.55 -33.7 58.54 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 124.295 1.038 . . . . 0.0 110.683 176.616 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 80.8 mt -68.31 -52.81 29.39 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.871 0.868 . . . . 0.0 111.387 174.038 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -63.95 -21.47 66.5 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 113.56 0.948 . . . . 0.0 113.56 -179.026 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.3 t30 -68.69 -33.32 73.76 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 123.877 0.871 . . . . 0.0 112.618 174.876 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 9.1 m-85 -88.52 -14.34 37.99 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 114.302 1.223 . . . . 0.0 114.302 -179.086 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 91.7 m -71.53 160.34 32.88 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.692 0.797 . . . . 0.0 112.936 170.988 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 7.1 p-10 . . . . . 0 C--O 1.254 1.299 0 C-N-CA 126.895 2.078 . . . . 0.0 113.356 179.675 . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 67.5 m-85 . . . . . 0 N--CA 1.484 1.261 0 CA-C-O 117.898 -1.048 . . . . 0.0 108.743 . . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 80.2 t -68.62 -36.37 74.25 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.38 0 CA-C-N 120.861 1.664 . . . . 0.0 109.475 168.625 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 51.7 p-10 -65.48 149.02 50.74 Favored 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 125.458 1.503 . . . . 0.0 112.291 168.515 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -162.14 165.3 27.24 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.13 0.972 . . . . 0.0 111.253 -171.441 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 34.0 m-70 -74.86 143.29 43.93 Favored 'General case' 0 CA--C 1.55 0.979 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 164.412 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 40.6 mt -142.97 137.73 29.58 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 125.773 1.629 . . . . 0.0 109.208 174.722 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 3.4 t -145.62 148.76 33.45 Favored 'General case' 0 N--CA 1.47 0.574 0 O-C-N 121.367 -0.833 . . . . 0.0 112.581 -176.2 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 52.89 -128.91 38.03 Favored Glycine 0 N--CA 1.473 1.133 0 C-N-CA 125.08 1.324 . . . . 0.0 114.018 172.141 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 26.7 m -56.87 -38.17 72.36 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.182 0.993 . . . . 0.0 113.03 -178.717 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 69.7 m-70 -73.13 -30.19 63.43 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 119.308 0.958 . . . . 0.0 112.839 177.529 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 51.1 tp -68.5 -45.77 71.42 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 118.881 0.764 . . . . 0.0 111.119 170.85 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 73.8 t -63.94 -42.3 95.33 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 CA-C-N 118.489 0.586 . . . . 0.0 111.351 176.435 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -56.3 -49.54 74.0 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.991 1.317 . . . . 0.0 111.502 171.018 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.38 -43.77 98.3 Favored 'General case' 0 CA--C 1.536 0.423 0 O-C-N 121.547 -0.721 . . . . 0.0 111.448 177.48 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 21.3 mt -58.24 -44.32 88.22 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 123.626 0.771 . . . . 0.0 111.535 176.516 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 14.8 m-85 -63.03 -45.36 92.65 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 119.107 0.867 . . . . 0.0 112.755 174.116 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 9.0 mp -72.75 -41.17 65.41 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 123.799 0.839 . . . . 0.0 113.063 -176.512 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 55.5 t -70.5 -43.48 77.9 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 C-N-CA 124.644 1.178 . . . . 0.0 110.934 -177.741 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 68.7 m -79.82 -15.95 56.42 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 113.412 0.893 . . . . 0.0 113.412 -178.565 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 59.12 -120.72 23.94 Favored Glycine 0 N--CA 1.469 0.884 0 C-N-CA 125.09 1.328 . . . . 0.0 113.427 168.842 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -59.93 -24.07 64.05 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.409 1.484 . . . . 0.0 113.418 -178.332 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 79.9 mtp180 -63.83 -30.36 71.46 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.084 0.954 . . . . 0.0 112.276 173.331 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.22 -155.19 51.38 Favored Glycine 0 CA--C 1.534 1.257 0 C-N-CA 124.461 1.029 . . . . 0.0 111.495 -168.904 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 58.3 t80 -149.36 148.01 29.0 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.431 1.492 . . . . 0.0 109.969 174.923 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 46.6 t80 -159.06 64.69 0.41 Allowed 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 124.234 1.014 . . . . 0.0 111.631 -169.28 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 67.7 t80 -156.97 155.92 32.12 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.713 1.605 . . . . 0.0 111.116 176.336 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 22.9 p -118.96 99.88 50.92 Favored Pre-proline 0 N--CA 1.475 0.785 0 C-N-CA 125.428 1.491 . . . . 0.0 110.557 -179.825 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -63.61 170.44 8.37 Favored 'Trans proline' 0 CA--C 1.539 0.768 0 C-N-CA 123.528 2.819 . . . . 0.0 113.441 173.842 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -59.3 -26.5 65.04 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 114.172 1.175 . . . . 0.0 114.172 -178.384 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 2.4 t -114.21 103.22 10.88 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 126.298 1.839 . . . . 0.0 108.077 169.774 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 28.2 tptp -74.1 124.63 26.66 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 125.479 1.512 . . . . 0.0 112.35 -175.133 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.12 0 C-N-CA 125.619 1.568 . . . . 0.0 112.018 169.983 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.193 0 N-CA-C 110.842 -0.903 . . . . 0.0 110.842 . . . . . . . . . 0 0 . 1 . 031 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 6.3 tp 169.75 -41.62 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.379 0 C-N-CA 130.812 3.645 . . . . 0.0 110.116 171.992 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 7.2 p -61.09 -32.41 52.64 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 O-C-N 121.408 -0.808 . . . . 0.0 112.335 179.46 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.7 pm0 -73.15 -18.98 61.22 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.371 1.068 . . . . 0.0 113.505 175.421 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 25.5 tp60 -88.74 -44.05 10.83 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.226 1.01 . . . . 0.0 110.3 172.445 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 21.4 m -78.82 -32.1 46.11 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 115.254 1.575 . . . . 0.0 115.254 -177.37 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 42.6 t -93.16 -59.24 2.08 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-N 119.825 1.193 . . . . 0.0 112.12 -175.487 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 19.2 m -67.84 -44.58 76.87 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.746 1.218 . . . . 0.0 110.62 -176.525 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.3 t -103.04 -163.16 0.97 Allowed 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.623 1.169 . . . . 0.0 110.832 169.119 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 82.0 mt -109.21 138.91 34.25 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 125.835 1.654 . . . . 0.0 109.471 -179.001 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 10.2 p -129.87 170.54 13.77 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.779 0.832 . . . . 0.0 113.149 173.565 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 81.9 p -120.22 167.13 12.58 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 125.962 1.705 . . . . 0.0 112.562 -175.43 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 51.0 mt -62.16 -30.94 71.4 Favored 'General case' 0 CA--C 1.539 0.554 0 O-C-N 121.751 -0.593 . . . . 0.0 111.954 173.989 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 89.7 t80 -64.81 -36.72 85.25 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 121.416 -0.802 . . . . 0.0 112.739 171.891 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -70.82 -26.16 63.18 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 118.632 -0.699 . . . . 0.0 111.815 173.011 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 74.4 mt -73.95 -43.62 57.62 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 119.423 1.01 . . . . 0.0 112.182 169.728 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -55.51 -34.87 65.02 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 123.575 0.75 . . . . 0.0 112.777 175.11 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 15.1 t30 -58.81 -27.77 65.38 Favored 'General case' 0 CA--C 1.55 0.969 0 N-CA-C 113.679 0.992 . . . . 0.0 113.679 176.551 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 49.9 m-85 -98.3 0.44 45.59 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 125.482 1.513 . . . . 0.0 113.751 179.339 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 37.9 t -75.37 167.74 21.32 Favored 'General case' 0 CA--C 1.544 0.745 0 O-C-N 120.846 -1.159 . . . . 0.0 112.116 169.917 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 25.9 m120 . . . . . 0 C--O 1.251 1.177 0 C-N-CA 126.356 1.862 . . . . 0.0 112.094 177.643 . . . . . . . . 0 0 . 1 . 031 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 33.9 t80 . . . . . 0 N--CA 1.487 1.399 0 CA-C-O 117.985 -1.007 . . . . 0.0 110.106 . . . . . . . . . 0 0 . 1 . 031 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 4.8 p -173.75 102.84 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 C-N-CA 126.601 1.96 . . . . 0.0 107.793 178.13 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 10.4 m120 -144.8 135.77 24.88 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.623 1.169 . . . . 0.0 111.292 -167.156 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 2.8 mm-40 -161.48 170.04 20.69 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.842 1.257 . . . . 0.0 112.542 -177.27 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 86.5 m-70 -86.04 135.02 33.8 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.327 1.051 . . . . 0.0 109.647 167.62 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 82.5 mt -139.85 119.38 13.1 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 125.892 1.677 . . . . 0.0 109.926 178.576 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 72.1 m -123.29 130.63 53.0 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 124.911 1.284 . . . . 0.0 112.243 -174.352 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 56.31 -120.65 20.74 Favored Glycine 0 N--CA 1.472 1.072 0 C-N-CA 124.729 1.156 . . . . 0.0 113.733 169.344 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 22.2 m -54.24 -33.24 57.98 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 124.562 1.145 . . . . 0.0 112.912 177.459 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 34.7 m80 -71.24 -41.11 70.54 Favored 'General case' 0 CA--C 1.539 0.551 0 O-C-N 120.895 -1.128 . . . . 0.0 111.34 178.07 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 60.4 tp -63.79 -45.27 90.44 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 123.637 0.775 . . . . 0.0 111.024 172.648 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 31.8 t -60.33 -46.12 95.43 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 C-N-CA 124.33 1.052 . . . . 0.0 110.77 177.808 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -63.87 -45.92 87.27 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 123.198 0.599 . . . . 0.0 111.767 176.409 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.27 -42.18 96.58 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 118.638 0.654 . . . . 0.0 111.897 179.235 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 27.1 tp -66.14 -37.75 86.46 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.075 0.95 . . . . 0.0 111.292 178.825 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 11.8 m-85 -64.67 -42.97 94.99 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 119.248 0.931 . . . . 0.0 112.448 169.109 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 70.2 mt -63.88 -39.09 93.38 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 119.08 0.855 . . . . 0.0 112.226 177.872 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 39.3 t -68.59 -45.55 81.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 124.052 0.941 . . . . 0.0 112.212 174.353 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 16.8 t -84.96 -23.21 28.85 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 114.238 1.199 . . . . 0.0 114.238 -171.915 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 77.38 -157.59 46.44 Favored Glycine 0 CA--C 1.533 1.165 0 C-N-CA 124.857 1.217 . . . . 0.0 112.372 -174.845 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -69.36 -10.86 59.83 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.034 1.334 . . . . 0.0 114.44 -175.083 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 71.1 mtm-85 -67.7 -25.56 65.74 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.698 1.199 . . . . 0.0 113.883 -175.975 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.17 155.18 12.36 Favored Glycine 0 CA--C 1.533 1.204 0 C-N-CA 124.856 1.217 . . . . 0.0 112.74 -175.02 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 22.2 p90 -115.15 170.89 8.03 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.64 1.576 . . . . 0.0 112.619 -177.591 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 45.2 p90 -108.74 152.06 25.36 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.705 1.202 . . . . 0.0 110.003 167.41 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 49.9 t80 -156.98 144.94 19.28 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 123.563 0.745 . . . . 0.0 112.742 -169.59 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 53.8 m -141.1 134.32 14.55 Favored Pre-proline 0 N--CA 1.473 0.707 0 C-N-CA 126.268 1.827 . . . . 0.0 108.361 173.755 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_endo -76.0 -170.48 0.86 Allowed 'Trans proline' 0 CA--C 1.542 0.91 0 C-N-CA 123.261 2.641 . . . . 0.0 111.896 178.339 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 28.4 ttpp -56.11 -34.26 65.89 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 114.489 1.292 . . . . 0.0 114.489 -175.336 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 9.6 t -162.44 -137.56 0.04 OUTLIER 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 126.726 2.01 . . . . 0.0 108.696 -173.461 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 65.1 pttt -68.6 -15.27 63.47 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.759 1.624 . . . . 0.0 114.358 177.206 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 . . . . . 0 C--O 1.251 1.173 0 C-N-CA 128.686 2.795 . . . . 0.0 110.525 177.159 . . . . . . . . 0 0 . 1 . 032 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.678 0 N-CA-C 111.988 -0.445 . . . . 0.0 111.988 . . . . . . . . . 0 0 . 1 . 032 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 19.5 tt -87.72 -31.04 5.7 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 N-CA-C 114.498 1.296 . . . . 0.0 114.498 -177.924 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 58.0 t -67.68 -39.45 82.17 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.099 0 C-N-CA 123.712 0.805 . . . . 0.0 111.977 -168.16 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.7 pm0 -75.24 -35.49 61.42 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.436 1.094 . . . . 0.0 111.928 171.464 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 11.0 tp60 -74.26 -43.72 55.78 Favored 'General case' 0 CA--C 1.537 0.471 0 O-C-N 121.363 -0.835 . . . . 0.0 111.962 -172.396 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 33.3 m -65.58 -21.08 66.56 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 123.706 0.802 . . . . 0.0 113.072 172.947 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 48.7 t -91.49 -45.75 8.36 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 118.701 0.682 . . . . 0.0 112.09 -178.622 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 49.2 p -76.33 -20.59 57.11 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 125.234 1.413 . . . . 0.0 113.838 179.932 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 7.8 t -143.63 -167.82 2.68 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.733 1.213 . . . . 0.0 110.991 173.653 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 70.3 mt -93.55 132.23 38.29 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 C-N-CA 124.689 1.196 . . . . 0.0 109.052 172.953 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 27.0 p -114.46 164.74 13.55 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.364 1.066 . . . . 0.0 113.305 178.238 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 36.8 t -94.69 152.52 18.41 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 124.802 1.241 . . . . 0.0 112.813 -175.855 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 48.7 mt -60.82 -30.64 70.21 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 121.457 -0.777 . . . . 0.0 111.84 173.724 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 90.9 t80 -60.84 -36.81 80.08 Favored 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 171.788 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 64.6 mt-30 -70.32 -44.56 67.98 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.322 0.649 . . . . 0.0 110.061 176.886 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 98.6 mt -57.77 -42.98 85.2 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.7 0.8 . . . . 0.0 111.958 176.667 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -72.12 -35.09 69.04 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 113.981 1.104 . . . . 0.0 113.981 175.276 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -72.66 -34.77 67.45 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 119.104 0.865 . . . . 0.0 112.958 -177.628 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 27.5 m-85 -80.75 -5.83 57.66 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 113.741 1.015 . . . . 0.0 113.741 173.868 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 8.3 t -76.8 173.32 11.82 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 123.961 0.905 . . . . 0.0 112.785 172.401 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 . . . . . 0 C--O 1.253 1.268 0 C-N-CA 125.363 1.465 . . . . 0.0 114.022 -175.403 . . . . . . . . 0 0 . 1 . 032 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 54.9 p90 . . . . . 0 N--CA 1.483 1.193 0 N-CA-C 111.232 0.086 . . . . 0.0 111.232 . . . . . . . . . 0 0 . 1 . 032 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 17.5 m -71.28 145.97 12.12 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.33 0 C-N-CA 123.909 0.884 . . . . 0.0 112.334 -177.308 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 58.91 70.71 0.63 Allowed 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 125.546 1.538 . . . . 0.0 110.98 178.803 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -141.96 166.12 25.59 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 126.869 2.068 . . . . 0.0 110.228 -168.713 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 24.3 m-70 -68.08 131.87 46.21 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 165.008 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 74.9 mt -140.24 115.75 10.06 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 126.224 1.81 . . . . 0.0 109.072 -173.615 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 78.2 m -121.57 143.82 49.08 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.084 1.353 . . . . 0.0 111.544 -178.649 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 48.62 -124.12 11.46 Favored Glycine 0 N--CA 1.473 1.118 0 C-N-CA 125.298 1.428 . . . . 0.0 114.529 169.338 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 18.7 m -53.6 -39.89 65.26 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.444 1.098 . . . . 0.0 113.338 178.559 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 18.6 t60 -72.4 -31.23 65.35 Favored 'General case' 0 CA--C 1.543 0.677 0 O-C-N 120.971 -1.08 . . . . 0.0 112.058 179.655 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 50.3 tp -67.17 -42.87 83.53 Favored 'General case' 0 C--O 1.224 -0.253 0 O-C-N 121.503 -0.748 . . . . 0.0 110.924 168.885 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 77.2 t -60.81 -43.45 95.45 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 CA-C-N 119.029 0.831 . . . . 0.0 111.241 175.983 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 67.2 mt-10 -54.75 -50.91 67.24 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 118.927 0.785 . . . . 0.0 111.087 171.166 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.02 -44.4 92.68 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.681 0.792 . . . . 0.0 112.11 -177.821 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 33.1 mt -56.22 -48.01 77.32 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 124.169 0.988 . . . . 0.0 110.892 176.338 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 14.2 m-85 -65.41 -43.77 89.53 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 119.074 0.852 . . . . 0.0 112.851 177.201 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 76.9 mt -66.85 -42.93 84.87 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 123.608 0.763 . . . . 0.0 112.552 -179.87 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 71.0 t -77.14 -36.65 24.86 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 C-N-CA 124.557 1.143 . . . . 0.0 111.602 -176.741 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 49.8 t -77.57 -31.48 53.17 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 113.875 1.065 . . . . 0.0 113.875 178.017 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 76.95 -140.37 24.78 Favored Glycine 0 CA--C 1.531 1.054 0 C-N-CA 124.072 0.844 . . . . 0.0 112.886 178.041 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 3.6 pm0 -66.46 -16.67 64.29 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 115.416 1.635 . . . . 0.0 115.416 -169.499 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 49.2 mtm180 -62.74 -37.24 85.82 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 118.785 0.721 . . . . 0.0 112.106 174.957 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.62 139.15 1.51 Allowed Glycine 0 CA--C 1.531 1.07 0 C-N-CA 125.809 1.671 . . . . 0.0 113.147 179.139 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 50.1 t80 -71.48 156.86 38.96 Favored 'General case' 0 CA--C 1.545 0.762 0 O-C-N 122.066 -0.667 . . . . 0.0 112.494 177.701 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 89.7 t80 -156.42 -32.29 0.09 Allowed 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 114.723 1.379 . . . . 0.0 114.723 -168.882 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 79.1 t80 -60.78 131.53 50.99 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.281 1.033 . . . . 0.0 113.285 -176.102 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 39.7 p -74.74 145.92 82.38 Favored Pre-proline 0 N--CA 1.477 0.899 0 O-C-N 121.27 -0.894 . . . . 0.0 111.697 -176.807 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -73.32 137.84 26.47 Favored 'Trans proline' 0 N--CA 1.456 -0.706 0 C-N-CA 122.955 2.437 . . . . 0.0 111.332 -178.537 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 45.3 mmtm -105.24 -20.6 13.45 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 113.628 0.973 . . . . 0.0 113.628 -177.69 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 17.0 m -69.06 -39.16 79.3 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 125.778 1.631 . . . . 0.0 111.476 178.248 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 64.9 tttm -154.11 135.83 14.43 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.789 1.635 . . . . 0.0 110.506 176.152 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.184 0 C-N-CA 127.975 2.51 . . . . 0.0 111.967 -177.503 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.294 0 CA-C-O 118.834 -0.981 . . . . 0.0 111.039 . . . . . . . . . 0 0 . 1 . 033 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 7.1 tp 164.47 -39.1 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.45 0 C-N-CA 130.791 3.636 . . . . 0.0 110.399 172.747 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 48.4 t -59.21 -35.91 60.29 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 C-N-CA 124.188 0.995 . . . . 0.0 110.957 178.437 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 13.0 pm0 -69.67 -9.28 53.66 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.79 1.236 . . . . 0.0 114.047 177.207 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 25.7 tt0 -99.68 -66.41 0.91 Allowed 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.17 0.988 . . . . 0.0 109.152 169.505 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 50.8 m -71.99 -26.53 62.27 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 115.464 1.654 . . . . 0.0 115.464 -168.928 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 13.4 t -85.43 -44.54 12.66 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 119.304 0.956 . . . . 0.0 110.992 176.924 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 27.3 m -65.63 -40.13 92.21 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 126.086 1.754 . . . . 0.0 111.893 -179.743 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 67.3 m -138.25 172.25 13.19 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.232 1.413 . . . . 0.0 112.0 -174.866 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 43.4 mt -64.98 136.17 27.1 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 O-C-N 120.748 -1.22 . . . . 0.0 110.179 170.666 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 9.6 p -134.51 176.72 8.37 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.235 1.414 . . . . 0.0 111.673 170.793 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 22.9 t -138.03 161.78 35.83 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.556 1.143 . . . . 0.0 112.708 -179.936 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -61.18 -28.88 69.45 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.927 1.291 . . . . 0.0 111.783 -179.932 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 79.9 t80 -63.27 -24.25 67.78 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.68 1.192 . . . . 0.0 113.439 172.954 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 62.8 mt-30 -85.1 -37.43 20.28 Favored 'General case' 0 N--CA 1.469 0.517 0 O-C-N 121.549 -0.719 . . . . 0.0 110.638 171.884 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 27.5 mt -60.97 -33.33 73.04 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 118.965 0.802 . . . . 0.0 113.001 175.532 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.7 mm-40 -50.93 -30.97 16.23 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 124.637 1.175 . . . . 0.0 113.714 169.175 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 -73.93 -19.86 60.55 Favored 'General case' 0 CA--C 1.546 0.82 0 O-C-N 121.09 -1.006 . . . . 0.0 113.101 177.037 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 79.9 m-85 -93.35 -7.19 45.45 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.593 1.557 . . . . 0.0 113.191 176.944 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 33.1 m -74.16 136.44 42.87 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.477 1.111 . . . . 0.0 109.236 167.598 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 9.3 p30 . . . . . 0 C--O 1.253 1.268 0 CA-C-O 118.026 -0.988 . . . . 0.0 113.364 179.293 . . . . . . . . 0 0 . 1 . 033 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 63.7 m-85 . . . . . 0 N--CA 1.488 1.464 0 CA-C-O 119.051 -0.5 . . . . 0.0 110.299 . . . . . . . . . 0 0 . 1 . 033 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 27.6 m -61.02 -34.71 61.07 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.367 0 CA-C-N 119.97 1.259 . . . . 0.0 112.616 179.227 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 24.6 m120 -83.87 120.42 26.05 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.429 1.091 . . . . 0.0 109.737 168.93 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 5.4 tt0 -166.76 163.47 16.52 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 124.172 0.989 . . . . 0.0 111.646 -177.014 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 26.4 m-70 -77.48 142.5 39.11 Favored 'General case' 0 CA--C 1.548 0.87 0 N-CA-C 107.631 -1.248 . . . . 0.0 107.631 163.932 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 58.5 mt -139.72 132.53 29.15 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 125.719 1.607 . . . . 0.0 108.557 175.251 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.6 t -144.04 149.33 36.5 Favored 'General case' 0 N--CA 1.47 0.569 0 O-C-N 121.439 -0.788 . . . . 0.0 112.391 -175.054 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.32 -128.01 43.19 Favored Glycine 0 N--CA 1.469 0.855 0 C-N-CA 124.702 1.144 . . . . 0.0 113.515 172.611 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 27.2 p -53.41 -44.99 69.17 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.437 1.095 . . . . 0.0 112.923 177.363 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 12.8 m-70 -67.38 -31.27 71.39 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 120.941 -1.099 . . . . 0.0 113.352 179.255 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 40.6 tp -70.53 -44.34 67.73 Favored 'General case' 0 N--CA 1.466 0.343 0 O-C-N 121.616 -0.677 . . . . 0.0 110.892 171.517 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 54.0 t -59.02 -43.04 88.03 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 C-N-CA 123.585 0.754 . . . . 0.0 111.168 173.692 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -59.43 -44.5 92.9 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 123.864 0.866 . . . . 0.0 111.819 172.229 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.53 -42.44 99.52 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-N 119.062 0.846 . . . . 0.0 111.982 176.467 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -58.48 -46.04 87.45 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 118.79 0.723 . . . . 0.0 111.599 173.162 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 9.5 m-85 -59.12 -46.09 89.23 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 119.024 0.829 . . . . 0.0 112.339 174.28 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 67.8 mt -68.13 -39.64 82.66 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.196 0.998 . . . . 0.0 112.495 -178.229 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 71.9 t -72.23 -53.49 19.54 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 C-N-CA 123.629 0.772 . . . . 0.0 111.213 177.249 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 65.5 m -79.64 -31.69 41.55 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 113.579 0.955 . . . . 0.0 113.579 -170.729 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.5 -133.97 41.76 Favored Glycine 0 CA--C 1.528 0.871 0 C-N-CA 124.094 0.854 . . . . 0.0 111.815 178.09 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -65.32 -14.57 61.09 Favored 'General case' 0 CA--C 1.543 0.673 0 N-CA-C 114.633 1.346 . . . . 0.0 114.633 -179.632 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 88.0 mtm180 -66.43 -40.03 89.25 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 118.775 0.716 . . . . 0.0 112.216 177.981 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.93 170.74 45.0 Favored Glycine 0 CA--C 1.536 1.377 0 C-N-CA 124.225 0.917 . . . . 0.0 112.67 -168.795 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 54.6 p90 -148.03 166.49 27.6 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 114.835 1.42 . . . . 0.0 114.835 -169.272 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -99.65 141.78 32.0 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.495 1.518 . . . . 0.0 110.418 168.49 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 34.7 t80 -158.24 129.54 6.55 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.049 1.34 . . . . 0.0 111.47 177.893 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 29.5 p -149.22 154.51 39.11 Favored Pre-proline 0 N--CA 1.476 0.863 0 C-N-CA 126.403 1.881 . . . . 0.0 110.613 170.556 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_endo -72.05 176.63 8.16 Favored 'Trans proline' 0 C--N 1.354 0.839 0 C-N-CA 124.272 3.315 . . . . 0.0 112.434 178.154 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 77.8 mttt -58.74 -40.17 83.06 Favored 'General case' 0 CA--C 1.544 0.739 0 N-CA-C 114.43 1.27 . . . . 0.0 114.43 -169.6 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 41.8 m -144.58 -80.42 0.18 Allowed 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 125.62 1.568 . . . . 0.0 110.438 -174.613 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 39.7 ttpt -85.64 128.94 34.92 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.12 0.968 . . . . 0.0 111.989 -176.023 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 51.0 tpt85 . . . . . 0 C--O 1.252 1.211 0 C-N-CA 125.69 1.596 . . . . 0.0 112.85 175.966 . . . . . . . . 0 0 . 1 . 034 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.799 0 N-CA-C 110.911 -0.876 . . . . 0.0 110.911 . . . . . . . . . 0 0 . 1 . 034 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 12.1 tt -64.0 -26.25 40.07 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.088 0 N-CA-C 115.676 1.732 . . . . 0.0 115.676 -169.065 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . 0.404 HG12 ' H ' ' B' ' 29' ' ' LYS . 2.7 p -64.46 -29.86 48.56 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.193 0 CA-C-N 120.187 1.358 . . . . 0.0 112.735 175.396 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -73.8 -36.4 64.99 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 118.501 0.591 . . . . 0.0 111.394 173.08 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 32.1 tt0 -76.94 -57.96 3.55 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 124.75 1.22 . . . . 0.0 111.952 -174.988 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 21.0 m -67.14 -21.5 65.82 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 113.892 1.071 . . . . 0.0 113.892 -177.27 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 8.1 t -87.82 -30.15 20.43 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.804 0.841 . . . . 0.0 112.702 179.949 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 28.9 m -88.47 -46.49 9.08 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 125.095 1.358 . . . . 0.0 110.949 177.359 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 49.1 m -113.39 167.66 10.38 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 125.714 1.606 . . . . 0.0 111.473 -176.482 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 62.9 mt -75.08 137.17 23.53 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 O-C-N 120.96 -1.088 . . . . 0.0 108.705 170.429 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.4 p -132.87 173.34 11.49 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.61 1.164 . . . . 0.0 112.816 178.01 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 23.2 t -131.88 166.29 21.94 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 125.313 1.445 . . . . 0.0 112.459 -175.67 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 60.0 mt -57.64 -29.16 64.34 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.781 1.233 . . . . 0.0 112.455 177.94 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 86.9 t80 -61.03 -31.31 70.95 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 124.387 1.075 . . . . 0.0 113.317 173.584 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 33.4 mt-30 -79.19 -33.3 44.02 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 123.731 0.812 . . . . 0.0 110.856 175.309 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 88.2 mt -63.61 -42.72 98.2 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 118.779 0.718 . . . . 0.0 111.553 171.728 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -56.38 -34.81 67.05 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.676 0.79 . . . . 0.0 113.027 174.698 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 17.3 t30 -64.14 -26.63 68.62 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 113.109 0.781 . . . . 0.0 113.109 179.76 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 54.7 m-85 -98.37 1.67 47.2 Favored 'General case' 0 CA--C 1.551 1.007 0 C-N-CA 125.363 1.465 . . . . 0.0 113.826 179.475 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 46.4 t -84.53 174.11 10.28 Favored 'General case' 0 CA--C 1.55 0.942 0 C-N-CA 124.886 1.274 . . . . 0.0 111.223 168.151 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 8.3 p30 . . . . . 0 C--O 1.253 1.251 0 C-N-CA 125.177 1.391 . . . . 0.0 112.042 170.535 . . . . . . . . 0 0 . 1 . 034 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 15.2 t80 . . . . . 0 N--CA 1.488 1.439 0 CA-C-O 118.912 -0.566 . . . . 0.0 110.03 . . . . . . . . . 0 0 . 1 . 034 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 30.2 m -65.06 -22.44 31.39 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.341 0 CA-C-N 120.621 1.555 . . . . 0.0 114.433 -174.431 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 23.0 m120 -78.75 118.76 21.13 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.589 1.155 . . . . 0.0 111.545 176.773 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 16.7 tt0 -162.81 164.68 26.05 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.804 1.242 . . . . 0.0 111.096 -179.808 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 97.5 m-70 -79.02 146.62 33.23 Favored 'General case' 0 CA--C 1.544 0.726 0 O-C-N 120.782 -1.199 . . . . 0.0 110.058 167.9 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 83.5 mt -141.24 133.43 27.96 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 125.039 1.335 . . . . 0.0 110.075 175.525 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 5.0 t -153.47 143.26 21.95 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 121.526 -0.734 . . . . 0.0 112.211 -177.319 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 60.36 -133.38 50.37 Favored Glycine 0 CA--C 1.531 1.069 0 C-N-CA 124.377 0.989 . . . . 0.0 112.981 177.375 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.0 m -54.84 -32.76 60.92 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 124.676 1.19 . . . . 0.0 113.16 178.473 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 20.1 m80 -67.71 -43.82 79.15 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.225 -0.922 . . . . 0.0 111.182 177.874 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 59.2 tp -65.1 -44.37 89.04 Favored 'General case' 0 C--N 1.342 0.262 0 C-N-CA 123.587 0.755 . . . . 0.0 111.244 174.072 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 41.0 t -60.45 -45.56 96.64 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 124.173 0.989 . . . . 0.0 110.925 178.431 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -62.98 -47.33 83.63 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 123.469 0.708 . . . . 0.0 111.597 175.65 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.8 -41.9 97.81 Favored 'General case' 0 CA--C 1.542 0.649 0 O-C-N 121.391 -0.818 . . . . 0.0 112.326 179.439 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 30.8 tp -66.76 -37.61 84.96 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.176 0.99 . . . . 0.0 111.086 178.776 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 11.6 m-85 -65.91 -40.93 91.94 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 119.395 0.998 . . . . 0.0 112.45 169.523 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 65.1 mt -64.13 -41.14 97.33 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 119.178 0.899 . . . . 0.0 112.155 176.891 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 41.2 t -70.34 -44.14 77.75 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.954 0 C-N-CA 123.4 0.68 . . . . 0.0 112.468 175.31 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 9.5 t -80.52 -18.29 48.96 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 113.757 1.021 . . . . 0.0 113.757 -175.81 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 71.8 -149.65 45.08 Favored Glycine 0 CA--C 1.527 0.838 0 C-N-CA 125.495 1.521 . . . . 0.0 112.897 174.506 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -62.96 -22.04 66.52 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.21 1.404 . . . . 0.0 113.182 -175.993 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 88.3 mtm-85 -64.46 -33.66 76.39 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.021 0.929 . . . . 0.0 113.126 -179.553 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.29 141.47 0.87 Allowed Glycine 0 CA--C 1.531 1.065 0 C-N-CA 125.323 1.44 . . . . 0.0 112.071 -172.524 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 32.8 p90 -76.06 153.0 36.71 Favored 'General case' 0 CA--C 1.542 0.67 0 O-C-N 121.636 -0.92 . . . . 0.0 113.199 -178.11 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 78.3 t80 -84.97 -24.7 28.19 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.073 1.349 . . . . 0.0 112.641 -179.012 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 52.0 t80 -63.22 158.33 20.35 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 126.42 1.888 . . . . 0.0 115.085 -177.128 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 17.7 p -137.88 132.52 17.25 Favored Pre-proline 0 N--CA 1.471 0.615 0 C-N-CA 126.274 1.83 . . . . 0.0 108.765 168.315 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -79.57 162.33 24.71 Favored 'Trans proline' 0 N--CA 1.46 -0.483 0 C-N-CA 122.936 2.424 . . . . 0.0 111.948 -177.057 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . 0.404 ' H ' HG12 ' A' ' 3' ' ' VAL . 59.5 mtpt -57.21 -19.44 20.98 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 124.872 1.269 . . . . 0.0 114.41 179.956 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 67.7 p -80.27 -16.37 54.84 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 125.903 1.681 . . . . 0.0 113.297 177.251 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 44.1 mmtm -114.13 -25.99 8.26 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.914 1.285 . . . . 0.0 113.625 -179.393 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 72.0 mtp85 . . . . . 0 C--O 1.251 1.179 0 C-N-CA 125.277 1.431 . . . . 0.0 112.824 175.882 . . . . . . . . 0 0 . 1 . 035 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.681 0 N-CA-C 111.83 -0.508 . . . . 0.0 111.83 . . . . . . . . . 0 0 . 1 . 035 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . 0.411 ' HB ' ' CD2' ' A' ' 19' ' ' TYR . 7.7 tp -73.57 -30.2 28.98 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 N-CA-C 114.716 1.376 . . . . 0.0 114.716 -169.415 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 11.0 p -58.81 -57.1 12.65 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 N-CA-C 112.878 0.696 . . . . 0.0 112.878 -168.44 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 67.0 mt-10 -73.33 -30.23 63.2 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 119.854 1.206 . . . . 0.0 112.205 177.013 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 26.5 tt0 -62.59 -32.62 73.65 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.957 0.903 . . . . 0.0 112.114 -178.934 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 62.0 m -94.61 -27.05 16.11 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 114.505 1.298 . . . . 0.0 114.505 170.701 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 60.8 m -72.37 -64.81 0.87 Allowed 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 120.229 1.377 . . . . 0.0 112.181 178.99 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 40.4 p -87.8 -15.29 37.31 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.131 0.972 . . . . 0.0 113.538 -171.523 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 68.6 m -122.03 167.78 12.71 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.967 1.307 . . . . 0.0 111.72 171.86 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 72.3 mt -79.61 135.35 25.75 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 124.275 1.03 . . . . 0.0 109.352 173.753 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 11.9 p -130.69 163.83 26.37 Favored 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 113.905 1.076 . . . . 0.0 113.905 178.15 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 35.1 t -111.23 159.3 18.03 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.99 1.716 . . . . 0.0 112.346 179.726 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 53.6 mt -60.47 -27.97 67.96 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.81 0.844 . . . . 0.0 111.555 174.108 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 85.9 t80 -62.24 -30.56 71.19 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.283 1.033 . . . . 0.0 113.088 172.456 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 68.3 mt-30 -81.55 -31.06 32.85 Favored 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 123.548 0.739 . . . . 0.0 110.969 174.877 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 66.3 mt -63.74 -43.15 97.35 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 118.968 0.804 . . . . 0.0 111.494 169.657 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -55.98 -35.26 66.55 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.665 1.186 . . . . 0.0 113.526 175.025 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -60.31 -31.08 69.93 Favored 'General case' 0 CA--C 1.547 0.836 0 O-C-N 121.505 -0.747 . . . . 0.0 112.38 178.112 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.411 ' CD2' ' HB ' ' A' ' 2' ' ' ILE . 92.0 m-85 -103.39 10.11 37.52 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.762 1.225 . . . . 0.0 114.163 -177.721 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 76.0 m -73.46 150.74 41.41 Favored 'General case' 0 N--CA 1.468 0.452 0 O-C-N 121.462 -0.774 . . . . 0.0 110.977 167.89 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 21.9 t-20 . . . . . 0 C--O 1.254 1.318 0 C-N-CA 124.385 1.074 . . . . 0.0 113.132 176.336 . . . . . . . . 0 0 . 1 . 035 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 83.1 m-85 . . . . . 0 N--CA 1.487 1.376 0 CA-C-O 117.993 -1.003 . . . . 0.0 110.916 . . . . . . . . . 0 0 . 1 . 035 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 8.7 p -66.39 145.97 13.53 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.276 0 CA-C-N 120.576 1.534 . . . . 0.0 112.051 179.67 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 2.2 t30 58.57 63.8 1.61 Allowed 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 126.177 1.791 . . . . 0.0 111.311 175.874 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 -151.87 160.87 43.39 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.943 0.897 . . . . 0.0 111.83 -169.528 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 68.5 m-70 -76.59 138.14 39.95 Favored 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 164.824 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 66.3 mt -142.37 123.26 14.39 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 126.018 1.727 . . . . 0.0 108.759 177.484 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 5.6 t -141.36 149.92 41.77 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 121.36 -0.837 . . . . 0.0 112.729 -175.082 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.69 -128.42 44.86 Favored Glycine 0 N--CA 1.47 0.916 0 C-N-CA 124.261 0.934 . . . . 0.0 112.718 174.964 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.5 m -53.63 -37.98 63.61 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.681 1.192 . . . . 0.0 112.986 176.782 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 42.4 m-70 -70.59 -35.59 73.11 Favored 'General case' 0 CA--C 1.539 0.521 0 O-C-N 120.977 -1.077 . . . . 0.0 112.242 179.421 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 44.2 tp -67.62 -40.98 84.66 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 123.297 0.639 . . . . 0.0 111.28 171.724 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 25.5 t -59.52 -46.79 92.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 124.338 1.055 . . . . 0.0 111.266 172.789 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -61.19 -46.19 91.48 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 123.773 0.829 . . . . 0.0 111.567 175.077 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.06 -41.06 99.37 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 121.61 -0.681 . . . . 0.0 112.017 179.021 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 43.6 mt -65.92 -40.3 91.34 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 118.487 -0.768 . . . . 0.0 111.81 175.1 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 16.6 m-85 -61.57 -38.78 88.75 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 120.381 1.446 . . . . 0.0 112.765 171.41 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 76.4 mt -68.09 -44.54 76.01 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.801 0.84 . . . . 0.0 112.297 176.422 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 55.2 t -74.07 -45.68 47.57 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 C-N-CA 123.479 0.712 . . . . 0.0 112.232 -179.027 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 49.6 m -84.58 -26.59 27.86 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 113.786 1.032 . . . . 0.0 113.786 -173.789 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 71.81 -149.21 44.4 Favored Glycine 0 CA--C 1.531 1.076 0 C-N-CA 124.576 1.084 . . . . 0.0 112.092 -174.435 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -62.28 -19.82 63.64 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.116 1.366 . . . . 0.0 113.419 -178.815 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 62.7 mtm180 -58.79 -35.55 73.0 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.536 1.134 . . . . 0.0 113.21 178.495 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.68 -173.09 55.32 Favored Glycine 0 CA--C 1.53 1.011 0 C-N-CA 124.282 0.944 . . . . 0.0 113.199 -172.333 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 37.6 p90 -146.69 162.79 37.76 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 126.078 1.751 . . . . 0.0 112.571 -169.114 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 61.6 m-85 -89.95 -27.67 19.66 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 114.193 1.182 . . . . 0.0 114.193 -177.042 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 4.1 t80 57.03 31.46 19.95 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 125.059 1.344 . . . . 0.0 113.183 -179.633 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 38.4 m -47.17 123.12 8.16 Favored Pre-proline 0 CA--C 1.543 0.682 0 C-N-CA 126.276 1.83 . . . . 0.0 112.324 -168.959 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_exo -61.35 178.05 0.69 Allowed 'Trans proline' 0 C--N 1.352 0.714 0 C-N-CA 124.754 3.636 . . . . 0.0 115.292 179.216 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 17.3 ptmt -61.61 -15.95 43.94 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 114.956 1.465 . . . . 0.0 114.956 174.801 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 19.0 m -78.68 81.37 4.99 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 126.193 1.797 . . . . 0.0 109.972 -179.531 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 65.3 mttm 59.88 -140.7 0.62 Allowed 'General case' 0 CA--C 1.554 1.124 0 C-N-CA 125.846 1.658 . . . . 0.0 112.465 174.715 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 17.1 ptm180 . . . . . 0 C--O 1.252 1.216 0 C-N-CA 128.331 2.652 . . . . 0.0 111.685 175.744 . . . . . . . . 0 0 . 1 . 036 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.324 0 N-CA-C 110.205 -1.158 . . . . 0.0 110.205 . . . . . . . . . 0 0 . 1 . 036 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 19.1 tt -75.23 -33.32 28.05 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 CA-C-N 118.183 0.992 . . . . 0.0 112.44 174.513 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 72.2 t -56.31 -58.73 4.24 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 123.743 0.817 . . . . 0.0 111.878 -169.289 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -81.47 -20.47 40.18 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 -179.526 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 11.9 tp60 -69.2 -43.95 73.11 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 119.413 1.006 . . . . 0.0 111.338 177.268 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 46.8 m -67.23 -26.7 66.72 Favored 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 172.732 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 77.5 m -71.83 -56.54 5.55 Favored 'General case' 0 CA--C 1.543 0.675 0 O-C-N 121.016 -1.052 . . . . 0.0 111.193 172.985 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 46.6 p -75.16 -22.79 57.85 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 125.264 1.426 . . . . 0.0 113.98 -170.715 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 6.2 t -144.13 178.99 7.49 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 122.641 1.21 . . . . 0.0 112.411 175.586 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 17.6 mm -70.19 129.49 34.38 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.676 0 C-N-CA 125.439 1.496 . . . . 0.0 109.188 174.353 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 10.2 p -128.54 155.87 44.19 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.157 0.983 . . . . 0.0 112.448 174.576 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 75.3 p -103.84 164.04 11.95 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 114.946 1.462 . . . . 0.0 114.946 -169.741 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 10.5 mp -65.39 -27.56 68.65 Favored 'General case' 0 CA--C 1.539 0.551 0 O-C-N 121.185 -0.947 . . . . 0.0 111.651 172.09 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 89.6 t80 -64.52 -34.05 77.32 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 121.653 -0.654 . . . . 0.0 112.568 170.788 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 67.2 mt-30 -72.6 -39.52 67.25 Favored 'General case' 0 N--CA 1.47 0.543 0 O-C-N 121.62 -0.675 . . . . 0.0 111.289 171.581 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 94.5 mt -61.22 -43.73 98.41 Favored 'General case' 0 CA--C 1.545 0.757 0 CA-C-N 119.322 0.965 . . . . 0.0 111.727 174.089 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 40.0 mm-40 -55.5 -40.82 72.22 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 125.538 1.535 . . . . 0.0 112.806 171.551 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 17.0 t-20 -63.46 -23.02 67.22 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 113.419 0.896 . . . . 0.0 113.419 -177.965 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 64.2 m-85 -102.22 3.26 38.11 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 125.455 1.502 . . . . 0.0 114.194 176.785 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 85.2 m -66.64 146.77 54.12 Favored 'General case' 0 CA--C 1.544 0.732 0 O-C-N 121.235 -0.916 . . . . 0.0 110.402 167.934 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 . . . . . 0 C--O 1.255 1.386 0 C-N-CA 124.758 1.223 . . . . 0.0 113.083 -174.511 . . . . . . . . 0 0 . 1 . 036 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 72.1 m-85 . . . . . 0 N--CA 1.484 1.238 0 CA-C-O 119.39 -0.338 . . . . 0.0 110.725 . . . . . . . . . 0 0 . 1 . 036 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 13.4 p -84.36 115.97 27.3 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.012 0 C-N-CA 123.834 0.854 . . . . 0.0 111.08 -178.134 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -174.0 143.68 0.95 Allowed 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.566 1.546 . . . . 0.0 111.978 -171.956 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 29.3 mm-40 -154.58 169.27 24.24 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 125.503 1.521 . . . . 0.0 111.017 -174.307 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 51.5 m-70 -77.91 135.13 37.82 Favored 'General case' 0 CA--C 1.548 0.868 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 166.273 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 86.1 mt -140.54 124.75 17.57 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 125.404 1.482 . . . . 0.0 109.273 -179.485 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 5.2 t -142.21 142.41 32.65 Favored 'General case' 0 N--CA 1.469 0.494 0 O-C-N 121.485 -0.76 . . . . 0.0 112.84 -174.908 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 56.94 -126.61 42.42 Favored Glycine 0 CA--C 1.53 1.005 0 C-N-CA 124.598 1.094 . . . . 0.0 113.148 175.527 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 22.1 p -54.68 -38.07 66.52 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.411 1.085 . . . . 0.0 112.934 176.46 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 20.3 t-160 -68.95 -36.39 77.88 Favored 'General case' 0 CA--C 1.543 0.701 0 O-C-N 120.832 -1.168 . . . . 0.0 111.55 179.235 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 58.9 tp -67.99 -43.18 79.48 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 123.524 0.73 . . . . 0.0 111.361 172.083 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 28.8 t -59.26 -45.82 92.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 C-N-CA 124.31 1.044 . . . . 0.0 110.769 175.517 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -63.57 -44.05 95.23 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 118.621 0.646 . . . . 0.0 112.106 174.385 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.36 -41.71 94.24 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 119.254 0.934 . . . . 0.0 112.096 176.619 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 58.1 mt -63.58 -41.61 98.35 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 123.419 0.687 . . . . 0.0 111.749 174.546 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 14.0 m-85 -59.04 -45.94 89.49 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 119.761 1.164 . . . . 0.0 112.445 171.247 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 9.0 mp -67.55 -43.78 79.86 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.785 0.834 . . . . 0.0 112.35 -179.626 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 52.7 t -70.93 -49.37 50.44 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 CA-C-N 118.549 0.613 . . . . 0.0 111.456 -179.959 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 63.3 m -77.35 -33.23 55.43 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 113.371 0.878 . . . . 0.0 113.371 -174.189 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 65.36 -135.4 36.51 Favored Glycine 0 CA--C 1.529 0.907 0 C-N-CA 124.211 0.91 . . . . 0.0 111.781 178.573 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -64.09 -15.33 59.39 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 114.287 1.218 . . . . 0.0 114.287 -179.398 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 89.3 mtm180 -67.17 -36.6 82.14 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.896 0.878 . . . . 0.0 112.596 177.622 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.99 -177.41 50.23 Favored Glycine 0 CA--C 1.533 1.172 0 C-N-CA 124.391 0.996 . . . . 0.0 112.406 -169.657 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 46.5 p90 -159.85 174.45 14.43 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 125.058 1.343 . . . . 0.0 113.556 -172.039 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 27.9 t80 -142.89 125.03 15.35 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.189 0.996 . . . . 0.0 110.206 168.761 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 48.7 p90 -90.31 132.22 35.67 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 124.989 1.315 . . . . 0.0 112.096 -179.121 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 64.1 m -122.85 122.82 27.0 Favored Pre-proline 0 N--CA 1.479 0.996 0 C-N-CA 123.887 0.875 . . . . 0.0 111.648 -172.585 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_endo -91.46 177.56 1.89 Allowed 'Trans proline' 0 CA--C 1.539 0.767 0 C-N-CA 125.126 3.884 . . . . 0.0 112.263 172.959 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -62.42 -28.24 69.66 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 126.08 1.752 . . . . 0.0 113.805 174.896 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 22.8 p -72.13 -14.58 61.87 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 125.371 1.469 . . . . 0.0 112.828 172.934 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 30.8 ttpt 78.09 157.58 0.18 Allowed 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 128.103 2.561 . . . . 0.0 113.967 169.473 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 74.3 ttt180 . . . . . 0 C--O 1.254 1.313 0 C-N-CA 126.012 1.725 . . . . 0.0 112.007 175.311 . . . . . . . . 0 0 . 1 . 037 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.673 0 N-CA-C 112.526 -0.229 . . . . 0.0 112.526 . . . . . . . . . 0 0 . 1 . 037 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 19.1 tt -61.64 -26.97 41.15 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.082 0 O-C-N 121.457 -1.025 . . . . 0.0 113.629 -174.223 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 55.9 t -57.54 -29.38 33.84 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 172.805 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -89.96 -35.48 15.54 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 118.978 0.808 . . . . 0.0 112.463 169.656 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -69.27 -41.21 77.18 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 121.84 -0.538 . . . . 0.0 112.299 -171.93 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.3 m -74.75 -21.98 59.04 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 113.118 0.784 . . . . 0.0 113.118 172.174 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 17.1 t -89.38 -46.81 8.45 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.427 0.691 . . . . 0.0 112.489 -171.585 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 85.7 m -82.72 -44.35 15.74 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 125.393 1.477 . . . . 0.0 111.326 178.039 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 68.8 m -106.09 172.95 6.53 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 124.4 1.08 . . . . 0.0 111.813 177.53 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 22.6 mm -73.91 144.55 12.41 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 O-C-N 120.89 -1.131 . . . . 0.0 110.108 171.285 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 11.8 p -134.9 -177.03 4.44 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 113.751 1.019 . . . . 0.0 113.751 170.601 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 79.3 p -147.76 164.58 33.17 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 125.382 1.473 . . . . 0.0 112.5 -169.172 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 10.9 mp -61.89 -29.33 70.13 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 121.416 -0.803 . . . . 0.0 112.423 -177.416 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 90.3 t80 -63.01 -37.0 85.45 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 123.44 0.696 . . . . 0.0 112.483 172.773 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 58.6 mt-30 -74.9 -36.56 62.23 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 123.786 0.835 . . . . 0.0 111.052 175.461 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 94.9 mt -61.83 -48.48 80.38 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 118.728 0.695 . . . . 0.0 111.279 172.97 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 19.6 mm-40 -60.97 -34.56 74.95 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.208 1.003 . . . . 0.0 113.268 176.691 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 17.0 t30 -57.76 -28.01 63.56 Favored 'General case' 0 CA--C 1.547 0.85 0 O-C-N 121.013 -1.054 . . . . 0.0 113.028 178.209 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 71.0 m-85 -103.08 6.89 38.88 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.183 1.393 . . . . 0.0 113.906 177.445 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 98.9 m -92.27 160.64 15.05 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.134 0.974 . . . . 0.0 112.994 171.12 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 . . . . . 0 C--O 1.253 1.267 0 N-CA-C 113.55 0.944 . . . . 0.0 113.55 -173.078 . . . . . . . . 0 0 . 1 . 037 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 62.5 t80 . . . . . 0 N--CA 1.488 1.456 0 N-CA-C 110.175 -0.305 . . . . 0.0 110.175 . . . . . . . . . 0 0 . 1 . 037 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 9.4 p -66.23 145.99 13.52 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.2 0 O-C-N 121.344 -0.847 . . . . 0.0 111.891 179.119 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 1.9 t30 61.33 58.63 2.11 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.186 1.394 . . . . 0.0 111.288 177.091 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -150.43 164.17 36.57 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.022 1.329 . . . . 0.0 110.473 -176.088 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 97.7 m-70 -80.08 145.54 32.38 Favored 'General case' 0 CA--C 1.549 0.908 0 O-C-N 121.224 -0.923 . . . . 0.0 111.044 170.658 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 80.8 mt -142.57 139.71 31.47 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.988 1.715 . . . . 0.0 110.069 173.78 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.0 t -151.65 145.77 25.32 Favored 'General case' 0 N--CA 1.471 0.604 0 O-C-N 121.316 -0.865 . . . . 0.0 112.056 -177.345 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 54.42 -124.22 30.5 Favored Glycine 0 CA--C 1.529 0.964 0 C-N-CA 124.549 1.071 . . . . 0.0 113.385 172.829 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 71.8 p -55.09 -35.61 64.77 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 124.892 1.277 . . . . 0.0 113.463 177.458 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 4.2 m80 -75.52 -37.18 60.25 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 121.503 -0.748 . . . . 0.0 111.112 -179.078 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 54.3 tp -64.98 -45.38 85.9 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 123.437 0.695 . . . . 0.0 111.308 171.573 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 22.2 t -59.37 -46.81 92.28 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.913 0 C-N-CA 124.747 1.219 . . . . 0.0 111.275 175.555 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -63.61 -43.52 96.63 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.315 0.646 . . . . 0.0 111.767 177.105 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.17 -44.35 96.81 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.35 0.66 . . . . 0.0 111.837 176.65 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 44.4 mt -58.76 -43.66 90.41 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 123.024 0.53 . . . . 0.0 111.635 175.808 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 20.4 m-85 -63.95 -43.68 95.1 Favored 'General case' 0 CA--C 1.544 0.717 0 O-C-N 121.343 -0.848 . . . . 0.0 112.629 174.2 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 76.5 mt -67.44 -41.28 85.0 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 123.674 0.79 . . . . 0.0 112.641 179.589 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 61.6 t -73.55 -46.96 46.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 124.359 1.064 . . . . 0.0 111.58 -178.159 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 58.8 m -98.9 -16.47 18.8 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 115.389 1.626 . . . . 0.0 115.389 -169.312 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 73.97 -148.5 39.73 Favored Glycine 0 CA--C 1.531 1.061 0 C-N-CA 124.309 0.957 . . . . 0.0 113.431 177.896 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 2.9 pm0 -67.02 -11.42 56.99 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.633 1.573 . . . . 0.0 114.541 -176.35 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 40.2 mtp180 -57.71 -36.03 71.45 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 125.02 1.328 . . . . 0.0 112.789 172.359 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.5 175.48 30.77 Favored Glycine 0 CA--C 1.529 0.928 0 C-N-CA 124.288 0.947 . . . . 0.0 113.663 -176.935 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 37.6 p90 -120.52 153.45 36.67 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.967 1.307 . . . . 0.0 113.064 -176.801 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 57.1 m-85 -127.59 38.55 4.03 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 127.74 2.416 . . . . 0.0 109.327 -179.119 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.84 151.1 43.27 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.899 1.68 . . . . 0.0 115.348 -170.405 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 18.9 p -97.86 134.79 21.92 Favored Pre-proline 0 N--CA 1.473 0.7 0 C-N-CA 124.72 1.208 . . . . 0.0 111.76 -175.215 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -76.55 173.84 13.82 Favored 'Trans proline' 0 C--N 1.351 0.68 0 C-N-CA 124.442 3.428 . . . . 0.0 112.17 -175.093 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -73.76 -38.05 64.84 Favored 'General case' 0 CA--C 1.546 0.794 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 173.619 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 18.8 m -155.78 -66.9 0.12 Allowed 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 125.211 1.404 . . . . 0.0 111.366 -169.21 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 32.1 mmmt -83.19 154.97 23.98 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.333 1.053 . . . . 0.0 113.12 -172.329 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.19 0 C-N-CA 126.777 2.031 . . . . 0.0 111.55 179.638 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.648 0 N-CA-C 112.337 -0.305 . . . . 0.0 112.337 . . . . . . . . . 0 0 . 1 . 038 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 10.8 tp -58.92 -34.17 51.88 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.389 0 O-C-N 121.249 -1.148 . . . . 0.0 113.951 -170.939 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 6.4 t -70.11 -21.11 23.49 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.276 0 C-N-CA 124.593 1.157 . . . . 0.0 112.682 -179.819 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -86.98 -48.03 8.46 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 123.784 0.834 . . . . 0.0 109.227 167.789 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 33.5 tt0 -65.33 -43.47 90.82 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 124.968 1.307 . . . . 0.0 113.87 -167.569 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 67.2 m -73.83 -12.7 60.76 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 113.545 0.942 . . . . 0.0 113.545 173.959 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 15.1 t -104.66 -43.55 5.1 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.955 1.302 . . . . 0.0 113.353 -168.863 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 81.5 p -85.84 -28.36 24.5 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 124.951 1.3 . . . . 0.0 112.279 175.328 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 5.5 t -126.39 -169.55 2.04 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.319 1.447 . . . . 0.0 111.035 170.107 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 6.5 tt -98.37 147.73 6.56 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.513 0 C-N-CA 125.08 1.352 . . . . 0.0 110.719 177.353 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 17.5 p -133.63 150.36 51.58 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 113.889 1.07 . . . . 0.0 113.889 -178.698 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 34.2 t -91.59 160.92 15.15 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 125.826 1.65 . . . . 0.0 112.276 178.195 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 10.0 mp -59.09 -29.18 67.16 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.357 1.063 . . . . 0.0 111.54 171.303 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 94.6 t80 -60.99 -37.72 83.47 Favored 'General case' 0 CA--C 1.54 0.56 0 O-C-N 121.55 -0.719 . . . . 0.0 112.786 171.546 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 37.0 mt-30 -74.73 -38.33 62.3 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 123.413 0.685 . . . . 0.0 110.45 177.618 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 95.5 mt -60.71 -43.77 97.4 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 123.467 0.707 . . . . 0.0 111.795 173.579 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -68.63 -35.28 77.09 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 113.518 0.932 . . . . 0.0 113.518 173.314 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -63.68 -32.18 73.58 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-N 119.535 1.061 . . . . 0.0 113.105 -177.627 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 41.4 m-85 -86.61 -1.97 58.11 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 124.786 1.234 . . . . 0.0 113.89 172.491 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 6.5 t -86.95 172.44 10.03 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 124.27 1.028 . . . . 0.0 112.542 171.47 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 19.8 m120 . . . . . 0 C--O 1.253 1.265 0 C-N-CA 125.68 1.592 . . . . 0.0 112.878 176.564 . . . . . . . . 0 0 . 1 . 038 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 65.2 m-85 . . . . . 0 N--CA 1.489 1.51 0 N-CA-C 111.343 0.127 . . . . 0.0 111.343 . . . . . . . . . 0 0 . 1 . 038 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 32.6 m -76.13 -6.11 8.32 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.388 0 C-N-CA 124.65 1.18 . . . . 0.0 114.08 -179.829 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 4.0 m120 -63.37 146.37 53.67 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.739 1.216 . . . . 0.0 113.036 -174.399 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 44.2 mt-30 -142.4 157.92 44.26 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.159 1.384 . . . . 0.0 111.868 -177.833 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 84.9 m-70 -95.03 126.47 40.39 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 108.166 -1.05 . . . . 0.0 108.166 167.197 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 54.5 mt -144.58 138.68 27.63 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 125.137 1.375 . . . . 0.0 109.862 -172.395 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 1.8 t -154.99 151.99 29.13 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 123.358 0.663 . . . . 0.0 111.664 -179.169 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 57.69 -133.11 52.8 Favored Glycine 0 CA--C 1.532 1.106 0 C-N-CA 124.336 0.969 . . . . 0.0 113.434 175.303 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 23.3 p -54.22 -43.22 70.62 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.734 1.214 . . . . 0.0 112.968 179.03 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 15.7 m-70 -67.15 -32.37 73.42 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 120.848 -1.157 . . . . 0.0 112.912 179.446 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 57.4 tp -68.91 -41.88 77.61 Favored 'General case' 0 N--CA 1.468 0.438 0 O-C-N 121.742 -0.599 . . . . 0.0 111.473 170.343 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 55.6 t -60.39 -44.59 96.4 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 CA-C-N 118.813 0.733 . . . . 0.0 110.864 175.457 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -58.4 -50.67 72.83 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 123.879 0.872 . . . . 0.0 111.354 172.049 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.91 -42.36 99.76 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.705 0.802 . . . . 0.0 112.432 -177.677 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 60.5 mt -57.73 -45.5 85.71 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 119.035 0.834 . . . . 0.0 111.087 175.399 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 25.8 m-85 -66.96 -41.0 87.65 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 118.868 0.758 . . . . 0.0 112.763 176.152 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 75.8 mt -67.42 -43.99 79.84 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 123.808 0.843 . . . . 0.0 112.417 178.793 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 67.7 t -76.68 -38.83 31.06 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 124.417 1.087 . . . . 0.0 111.749 -175.923 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 28.8 t -80.86 -26.22 37.1 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 113.266 0.839 . . . . 0.0 113.266 178.665 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 79.2 -153.85 38.12 Favored Glycine 0 CA--C 1.528 0.881 0 C-N-CA 124.731 1.158 . . . . 0.0 112.78 179.311 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -61.35 -14.29 26.23 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 115.196 1.554 . . . . 0.0 115.196 -174.228 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 49.8 mtp180 -54.22 -48.64 70.85 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 125.159 1.384 . . . . 0.0 112.24 171.192 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.74 145.85 0.9 Allowed Glycine 0 CA--C 1.533 1.21 0 C-N-CA 125.217 1.389 . . . . 0.0 112.604 -174.881 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 14.9 p90 -98.08 166.48 11.4 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 123.924 0.89 . . . . 0.0 112.2 175.797 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 69.9 t80 -151.87 119.36 6.03 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.356 1.462 . . . . 0.0 109.295 170.314 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 54.7 t80 -161.53 148.06 14.27 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 124.142 0.977 . . . . 0.0 112.39 -172.519 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 38.2 m -86.2 117.19 68.28 Favored Pre-proline 0 N--CA 1.474 0.733 0 C-N-CA 125.191 1.397 . . . . 0.0 109.639 178.103 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -74.63 165.58 31.26 Favored 'Trans proline' 0 CA--C 1.537 0.645 0 C-N-CA 123.375 2.717 . . . . 0.0 111.869 -176.84 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 64.4 pttt -59.49 -27.99 66.63 Favored 'General case' 0 N--CA 1.477 0.894 0 N-CA-C 114.23 1.196 . . . . 0.0 114.23 -176.597 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 58.5 m -92.02 88.59 6.62 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 105.545 -2.02 . . . . 0.0 105.545 168.392 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 15.4 ttpp -53.18 127.71 25.28 Favored 'General case' 0 CA--C 1.548 0.888 0 N-CA-C 114.291 1.219 . . . . 0.0 114.291 -167.604 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 34.9 ptt180 . . . . . 0 C--O 1.253 1.271 0 C-N-CA 125.827 1.651 . . . . 0.0 113.07 170.06 . . . . . . . . 0 0 . 1 . 039 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.685 0 N-CA-C 110.816 -0.913 . . . . 0.0 110.816 . . . . . . . . . 0 0 . 1 . 039 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 8.5 tp -46.67 -42.27 5.51 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.269 0 N-CA-C 116.257 1.947 . . . . 0.0 116.257 -166.972 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 67.6 t -68.71 -43.49 82.99 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 CA-C-N 118.619 0.645 . . . . 0.0 112.253 -171.896 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -75.45 -38.22 59.82 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 118.109 0.413 . . . . 0.0 111.505 170.372 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 52.3 tt0 -67.24 -43.53 81.73 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 125.129 1.372 . . . . 0.0 113.587 -171.058 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 41.6 m -70.04 -20.4 63.25 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 173.166 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 23.1 t -99.36 -38.2 8.93 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 118.929 0.786 . . . . 0.0 112.592 -171.972 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 67.5 p -86.74 -20.46 27.64 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 125.496 1.518 . . . . 0.0 113.416 176.412 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.5 t -138.88 -170.68 2.91 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.238 1.415 . . . . 0.0 110.725 174.361 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 78.0 mt -91.58 135.31 27.38 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 C-N-CA 124.884 1.273 . . . . 0.0 108.987 176.229 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 15.2 p -121.97 -176.11 3.26 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.217 1.007 . . . . 0.0 112.016 172.189 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 95.7 p -143.48 165.39 27.68 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 125.046 1.339 . . . . 0.0 112.294 -172.671 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 43.0 mt -58.17 -33.23 69.01 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.238 0.615 . . . . 0.0 112.106 177.731 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 71.9 t80 -65.75 -28.94 69.4 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.139 0.976 . . . . 0.0 113.23 174.25 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 54.2 mt-30 -80.1 -32.7 39.15 Favored 'General case' 0 CA--C 1.538 0.483 0 O-C-N 121.509 -0.744 . . . . 0.0 111.321 173.175 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 91.0 mt -65.94 -44.32 85.43 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 118.888 0.767 . . . . 0.0 111.495 171.763 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.0 mm-40 -52.14 -38.04 56.31 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 125.661 1.584 . . . . 0.0 112.959 172.648 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.9 t30 -62.05 -24.38 67.05 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 113.373 0.879 . . . . 0.0 113.373 -178.64 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 79.0 m-85 -105.6 12.63 30.99 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.441 1.496 . . . . 0.0 113.929 179.456 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 78.3 m -82.14 164.58 21.2 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 123.855 0.862 . . . . 0.0 110.722 167.201 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 13.8 m120 . . . . . 0 C--O 1.254 1.295 0 CA-C-O 118.243 -0.884 . . . . 0.0 112.432 170.917 . . . . . . . . 0 0 . 1 . 039 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 47.9 t80 . . . . . 0 N--CA 1.486 1.351 0 CA-C-O 119.705 -0.188 . . . . 0.0 110.612 . . . . . . . . . 0 0 . 1 . 039 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 27.6 m -64.35 -24.4 35.58 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 N-CA-C 114.513 1.301 . . . . 0.0 114.513 -173.147 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 16.8 m120 -128.19 127.74 43.49 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 126.167 1.787 . . . . 0.0 109.095 169.825 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 3.3 tt0 -169.92 166.35 9.43 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 119.139 0.881 . . . . 0.0 112.948 -170.283 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 99.4 m-70 -85.97 142.74 28.58 Favored 'General case' 0 CA--C 1.549 0.931 0 N-CA-C 108.412 -0.959 . . . . 0.0 108.412 164.198 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 75.9 mt -145.73 126.75 14.6 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 126.092 1.757 . . . . 0.0 109.477 176.098 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 92.4 m -124.92 146.04 49.54 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 125.135 1.374 . . . . 0.0 111.253 179.474 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 45.95 -122.11 5.71 Favored Glycine 0 N--CA 1.473 1.127 0 C-N-CA 125.314 1.435 . . . . 0.0 115.021 168.568 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 67.8 p -52.42 -40.11 61.78 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 125.034 1.334 . . . . 0.0 113.301 -179.931 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 2.2 m80 -70.84 -37.92 73.18 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.217 -0.927 . . . . 0.0 111.019 -177.933 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 60.6 tp -66.11 -45.0 82.66 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.346 0.658 . . . . 0.0 111.49 171.915 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 53.2 t -61.54 -43.42 96.89 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 C-N-CA 123.802 0.841 . . . . 0.0 110.99 178.766 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -65.58 -41.66 92.64 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 118.767 0.712 . . . . 0.0 112.332 173.016 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.76 -41.79 96.14 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 119.667 1.122 . . . . 0.0 112.111 174.938 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 54.8 mt -61.21 -44.24 97.6 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 123.524 0.729 . . . . 0.0 111.317 173.627 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 13.9 m-30 -58.86 -43.41 90.84 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 119.495 1.043 . . . . 0.0 112.025 175.138 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 8.3 mp -67.46 -45.45 75.94 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 124.083 0.953 . . . . 0.0 112.427 177.28 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 45.5 t -69.4 -48.71 65.62 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 C-N-CA 123.351 0.661 . . . . 0.0 111.637 -178.506 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 62.6 m -70.6 -39.0 74.06 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 118.53 0.605 . . . . 0.0 112.281 -176.936 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.58 -137.76 42.38 Favored Glycine 0 CA--C 1.527 0.815 0 C-N-CA 124.281 0.944 . . . . 0.0 112.347 176.863 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -63.94 -15.84 60.09 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 114.549 1.314 . . . . 0.0 114.549 -177.861 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 91.6 mtm180 -67.1 -35.13 79.13 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 123.818 0.847 . . . . 0.0 112.727 175.994 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 94.44 154.2 30.8 Favored Glycine 0 CA--C 1.533 1.212 0 C-N-CA 125.34 1.448 . . . . 0.0 113.322 -172.401 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 53.7 p90 -93.41 153.84 18.28 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 125.946 1.698 . . . . 0.0 111.326 176.962 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 20.4 t80 -144.06 21.12 1.76 Allowed 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 124.302 1.041 . . . . 0.0 112.953 -173.483 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 17.3 p90 -65.89 147.25 53.66 Favored 'General case' 0 CA--C 1.55 0.951 0 O-C-N 120.715 -1.241 . . . . 0.0 113.181 178.067 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' B' B ' 27' ' ' THR . . . . . 0.491 ' H ' ' CD ' ' B' ' 28' ' ' PRO . 74.3 p -139.81 -26.98 0.01 OUTLIER Pre-proline 0 N--CA 1.479 1.009 0 CA-C-O 115.532 -2.175 . . . . 0.0 116.105 178.436 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . 0.491 ' CD ' ' H ' ' B' ' 27' ' ' THR . 94.5 Cg_exo -54.72 144.61 64.41 Favored 'Trans proline' 0 C--N 1.361 1.201 0 C-N-CA 122.969 2.446 . . . . 0.0 114.277 -177.207 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 58.0 tttt 53.16 2.22 0.02 OUTLIER 'General case' 0 CA--C 1.557 1.235 0 C-N-CA 127.818 2.447 . . . . 0.0 116.509 178.992 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 20.0 p -127.28 -57.88 1.29 Allowed 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 125.753 1.621 . . . . 0.0 111.411 -171.92 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 29.4 mtpp -105.05 -25.03 12.7 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 124.955 1.302 . . . . 0.0 112.927 179.362 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.134 0 C-N-CA 125.846 1.658 . . . . 0.0 113.147 176.488 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.709 0 N-CA-C 111.92 -0.472 . . . . 0.0 111.92 . . . . . . . . . 0 0 . 1 . 040 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 10.3 tp -80.09 -44.04 22.5 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.109 0 N-CA-C 113.997 1.11 . . . . 0.0 113.997 -172.387 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 9.9 p -64.82 -34.49 70.59 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.295 0 CA-C-N 119.54 1.064 . . . . 0.0 112.587 -176.338 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 26.6 pt-20 -71.57 -3.69 22.82 Favored 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 113.95 1.092 . . . . 0.0 113.95 174.472 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 53.6 tp60 -104.05 -58.62 1.85 Allowed 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.165 0.986 . . . . 0.0 109.042 167.906 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 58.9 m -68.99 -25.99 64.79 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 114.701 1.371 . . . . 0.0 114.701 -169.524 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 11.7 t -80.85 -39.89 25.76 Favored 'General case' 0 N--CA 1.472 0.631 0 O-C-N 121.57 -0.706 . . . . 0.0 112.22 -175.744 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 24.5 p -95.1 -31.09 13.72 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 126.238 1.815 . . . . 0.0 112.686 -177.498 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 10.7 t -129.35 -169.75 2.16 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.975 1.71 . . . . 0.0 110.761 178.27 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 33.2 mm -87.92 146.71 5.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 C-N-CA 125.049 1.34 . . . . 0.0 111.273 -174.381 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 4.1 m -124.27 159.23 30.69 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 122.637 1.208 . . . . 0.0 114.006 170.742 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 17.7 t -130.78 157.23 43.4 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 127.598 2.359 . . . . 0.0 110.533 173.884 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 17.5 mt -59.7 -26.05 65.28 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 114.284 1.216 . . . . 0.0 114.284 -169.552 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 92.7 t80 -59.8 -33.69 72.06 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 121.548 -0.72 . . . . 0.0 112.572 173.227 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 68.3 mt-30 -78.88 -32.48 45.91 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.768 1.227 . . . . 0.0 111.122 179.376 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -63.02 -50.48 70.51 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.755 0.822 . . . . 0.0 109.681 170.489 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -60.33 -33.54 72.54 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 113.499 0.925 . . . . 0.0 113.499 178.308 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 19.1 t-20 -61.16 -24.0 65.97 Favored 'General case' 0 CA--C 1.548 0.889 0 N-CA-C 114.146 1.165 . . . . 0.0 114.146 -177.577 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 58.7 m-85 -106.73 3.84 27.06 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.612 1.565 . . . . 0.0 114.132 179.081 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 89.4 m -84.34 165.75 17.99 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.112 0.965 . . . . 0.0 113.422 173.652 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.252 1.228 0 C-N-CA 125.28 1.432 . . . . 0.0 110.731 -176.342 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 78.4 t80 . . . . . 0 N--CA 1.489 1.495 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 . . . . . . . . . 0 0 . 1 . 040 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 14.3 p -67.93 131.04 33.48 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.246 0 CA-C-N 119.085 0.857 . . . . 0.0 111.796 -176.294 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 19.1 t30 -166.83 102.15 0.56 Allowed 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.142 1.777 . . . . 0.0 108.143 -169.843 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -163.78 167.05 21.39 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 123.483 0.713 . . . . 0.0 111.664 -166.545 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 96.2 m-70 -70.79 146.18 49.91 Favored 'General case' 0 CA--C 1.549 0.916 0 O-C-N 121.06 -1.025 . . . . 0.0 111.489 168.918 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 74.5 mt -145.2 134.27 22.67 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 125.768 1.627 . . . . 0.0 109.848 174.113 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 5.5 t -148.08 153.11 38.47 Favored 'General case' 0 N--CA 1.47 0.553 0 O-C-N 121.198 -0.938 . . . . 0.0 112.76 179.366 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 54.18 -128.18 40.54 Favored Glycine 0 N--CA 1.471 0.99 0 C-N-CA 124.635 1.112 . . . . 0.0 113.54 172.68 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 76.4 p -53.13 -37.08 61.49 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 125.036 1.335 . . . . 0.0 113.065 177.436 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 5.3 m80 -74.88 -36.41 62.27 Favored 'General case' 0 CA--C 1.54 0.581 0 O-C-N 121.486 -0.759 . . . . 0.0 111.24 -178.851 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 56.1 tp -67.61 -43.99 79.11 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 123.304 0.642 . . . . 0.0 111.48 172.646 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 46.8 t -59.85 -46.65 93.54 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 C-N-CA 124.351 1.06 . . . . 0.0 110.659 175.437 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -63.3 -42.97 99.08 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.154 0.582 . . . . 0.0 111.462 175.561 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.15 -42.13 98.0 Favored 'General case' 0 CA--C 1.536 0.415 0 O-C-N 121.255 -0.903 . . . . 0.0 112.166 176.999 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 43.5 mt -59.08 -42.67 90.97 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 118.796 0.725 . . . . 0.0 111.219 175.736 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 36.9 m-85 -68.64 -37.4 79.66 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 113.554 0.946 . . . . 0.0 113.554 173.796 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 65.2 mt -67.77 -42.75 81.24 Favored 'General case' 0 N--CA 1.473 0.715 0 O-C-N 121.066 -1.021 . . . . 0.0 112.178 176.663 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 74.6 t -72.26 -48.92 46.3 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 124.484 1.114 . . . . 0.0 111.27 -179.271 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 61.9 m -97.82 -7.99 29.33 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 114.702 1.371 . . . . 0.0 114.702 -169.777 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 83.37 -161.32 38.99 Favored Glycine 0 N--CA 1.469 0.864 0 C-N-CA 125.451 1.501 . . . . 0.0 113.179 179.627 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 2.9 pm0 -63.92 -12.39 36.67 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.445 1.498 . . . . 0.0 114.167 -178.879 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 57.8 mtm180 -57.4 -38.16 73.84 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 124.923 1.289 . . . . 0.0 112.675 171.607 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 69.83 -150.47 49.27 Favored Glycine 0 CA--C 1.532 1.095 0 C-N-CA 124.171 0.891 . . . . 0.0 112.326 -172.302 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 53.5 p90 -141.42 155.81 45.84 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.988 1.315 . . . . 0.0 113.226 -170.206 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 74.2 t80 -90.03 -25.71 20.68 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.649 1.18 . . . . 0.0 113.12 -175.989 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 63.2 t80 -65.71 148.77 51.22 Favored 'General case' 0 CA--C 1.543 0.676 0 N-CA-C 114.765 1.395 . . . . 0.0 114.765 -173.034 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 20.8 p -115.66 114.92 42.0 Favored Pre-proline 0 N--CA 1.476 0.85 0 C-N-CA 126.042 1.737 . . . . 0.0 109.511 171.962 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -57.25 136.25 75.18 Favored 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 123.632 2.888 . . . . 0.0 112.719 178.279 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 19.9 ptmt -66.37 -15.7 63.49 Favored 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 114.004 1.112 . . . . 0.0 114.004 -178.478 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 22.8 p -81.58 -32.47 32.09 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 127.216 2.207 . . . . 0.0 112.238 172.614 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 16.5 tppt? -90.59 -37.89 13.51 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.267 1.427 . . . . 0.0 113.232 -178.241 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 76.6 ttt-85 . . . . . 0 C--O 1.252 1.198 0 C-N-CA 126.106 1.762 . . . . 0.0 112.445 -179.196 . . . . . . . . 0 0 . 1 . 041 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.555 0 N-CA-C 111.532 -0.627 . . . . 0.0 111.532 . . . . . . . . . 0 0 . 1 . 041 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 18.1 tt -54.93 -33.91 29.88 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.074 0 C-N-CA 125.434 1.493 . . . . 0.0 114.675 -170.171 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . 0.421 HG12 ' H ' ' B' ' 29' ' ' LYS . 4.9 p -61.68 -26.91 41.02 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 C-N-CA 123.747 0.819 . . . . 0.0 112.411 178.827 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -73.0 -5.08 36.43 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.17 0.988 . . . . 0.0 112.649 177.099 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 24.2 tt0 -113.78 -56.64 2.38 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.265 1.026 . . . . 0.0 110.06 170.441 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 12.4 m -67.36 -24.1 65.67 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 115.393 1.627 . . . . 0.0 115.393 -173.361 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 34.5 t -91.73 -47.95 7.08 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 119.608 1.095 . . . . 0.0 112.214 -178.977 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 5.3 t -71.19 -29.95 65.8 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.429 1.092 . . . . 0.0 113.131 -178.946 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.2 t -131.76 -173.36 3.11 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.855 1.262 . . . . 0.0 111.231 175.758 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 61.8 mt -84.03 140.56 15.98 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 C-N-CA 124.639 1.176 . . . . 0.0 109.885 177.209 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 12.9 p -136.38 154.89 50.68 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 122.207 1.003 . . . . 0.0 113.165 170.136 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 8.4 t -119.04 173.09 7.11 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 126.047 1.739 . . . . 0.0 111.776 178.823 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 62.9 mt -56.46 -33.81 66.28 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.255 1.422 . . . . 0.0 112.946 -171.13 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 90.5 t80 -60.89 -34.61 74.9 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 123.817 0.847 . . . . 0.0 112.784 175.121 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -79.09 -28.84 43.08 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 124.527 1.131 . . . . 0.0 111.036 177.927 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 58.8 mt -67.29 -50.16 61.43 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 123.356 0.662 . . . . 0.0 110.404 170.466 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -63.9 -27.04 68.88 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.067 0.947 . . . . 0.0 113.147 178.129 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 17.6 t30 -61.35 -35.23 76.87 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 124.319 1.048 . . . . 0.0 113.292 -179.376 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 26.0 m-85 -81.21 -24.64 37.31 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 113.652 0.982 . . . . 0.0 113.652 177.479 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 69.2 m -71.83 149.34 45.33 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.051 1.34 . . . . 0.0 112.502 -178.689 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.251 1.165 0 C-N-CA 128.112 2.565 . . . . 0.0 112.439 -172.309 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 80.2 m-85 . . . . . 0 N--CA 1.487 1.4 0 CA-C-O 119.599 -0.238 . . . . 0.0 111.142 . . . . . . . . . 0 0 . 1 . 041 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 22.7 t 86.82 -58.6 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.287 0 C-N-CA 129.077 2.951 . . . . 0.0 110.264 177.064 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 16.1 p-10 -86.03 104.06 15.29 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 123.317 0.647 . . . . 0.0 109.402 168.828 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -146.06 171.08 15.42 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.136 1.374 . . . . 0.0 111.412 -169.099 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 48.2 m-70 -80.82 138.64 36.23 Favored 'General case' 0 CA--C 1.549 0.912 0 O-C-N 121.044 -1.035 . . . . 0.0 108.923 167.113 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 30.8 mt -138.9 135.61 34.63 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 125.778 1.631 . . . . 0.0 109.335 175.305 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 1.8 t -141.63 148.82 39.8 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 -174.65 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 53.95 -135.37 43.2 Favored Glycine 0 N--CA 1.47 0.94 0 C-N-CA 124.765 1.174 . . . . 0.0 114.127 169.94 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 5.6 m -59.12 -26.3 64.58 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 177.008 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -70.24 -36.89 74.79 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 120.239 1.381 . . . . 0.0 111.77 174.123 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 53.1 tp -70.33 -42.11 72.34 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.058 0.943 . . . . 0.0 111.675 172.763 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 78.2 t -60.65 -42.52 92.13 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.888 0 C-N-CA 123.096 0.558 . . . . 0.0 110.628 174.381 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -67.77 -39.17 84.16 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.855 0.862 . . . . 0.0 112.301 175.239 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -57.96 -42.27 84.66 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 121.359 -0.838 . . . . 0.0 111.234 171.633 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 6.7 mp -65.36 -39.07 91.87 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 118.815 0.734 . . . . 0.0 112.137 173.787 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 22.0 m-30 -59.66 -39.91 86.02 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-N 119.71 1.141 . . . . 0.0 112.08 174.372 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 88.4 mt -74.34 -51.27 15.63 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.58 1.152 . . . . 0.0 111.961 178.145 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 76.2 t -75.79 -37.07 34.71 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 C-N-CA 124.221 1.008 . . . . 0.0 112.133 -171.43 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 72.2 m -105.89 19.41 20.58 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.496 1.119 . . . . 0.0 113.695 -176.2 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -58.06 -29.05 61.88 Favored Glycine 0 CA--C 1.535 1.296 0 CA-C-N 119.149 0.886 . . . . 0.0 113.97 -179.268 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -94.38 -33.36 13.19 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.93 1.292 . . . . 0.0 112.979 172.475 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 35.6 mmt180 -68.93 -28.62 66.82 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 124.156 0.982 . . . . 0.0 113.284 178.948 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 86.08 107.25 0.75 Allowed Glycine 0 CA--C 1.529 0.957 0 N-CA-C 108.81 -1.716 . . . . 0.0 108.81 -167.293 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 13.4 p90 -74.23 152.92 39.64 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 -177.466 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 86.6 t80 -151.34 80.12 1.3 Allowed 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 125.142 1.377 . . . . 0.0 108.702 177.452 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 43.4 p90 -79.89 141.69 35.88 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.285 1.434 . . . . 0.0 112.859 -176.443 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 27.9 p -134.61 66.87 70.69 Favored Pre-proline 0 N--CA 1.477 0.9 0 C-N-CA 125.179 1.391 . . . . 0.0 113.142 -176.406 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -73.34 139.08 28.46 Favored 'Trans proline' 0 C--N 1.351 0.701 0 C-N-CA 123.06 2.507 . . . . 0.0 109.461 168.487 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . 0.421 ' H ' HG12 ' A' ' 3' ' ' VAL . 78.2 tttt -74.47 -46.15 41.51 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 113.26 0.837 . . . . 0.0 113.26 -170.24 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 38.7 m -150.31 -61.16 0.2 Allowed 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 125.915 1.686 . . . . 0.0 110.236 -175.507 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 29.4 tptp -81.61 141.7 33.47 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.471 1.108 . . . . 0.0 112.761 -176.203 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 31.3 mtp180 . . . . . 0 C--O 1.252 1.194 0 C-N-CA 126.535 1.934 . . . . 0.0 111.269 168.741 . . . . . . . . 0 0 . 1 . 042 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.585 0 N-CA-C 111.589 -0.604 . . . . 0.0 111.589 . . . . . . . . . 0 0 . 1 . 042 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 3.8 tt -105.61 -20.7 5.78 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.069 0 N-CA-C 115.051 1.5 . . . . 0.0 115.051 -176.882 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 3.9 p -62.03 -29.05 45.61 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.349 0 CA-C-N 121.325 1.875 . . . . 0.0 110.968 179.249 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -65.6 -10.37 34.97 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 126.254 1.822 . . . . 0.0 113.519 174.592 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 36.9 tt0 -111.29 -53.01 2.75 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.334 1.454 . . . . 0.0 109.9 169.152 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 85.2 m -60.73 -31.52 70.82 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 114.265 1.209 . . . . 0.0 114.265 -173.267 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 8.7 t -91.24 -20.82 21.51 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 113.253 0.835 . . . . 0.0 113.253 -173.894 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 30.0 p -104.14 -27.44 12.07 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 126.368 1.867 . . . . 0.0 112.715 179.988 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 10.3 t -144.01 -165.94 2.24 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.895 2.078 . . . . 0.0 110.163 -177.943 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 29.2 mm -87.65 144.23 9.66 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 C-N-CA 124.963 1.305 . . . . 0.0 110.804 178.082 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.8 p -138.44 179.07 6.68 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.518 1.527 . . . . 0.0 110.65 168.966 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 7.4 t -152.49 166.96 30.35 Favored 'General case' 0 N--CA 1.474 0.755 0 O-C-N 120.733 -1.23 . . . . 0.0 113.925 -174.045 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 26.9 mt -61.11 -34.48 75.02 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.647 1.579 . . . . 0.0 112.286 -170.625 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 87.1 t80 -60.74 -28.08 68.42 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.454 1.102 . . . . 0.0 112.993 175.553 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 41.8 mt-30 -82.96 -38.35 22.84 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 123.748 0.819 . . . . 0.0 111.23 173.276 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 84.9 mt -61.31 -34.5 75.34 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.908 0.883 . . . . 0.0 112.608 177.017 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -54.72 -32.21 59.33 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 113.423 0.898 . . . . 0.0 113.423 171.857 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 16.5 t-20 -68.18 -19.1 64.75 Favored 'General case' 0 CA--C 1.547 0.834 0 CA-C-N 118.92 0.782 . . . . 0.0 113.073 179.469 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 97.4 m-85 -98.1 4.55 49.13 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.568 1.547 . . . . 0.0 113.659 178.347 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 17.5 t -77.41 173.9 11.43 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 124.903 1.281 . . . . 0.0 111.312 168.481 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.049 0 C-N-CA 125.105 1.362 . . . . 0.0 111.531 169.634 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 75.8 m-85 . . . . . 0 N--CA 1.487 1.392 0 N-CA-C 107.757 -1.201 . . . . 0.0 107.757 . . . . . . . . . 0 0 . 1 . 042 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 4.2 t 69.28 176.9 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.706 0 C-N-CA 125.42 1.488 . . . . 0.0 108.934 -168.167 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 7.2 p30 -62.24 131.9 50.94 Favored 'General case' 0 CA--C 1.546 0.811 0 O-C-N 120.357 -1.464 . . . . 0.0 111.533 174.523 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 70.4 mt-30 -160.75 173.42 15.44 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.968 1.307 . . . . 0.0 111.032 -169.345 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 99.3 m-70 -87.49 139.24 30.75 Favored 'General case' 0 CA--C 1.549 0.915 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 165.093 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 5.0 mp -143.03 145.48 32.95 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 124.969 1.308 . . . . 0.0 111.116 177.717 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 1.8 t -156.35 151.3 26.2 Favored 'General case' 0 N--CA 1.468 0.445 0 O-C-N 121.212 -0.93 . . . . 0.0 112.022 178.935 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 53.52 -129.49 40.9 Favored Glycine 0 N--CA 1.472 1.053 0 C-N-CA 124.326 0.965 . . . . 0.0 114.044 172.625 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.5 m -57.16 -31.99 65.95 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 124.481 1.113 . . . . 0.0 113.79 178.854 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -71.42 -38.08 71.42 Favored 'General case' 0 CA--C 1.544 0.737 0 O-C-N 120.983 -1.073 . . . . 0.0 111.492 176.164 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 42.4 tp -67.85 -41.29 83.14 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 123.485 0.714 . . . . 0.0 110.844 174.183 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 40.4 t -59.31 -45.86 92.88 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.975 0 C-N-CA 124.542 1.137 . . . . 0.0 111.306 172.599 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -63.09 -43.51 98.31 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.456 0.702 . . . . 0.0 111.447 177.033 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -65.13 -39.85 93.62 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 121.35 -0.844 . . . . 0.0 112.406 177.075 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 48.7 mt -61.18 -42.54 98.75 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 118.521 0.6 . . . . 0.0 111.351 174.098 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 17.0 m-85 -62.26 -41.54 98.54 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 119.079 0.854 . . . . 0.0 112.613 172.291 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 73.3 mt -67.25 -43.12 82.7 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 123.668 0.787 . . . . 0.0 112.193 178.498 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 55.1 t -72.53 -44.55 61.17 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 C-N-CA 123.896 0.878 . . . . 0.0 112.384 -179.149 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 35.5 t -82.86 -24.98 32.99 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 113.397 0.888 . . . . 0.0 113.397 -177.914 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 74.35 -155.23 48.59 Favored Glycine 0 CA--C 1.529 0.962 0 C-N-CA 124.65 1.119 . . . . 0.0 112.422 -178.334 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -62.69 -12.16 21.87 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 114.455 1.279 . . . . 0.0 114.455 179.471 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 56.1 mtp85 -61.3 -31.04 70.87 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.939 1.296 . . . . 0.0 112.683 175.007 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.39 139.48 1.5 Allowed Glycine 0 CA--C 1.533 1.218 0 C-N-CA 125.56 1.552 . . . . 0.0 112.945 -178.706 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 7.1 p90 -74.7 160.61 30.55 Favored 'General case' 0 CA--C 1.541 0.626 0 O-C-N 121.933 -0.745 . . . . 0.0 112.97 177.48 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 76.8 t80 -91.24 -27.67 18.3 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 125.21 1.404 . . . . 0.0 112.79 175.352 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 18.3 t80 -117.44 139.8 50.42 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 126.196 1.799 . . . . 0.0 113.069 -170.99 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 26.2 p -110.57 155.28 42.39 Favored Pre-proline 0 N--CA 1.478 0.926 0 C-N-CA 125.149 1.38 . . . . 0.0 108.54 167.509 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_exo -50.82 129.16 26.64 Favored 'Trans proline' 0 C--N 1.351 0.696 0 C-N-CA 123.558 2.839 . . . . 0.0 112.636 -177.06 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 7.0 mtmp? 82.03 -3.81 1.5 Allowed 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 128.272 2.629 . . . . 0.0 113.452 179.946 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 39.4 p 98.05 -18.65 0.05 OUTLIER 'General case' 0 N--CA 1.493 1.725 1 C-N-CA 133.044 4.538 . . . . 0.0 111.907 -173.413 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -147.68 123.19 10.4 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 126.109 1.763 . . . . 0.0 109.926 172.357 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.215 0 C-N-CA 125.909 1.684 . . . . 0.0 114.387 -173.728 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.83 0 N-CA-C 111.763 -0.535 . . . . 0.0 111.763 . . . . . . . . . 0 0 . 1 . 043 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 11.7 pt -68.36 -18.64 23.59 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.392 0 N-CA-C 114.347 1.24 . . . . 0.0 114.347 -169.297 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 7.1 p -57.84 -34.14 47.45 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 C-N-CA 124.973 1.309 . . . . 0.0 112.695 -174.977 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -70.38 -47.82 59.1 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 118.252 0.478 . . . . 0.0 110.863 172.172 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -71.2 -43.9 66.47 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.674 0.789 . . . . 0.0 111.837 -171.414 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 67.8 m -58.92 -28.34 66.12 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 123.991 0.916 . . . . 0.0 112.415 172.932 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 8.7 t -83.09 -54.33 5.12 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.706 0.803 . . . . 0.0 111.466 -178.86 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 81.3 p -77.66 -21.66 51.82 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 124.517 1.127 . . . . 0.0 113.739 -177.03 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.7 t -143.49 -165.39 2.08 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.386 1.474 . . . . 0.0 111.126 -178.508 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 37.6 mt -99.39 132.82 44.09 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 C-N-CA 125.295 1.438 . . . . 0.0 109.887 -174.531 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 7.8 p -132.8 159.19 40.48 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.247 1.019 . . . . 0.0 112.858 178.962 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 77.3 p -108.94 163.39 13.34 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 114.661 1.356 . . . . 0.0 114.661 -169.687 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 75.2 mt -59.55 -30.26 68.5 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 121.398 -0.814 . . . . 0.0 112.567 174.781 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 94.0 t80 -63.79 -33.43 75.64 Favored 'General case' 0 N--CA 1.473 0.688 0 O-C-N 121.383 -0.823 . . . . 0.0 112.603 173.802 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 58.3 mt-30 -74.1 -37.5 64.12 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 123.414 0.685 . . . . 0.0 110.868 173.617 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 41.2 mt -60.8 -43.74 97.76 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 118.336 0.516 . . . . 0.0 112.156 171.465 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -59.07 -38.91 80.55 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.033 0.933 . . . . 0.0 112.538 172.465 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 -65.1 -22.68 66.98 Favored 'General case' 0 CA--C 1.552 1.048 0 O-C-N 121.436 -0.79 . . . . 0.0 112.981 174.368 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -90.58 -1.81 57.88 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 125.953 1.701 . . . . 0.0 114.271 173.482 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 78.2 m -71.95 158.84 35.27 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 119.973 1.26 . . . . 0.0 112.112 171.418 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 . . . . . 0 C--O 1.255 1.35 0 C-N-CA 125.155 1.382 . . . . 0.0 113.497 179.669 . . . . . . . . 0 0 . 1 . 043 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . 0.25 48.7 p90 . . . . . 0 N--CA 1.481 1.12 0 CA-C-O 117.107 -1.425 . . . . 0.0 113.267 . . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 3.5 p -176.29 -51.47 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 CA-C-N 121.228 1.831 . . . . 0.0 113.512 178.066 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 63.7 t30 -120.48 99.76 6.75 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 123.945 0.898 . . . . 0.0 110.158 -169.84 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 8.5 mt-30 -143.45 168.38 19.98 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 124.795 1.238 . . . . 0.0 113.056 -166.255 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 26.2 m-70 -77.54 135.34 38.19 Favored 'General case' 0 CA--C 1.549 0.926 0 N-CA-C 108.339 -0.985 . . . . 0.0 108.339 166.159 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 87.8 mt -144.1 128.51 17.93 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 125.961 1.704 . . . . 0.0 109.343 177.874 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 5.6 t -145.8 145.29 30.74 Favored 'General case' 0 N--CA 1.469 0.504 0 O-C-N 121.335 -0.853 . . . . 0.0 112.174 -179.495 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.08 -125.85 36.99 Favored Glycine 0 N--CA 1.469 0.842 0 C-N-CA 124.395 0.998 . . . . 0.0 113.354 175.926 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 28.9 p -56.4 -35.79 68.16 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.763 1.225 . . . . 0.0 113.448 178.487 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 94.8 m-70 -68.26 -39.71 82.11 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 120.78 -1.2 . . . . 0.0 111.945 176.872 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 38.4 tp -68.13 -42.7 79.8 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 123.734 0.813 . . . . 0.0 111.308 174.41 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 40.9 t -61.37 -42.21 92.82 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.973 0 C-N-CA 124.095 0.958 . . . . 0.0 111.315 174.878 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -63.93 -44.9 91.47 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 123.829 0.852 . . . . 0.0 111.528 174.537 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.79 -39.33 91.31 Favored 'General case' 0 CA--C 1.541 0.599 0 O-C-N 121.466 -0.771 . . . . 0.0 112.117 175.988 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 70.1 mt -66.08 -40.05 90.54 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 118.526 -0.749 . . . . 0.0 112.194 174.039 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 19.4 m-85 -60.18 -40.42 89.94 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 120.363 1.438 . . . . 0.0 112.236 170.943 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 81.0 mt -68.07 -44.69 75.73 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.632 0.773 . . . . 0.0 112.47 177.336 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 53.0 t -73.46 -47.82 44.03 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 123.725 0.81 . . . . 0.0 112.181 -179.258 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 56.7 m -80.84 -32.07 35.26 Favored 'General case' 0 N--CA 1.47 0.544 0 N-CA-C 113.227 0.825 . . . . 0.0 113.227 -174.205 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 66.75 -138.34 35.33 Favored Glycine 0 CA--C 1.53 1.0 0 C-N-CA 124.137 0.875 . . . . 0.0 111.999 -177.934 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -62.26 -21.39 65.15 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 124.775 1.23 . . . . 0.0 113.258 -178.684 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 89.4 mtm180 -61.79 -35.75 79.08 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.151 0.981 . . . . 0.0 112.939 178.326 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.68 -175.73 49.39 Favored Glycine 0 CA--C 1.533 1.21 0 C-N-CA 124.131 0.872 . . . . 0.0 113.033 -171.232 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 2.0 p90 -130.03 167.68 17.91 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.146 1.378 . . . . 0.0 114.48 -170.442 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 58.1 t80 -93.38 1.53 56.87 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 127.303 2.241 . . . . 0.0 113.125 176.837 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 76.7 t80 -52.05 141.46 18.2 Favored 'General case' 0 CA--C 1.546 0.798 0 N-CA-C 115.753 1.761 . . . . 0.0 115.753 -171.902 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -162.97 127.37 1.96 Allowed Pre-proline 0 N--CA 1.47 0.573 0 C-N-CA 127.347 2.259 . . . . 0.0 108.0 170.463 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -70.5 145.66 53.47 Favored 'Trans proline' 0 C--N 1.35 0.641 0 C-N-CA 123.2 2.6 . . . . 0.0 113.434 -169.033 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 35.9 mmtm -128.91 1.41 5.34 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 125.579 1.552 . . . . 0.0 113.056 173.481 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 12.7 p -97.27 -60.93 1.48 Allowed 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 127.52 2.328 . . . . 0.0 110.156 -178.483 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 23.0 ptmt -82.81 -3.61 56.93 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 125.662 1.585 . . . . 0.0 114.43 176.447 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 79.1 ttt180 . . . . . 0 C--O 1.252 1.203 0 C-N-CA 127.278 2.231 . . . . 0.0 110.867 -175.93 . . . . . . . . 0 0 . 1 . 044 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.353 0 N-CA-C 112.216 -0.353 . . . . 0.0 112.216 . . . . . . . . . 0 0 . 1 . 044 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 9.6 tp -92.62 -36.52 7.71 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 C-N-CA 124.33 1.052 . . . . 0.0 113.647 -175.488 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 41.5 t -68.49 -35.33 70.03 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.107 0 CA-C-N 120.02 1.282 . . . . 0.0 111.092 -172.625 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.3 pm0 -69.97 -9.9 56.74 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 113.64 0.978 . . . . 0.0 113.64 174.884 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 60.5 mt-30 -93.96 -58.48 2.23 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 118.706 0.684 . . . . 0.0 109.199 169.716 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 86.7 m -76.42 -27.93 56.44 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 115.689 1.736 . . . . 0.0 115.689 -169.395 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 16.3 t -85.41 -49.51 8.05 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 118.404 0.547 . . . . 0.0 110.726 179.65 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 15.3 m -64.75 -38.23 90.29 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 126.248 1.819 . . . . 0.0 111.924 -178.197 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 65.8 m -142.92 -176.0 4.73 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 125.592 1.557 . . . . 0.0 111.405 -173.898 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 95.6 mt -79.38 122.77 35.27 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 O-C-N 120.252 -1.53 . . . . 0.0 108.174 168.057 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 20.8 p -100.77 157.08 16.97 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.934 0.893 . . . . 0.0 111.407 170.627 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 37.5 t -79.97 152.9 29.25 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 120.948 -1.095 . . . . 0.0 112.067 175.51 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -62.11 -28.43 69.62 Favored 'General case' 0 CA--C 1.543 0.709 0 O-C-N 121.038 -1.039 . . . . 0.0 110.721 170.77 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.7 t80 -66.8 -30.96 71.28 Favored 'General case' 0 CA--C 1.542 0.654 0 O-C-N 121.324 -0.86 . . . . 0.0 112.996 170.435 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 94.7 mt-30 -76.16 -33.96 59.37 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 121.453 -0.779 . . . . 0.0 110.879 175.361 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 93.9 mt -59.2 -49.87 76.19 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 119.192 0.906 . . . . 0.0 110.19 168.479 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -62.79 -29.5 70.75 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 114.249 1.203 . . . . 0.0 114.249 176.48 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -63.01 -24.83 68.1 Favored 'General case' 0 CA--C 1.548 0.868 0 CA-C-N 119.527 1.058 . . . . 0.0 113.012 -179.306 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 52.9 m-85 -95.15 2.95 55.16 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.427 1.491 . . . . 0.0 113.624 173.732 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 95.4 m -103.76 124.72 49.41 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 121.218 -0.926 . . . . 0.0 112.966 179.753 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.252 1.225 0 C-N-CA 127.254 2.221 . . . . 0.0 112.843 -169.262 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 45.6 p90 . . . . . 0 N--CA 1.485 1.294 0 CA-C-O 119.745 -0.169 . . . . 0.0 110.887 . . . . . . . . . 0 0 . 1 . 044 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 22.4 m -138.03 151.14 25.08 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 C-N-CA 124.983 1.313 . . . . 0.0 111.093 171.638 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 60.8 t30 -77.92 179.69 6.58 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 124.233 1.013 . . . . 0.0 111.61 170.447 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 15.8 mp0 -107.68 169.89 8.32 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.828 1.651 . . . . 0.0 110.914 177.838 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 15.1 m-70 -71.28 139.62 50.05 Favored 'General case' 0 CA--C 1.545 0.763 0 O-C-N 121.376 -0.827 . . . . 0.0 109.013 167.481 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 73.7 mt -135.03 126.23 28.09 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 125.478 1.511 . . . . 0.0 108.875 179.699 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.6 t -144.36 150.02 37.1 Favored 'General case' 0 N--CA 1.47 0.538 0 O-C-N 121.691 -0.63 . . . . 0.0 112.02 -176.903 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 56.83 -128.79 47.94 Favored Glycine 0 CA--C 1.529 0.908 0 C-N-CA 124.344 0.973 . . . . 0.0 113.588 174.244 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 26.5 p -56.43 -37.48 70.27 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.853 1.261 . . . . 0.0 113.044 177.516 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 68.4 m-70 -73.51 -29.26 62.37 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 119.615 1.098 . . . . 0.0 112.689 177.452 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 39.5 tp -71.93 -42.42 66.7 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 121.144 -0.973 . . . . 0.0 111.402 170.654 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 21.7 t -57.64 -47.91 84.48 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 C-N-CA 124.285 1.034 . . . . 0.0 110.896 171.286 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -58.37 -47.56 83.42 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.542 1.537 . . . . 0.0 111.677 174.589 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.86 -43.68 98.14 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 118.671 0.669 . . . . 0.0 112.21 177.778 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 44.8 mt -61.04 -42.75 99.06 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 118.619 0.645 . . . . 0.0 111.454 176.384 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 16.8 m-85 -61.22 -45.28 95.22 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.046 0.839 . . . . 0.0 112.491 172.776 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 78.2 mt -68.06 -42.6 80.21 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.788 0.835 . . . . 0.0 112.966 -179.5 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 54.6 t -73.99 -44.69 50.44 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 124.524 1.13 . . . . 0.0 111.606 -178.079 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 65.9 m -99.71 -18.93 17.01 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 114.984 1.475 . . . . 0.0 114.984 -169.896 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 61.72 -133.07 47.11 Favored Glycine 0 CA--C 1.533 1.158 0 CA-C-N 118.973 0.806 . . . . 0.0 112.633 177.571 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 5.3 pm0 -66.93 -11.97 58.05 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.7 1.6 . . . . 0.0 115.223 -176.799 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 69.8 mtp180 -60.22 -38.01 82.05 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.859 0.863 . . . . 0.0 112.478 176.134 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.62 166.62 9.6 Favored Glycine 0 CA--C 1.536 1.362 0 C-N-CA 124.087 0.851 . . . . 0.0 112.364 -170.393 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 47.6 p90 -130.83 147.79 52.53 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.019 1.328 . . . . 0.0 112.98 -174.479 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 39.4 t80 -94.37 91.43 6.68 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 125.789 1.636 . . . . 0.0 109.457 172.424 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 15.9 t80 -71.36 127.81 33.82 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 121.718 -0.614 . . . . 0.0 111.597 -177.156 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 3.9 p -136.83 108.02 9.06 Favored Pre-proline 0 N--CA 1.477 0.908 0 C-N-CA 124.974 1.31 . . . . 0.0 110.394 -172.934 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -81.87 170.96 13.51 Favored 'Trans proline' 0 C--N 1.355 0.881 0 C-N-CA 124.481 3.454 . . . . 0.0 113.654 -170.355 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 27.4 mtpp -61.79 -23.5 66.24 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 124.529 1.132 . . . . 0.0 113.917 176.064 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 2.2 t -88.0 -2.93 58.91 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 126.424 1.89 . . . . 0.0 113.243 174.413 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 82.3 tttt 76.64 -49.97 0.57 Allowed 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 128.926 2.891 . . . . 0.0 113.354 177.479 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 72.9 ttp85 . . . . . 0 C--O 1.252 1.233 0 C-N-CA 126.793 2.037 . . . . 0.0 111.667 -179.998 . . . . . . . . 0 0 . 1 . 045 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.44 0 N-CA-C 110.512 -1.035 . . . . 0.0 110.512 . . . . . . . . . 0 0 . 1 . 045 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 20.1 tt -165.35 -47.17 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.219 0 C-N-CA 124.493 1.117 . . . . 0.0 112.474 -177.292 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 58.0 t -58.74 -44.92 91.18 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.058 0 C-N-CA 124.367 1.067 . . . . 0.0 110.408 -177.003 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.0 pm0 -66.63 -11.31 53.08 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.633 1.573 . . . . 0.0 113.819 177.671 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 26.3 mm100 -95.27 -53.11 3.9 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.457 1.103 . . . . 0.0 109.561 168.833 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 84.8 m -61.06 -34.91 75.64 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.939 1.296 . . . . 0.0 114.153 -174.749 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 72.7 m -72.79 -46.08 55.17 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 121.244 -0.91 . . . . 0.0 111.147 174.995 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 21.7 m -77.15 -32.33 56.23 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 126.723 2.009 . . . . 0.0 112.849 -170.442 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.4 t -150.91 -168.96 3.25 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 126.069 1.748 . . . . 0.0 110.865 -176.167 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 62.5 mt -79.45 136.08 24.35 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 O-C-N 120.681 -1.262 . . . . 0.0 110.322 175.658 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.6 p -127.28 160.69 30.56 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.311 1.044 . . . . 0.0 112.402 173.731 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 33.5 t -101.26 154.02 19.12 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 114.194 1.183 . . . . 0.0 114.194 -168.848 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 32.2 mt -62.21 -30.64 71.23 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.139 0.976 . . . . 0.0 111.702 174.121 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 87.5 t80 -61.6 -34.72 76.12 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 123.695 0.798 . . . . 0.0 112.716 171.985 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 58.8 mt-30 -72.1 -43.74 64.31 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.423 0.689 . . . . 0.0 109.797 176.363 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 95.3 mt -57.23 -49.45 76.0 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 122.979 0.512 . . . . 0.0 111.734 174.411 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -62.77 -28.35 69.92 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 113.243 0.831 . . . . 0.0 113.243 178.166 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -81.19 -38.94 26.24 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 124.221 1.008 . . . . 0.0 112.942 179.039 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 20.7 m-85 -84.58 -6.46 59.37 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 114.55 1.315 . . . . 0.0 114.55 179.64 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 39.4 t -70.72 174.38 6.05 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 124.45 1.1 . . . . 0.0 112.07 168.076 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 14.6 t-20 . . . . . 0 C--O 1.251 1.178 0 C-N-CA 125.304 1.442 . . . . 0.0 113.313 -176.645 . . . . . . . . 0 0 . 1 . 045 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 34.1 t80 . . . . . 0 N--CA 1.487 1.381 0 CA-C-O 119.884 -0.103 . . . . 0.0 111.017 . . . . . . . . . 0 0 . 1 . 045 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 19.1 t -79.37 -19.92 12.6 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.362 0 O-C-N 120.784 -1.198 . . . . 0.0 113.049 -169.75 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 24.2 t30 -60.92 94.85 0.03 OUTLIER 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 125.586 1.554 . . . . 0.0 111.424 174.955 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -153.03 -170.69 3.7 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 126.415 1.886 . . . . 0.0 110.516 -168.804 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 19.9 m-70 -75.3 146.26 41.14 Favored 'General case' 0 CA--C 1.546 0.814 0 O-C-N 120.846 -1.159 . . . . 0.0 109.54 167.442 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 61.2 mt -146.5 133.02 19.73 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 126.535 1.934 . . . . 0.0 109.201 174.874 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.1 t -145.46 150.47 36.56 Favored 'General case' 0 N--CA 1.468 0.438 0 O-C-N 121.189 -0.944 . . . . 0.0 113.013 179.928 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 57.04 -129.99 50.29 Favored Glycine 0 N--CA 1.469 0.884 0 C-N-CA 124.929 1.252 . . . . 0.0 113.864 172.4 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 17.4 p -54.72 -43.28 72.46 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 124.348 1.059 . . . . 0.0 112.409 175.566 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -65.48 -34.83 79.19 Favored 'General case' 0 CA--C 1.542 0.666 0 O-C-N 121.117 -0.989 . . . . 0.0 112.256 178.919 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 62.2 tp -67.34 -44.87 78.03 Favored 'General case' 0 C--O 1.222 -0.371 0 CA-C-O 118.033 -0.984 . . . . 0.0 111.259 171.203 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 54.3 t -62.24 -43.41 97.93 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.078 0 CA-C-N 119.643 1.111 . . . . 0.0 111.25 178.975 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.1 mm-40 -60.79 -51.28 70.01 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 123.689 0.795 . . . . 0.0 111.224 173.8 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.89 -43.44 92.9 Favored 'General case' 0 CA--C 1.534 0.339 0 O-C-N 121.551 -0.718 . . . . 0.0 111.934 -177.5 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 62.0 tp -55.25 -47.14 75.85 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 125.339 1.456 . . . . 0.0 111.184 177.697 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -72.69 -39.34 67.12 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 119.134 0.879 . . . . 0.0 112.365 177.996 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 74.9 mt -66.92 -41.21 87.44 Favored 'General case' 0 N--CA 1.474 0.754 0 CA-C-N 118.95 0.796 . . . . 0.0 112.816 179.845 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 54.7 t -68.39 -34.86 68.17 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 C-N-CA 124.992 1.317 . . . . 0.0 111.566 176.33 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 42.7 t -80.97 -34.07 33.38 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 114.261 1.208 . . . . 0.0 114.261 -179.15 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 86.03 -145.34 20.64 Favored Glycine 0 CA--C 1.533 1.182 0 C-N-CA 125.197 1.38 . . . . 0.0 113.42 179.786 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -59.27 -22.75 61.63 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 126.232 1.813 . . . . 0.0 114.593 -169.593 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 71.3 mtp180 -52.33 -38.33 58.36 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 125.419 1.487 . . . . 0.0 113.176 175.496 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.04 148.84 3.02 Favored Glycine 0 CA--C 1.533 1.186 0 C-N-CA 125.101 1.334 . . . . 0.0 112.263 -174.085 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 27.2 p90 -71.56 168.29 17.92 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 113.993 1.108 . . . . 0.0 113.993 -175.079 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 73.5 t80 -136.96 -60.34 0.69 Allowed 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.854 1.262 . . . . 0.0 111.96 -177.486 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 15.6 t80 -74.16 114.15 12.17 Favored 'General case' 0 CA--C 1.546 0.814 0 O-C-N 121.75 -0.594 . . . . 0.0 112.373 -172.672 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 23.3 p -78.29 155.43 79.37 Favored Pre-proline 0 N--CA 1.48 1.029 0 C-N-CA 125.85 1.66 . . . . 0.0 112.167 -178.686 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -73.27 108.04 2.52 Favored 'Trans proline' 0 C--N 1.352 0.723 0 C-N-CA 123.537 2.825 . . . . 0.0 111.47 -176.88 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt -76.56 -24.83 53.56 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 114.223 1.194 . . . . 0.0 114.223 -169.69 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 6.2 t -92.54 -30.57 15.6 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 125.119 1.368 . . . . 0.0 113.027 -177.077 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm -91.02 -19.85 22.75 Favored 'General case' 0 CA--C 1.547 0.857 0 N-CA-C 114.461 1.282 . . . . 0.0 114.461 -178.226 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 32.0 tpt180 . . . . . 0 C--O 1.252 1.221 0 C-N-CA 124.751 1.22 . . . . 0.0 112.133 176.566 . . . . . . . . 0 0 . 1 . 046 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.296 0 N-CA-C 111.239 -0.744 . . . . 0.0 111.239 . . . . . . . . . 0 0 . 1 . 046 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 11.3 tt -72.32 -41.54 65.62 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.988 0 N-CA-C 113.042 0.756 . . . . 0.0 113.042 -173.379 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 9.8 p -68.78 -28.12 38.58 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 O-C-N 121.64 -0.662 . . . . 0.0 111.827 -176.596 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 37.2 mp0 -68.75 -12.9 61.99 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 123.853 0.861 . . . . 0.0 113.045 173.018 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 5.5 tp60 -97.99 -58.35 2.0 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.022 0.929 . . . . 0.0 110.347 169.199 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 34.7 m -70.77 -27.13 63.69 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 114.675 1.361 . . . . 0.0 114.675 -170.095 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 10.6 t -81.28 -38.8 26.24 Favored 'General case' 0 N--CA 1.472 0.646 0 O-C-N 120.868 -1.145 . . . . 0.0 111.105 175.288 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 28.7 m -69.61 -38.99 77.49 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 126.881 2.072 . . . . 0.0 112.586 -177.614 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 21.5 m -143.52 166.41 24.88 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 124.711 1.205 . . . . 0.0 111.304 -178.035 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 70.0 mt -58.93 128.78 20.2 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 O-C-N 121.129 -0.982 . . . . 0.0 109.326 169.447 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 15.1 p -120.37 154.6 34.86 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 122.066 0.936 . . . . 0.0 112.29 175.926 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 47.4 t -98.01 153.85 18.1 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 124.497 1.119 . . . . 0.0 112.621 -174.103 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 10.7 mp -61.61 -26.94 68.3 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.861 0.864 . . . . 0.0 111.503 174.21 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 93.5 t80 -59.31 -37.92 78.95 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 123.574 0.75 . . . . 0.0 112.669 169.582 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 68.9 mt-30 -75.62 -39.81 57.3 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 124.155 0.982 . . . . 0.0 110.567 178.418 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 78.6 mt -58.68 -53.76 54.71 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.128 0.971 . . . . 0.0 111.201 172.702 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -66.13 -30.34 70.82 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 -179.98 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 20.1 t30 -66.15 -33.03 74.84 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 118.927 0.785 . . . . 0.0 112.326 172.678 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -73.96 -33.23 63.8 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.03 0.932 . . . . 0.0 112.652 172.856 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 87.5 m -71.17 177.15 3.97 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 125.451 1.5 . . . . 0.0 114.655 176.866 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 31.2 m120 . . . . . 0 C--O 1.256 1.431 0 C-N-CA 125.549 1.54 . . . . 0.0 112.021 170.44 . . . . . . . . 0 0 . 1 . 046 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 41.2 t80 . . . . . 0 N--CA 1.487 1.41 0 CA-C-O 119.549 -0.262 . . . . 0.0 111.044 . . . . . . . . . 0 0 . 1 . 046 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 27.4 m -75.32 -36.37 36.08 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.42 0 O-C-N 121.209 -0.932 . . . . 0.0 113.366 -174.785 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -84.02 104.63 14.24 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.673 1.189 . . . . 0.0 108.022 169.268 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -169.73 -177.11 2.58 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.712 1.205 . . . . 0.0 110.336 -167.905 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 26.2 m-70 -71.83 136.74 47.14 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 164.472 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 84.4 mt -138.84 128.83 25.21 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 126.142 1.777 . . . . 0.0 109.176 -179.831 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.3 t -141.48 133.67 27.89 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 112.77 0.656 . . . . 0.0 112.77 -171.407 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 60.05 -126.88 42.81 Favored Glycine 0 CA--C 1.528 0.845 0 C-N-CA 124.361 0.982 . . . . 0.0 113.241 175.059 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 18.8 m -55.21 -32.81 62.53 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.281 1.032 . . . . 0.0 113.069 177.769 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 32.4 m80 -68.46 -39.0 81.58 Favored 'General case' 0 CA--C 1.542 0.662 0 O-C-N 121.043 -1.036 . . . . 0.0 111.732 177.465 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 32.1 tp -71.38 -41.26 69.87 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 124.255 1.022 . . . . 0.0 111.086 175.618 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 64.5 t -60.74 -43.29 94.86 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 123.597 0.759 . . . . 0.0 110.953 173.004 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -64.66 -41.77 95.86 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 123.643 0.777 . . . . 0.0 111.922 174.305 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.37 -45.26 94.14 Favored 'General case' 0 CA--C 1.535 0.399 0 O-C-N 121.568 -0.708 . . . . 0.0 111.483 174.396 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 51.6 mt -58.69 -44.1 90.19 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 123.627 0.771 . . . . 0.0 111.838 174.893 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 4.6 m-85 -56.01 -50.77 69.96 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.514 0.726 . . . . 0.0 112.126 172.593 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 8.4 mp -71.03 -42.23 69.79 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 123.522 0.729 . . . . 0.0 112.649 -176.573 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 69.2 t -76.02 -40.19 37.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 C-N-CA 124.624 1.17 . . . . 0.0 111.886 -174.224 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 58.5 m -95.61 -18.21 20.74 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 113.697 0.999 . . . . 0.0 113.697 -174.828 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 62.45 -140.32 46.19 Favored Glycine 0 CA--C 1.532 1.136 0 C-N-CA 124.761 1.172 . . . . 0.0 114.073 168.928 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -68.22 -13.95 62.62 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 124.951 1.3 . . . . 0.0 114.153 -174.111 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 57.0 mtm-85 -67.68 -26.08 66.01 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 123.867 0.867 . . . . 0.0 112.663 176.662 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.2 168.38 44.21 Favored Glycine 0 CA--C 1.531 1.051 0 C-N-CA 125.059 1.314 . . . . 0.0 112.908 -171.458 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 39.9 p90 -135.02 170.6 15.66 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.267 1.427 . . . . 0.0 112.437 -179.199 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 65.6 t80 -129.52 148.87 51.46 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.344 1.458 . . . . 0.0 110.169 172.021 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 63.2 t80 -156.8 125.21 5.7 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.743 1.217 . . . . 0.0 110.956 -174.437 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 50.3 m -152.17 124.41 3.92 Favored Pre-proline 0 N--CA 1.474 0.753 0 C-N-CA 124.869 1.268 . . . . 0.0 109.782 177.534 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -84.39 161.44 12.97 Favored 'Trans proline' 0 CA--C 1.536 0.618 0 C-N-CA 123.937 3.091 . . . . 0.0 111.056 169.401 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 58.2 tptt -59.16 -26.34 64.68 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.308 1.043 . . . . 0.0 113.245 177.522 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 31.2 p -72.02 -26.99 62.43 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 125.85 1.66 . . . . 0.0 113.624 178.001 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -109.36 -11.33 14.86 Favored 'General case' 0 N--CA 1.477 0.894 0 N-CA-C 114.563 1.32 . . . . 0.0 114.563 -176.848 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 75.6 ttt180 . . . . . 0 C--O 1.252 1.223 0 C-N-CA 124.859 1.263 . . . . 0.0 112.19 177.135 . . . . . . . . 0 0 . 1 . 047 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.42 0 N-CA-C 110.467 -1.053 . . . . 0.0 110.467 . . . . . . . . . 0 0 . 1 . 047 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 19.4 tt -166.21 -53.94 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 C-N-CA 125.687 1.595 . . . . 0.0 112.756 178.919 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 13.4 p -63.07 -31.91 54.31 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.129 0 CA-C-N 119.156 0.889 . . . . 0.0 112.523 -176.177 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 6.0 pm0 -72.46 -5.09 34.29 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.854 1.261 . . . . 0.0 113.618 175.768 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 47.2 tp60 -107.82 -52.83 2.71 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.257 1.423 . . . . 0.0 109.211 168.183 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 95.3 m -59.59 -35.1 73.63 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 114.238 1.199 . . . . 0.0 114.238 -175.423 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 19.0 t -82.74 -33.11 27.56 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 113.14 0.793 . . . . 0.0 113.14 -172.689 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 27.5 p -100.48 -26.85 13.71 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 126.388 1.875 . . . . 0.0 112.875 -175.701 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.7 t -138.98 -160.74 1.1 Allowed 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 126.114 1.766 . . . . 0.0 110.137 179.632 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 72.1 mt -97.81 140.03 18.8 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.71 0 O-C-N 120.546 -1.347 . . . . 0.0 110.109 -177.535 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 15.1 p -134.51 161.85 33.91 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 124.595 1.158 . . . . 0.0 112.66 173.983 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 60.1 p -109.16 165.64 11.45 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 115.174 1.546 . . . . 0.0 115.174 -170.647 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 11.0 mp -65.3 -30.25 71.09 Favored 'General case' 0 N--CA 1.47 0.549 0 O-C-N 121.454 -0.779 . . . . 0.0 111.726 171.831 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 80.1 t80 -63.63 -31.73 72.99 Favored 'General case' 0 CA--C 1.543 0.698 0 O-C-N 121.462 -0.774 . . . . 0.0 112.717 172.54 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 84.9 mt-30 -75.4 -36.34 60.86 Favored 'General case' 0 CA--C 1.537 0.46 0 O-C-N 121.483 -0.761 . . . . 0.0 111.495 172.593 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 86.7 mt -62.11 -42.11 98.9 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 119.374 0.988 . . . . 0.0 111.866 171.778 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -58.61 -27.11 64.37 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.748 1.219 . . . . 0.0 113.807 176.856 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.8 t30 -59.24 -28.01 66.3 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-N 119.125 0.875 . . . . 0.0 113.27 179.155 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 82.2 m-85 -100.55 6.98 44.33 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.508 1.523 . . . . 0.0 113.959 -178.522 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 54.2 m -89.39 153.42 20.86 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.194 0.998 . . . . 0.0 112.573 172.814 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.254 1.313 0 C-N-CA 126.589 1.956 . . . . 0.0 112.349 178.679 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . 0.263 12.0 p90 . . . . . 0 N--CA 1.486 1.352 0 CA-C-O 118.45 -0.786 . . . . 0.0 110.591 . . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 73.1 t -82.36 142.58 13.45 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.287 0 CA-C-N 120.203 1.365 . . . . 0.0 110.079 171.541 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -158.14 147.5 19.57 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 126.039 1.736 . . . . 0.0 112.551 177.57 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -162.54 170.62 18.32 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.825 1.25 . . . . 0.0 111.644 -170.304 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 96.6 m-70 -80.01 139.3 37.04 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 108.334 -0.988 . . . . 0.0 108.334 165.389 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 83.1 mt -148.76 133.81 18.19 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 125.24 1.416 . . . . 0.0 110.367 -179.581 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.6 t -152.36 147.64 26.54 Favored 'General case' 0 N--CA 1.473 0.693 0 O-C-N 121.112 -0.993 . . . . 0.0 113.078 178.183 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 57.88 -129.97 50.32 Favored Glycine 0 CA--C 1.528 0.861 0 C-N-CA 124.517 1.056 . . . . 0.0 112.79 176.174 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.4 m -54.29 -32.36 56.18 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 124.784 1.233 . . . . 0.0 113.335 177.46 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 24.0 m80 -70.81 -41.06 72.09 Favored 'General case' 0 CA--C 1.539 0.52 0 O-C-N 121.33 -0.857 . . . . 0.0 111.628 178.24 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 52.2 tp -67.84 -44.84 76.25 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 123.796 0.839 . . . . 0.0 110.52 174.395 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 25.6 t -56.37 -44.94 81.29 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.99 0 C-N-CA 124.499 1.12 . . . . 0.0 111.22 173.804 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -63.99 -41.77 97.41 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.174 0.59 . . . . 0.0 111.903 174.376 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.34 -41.0 98.21 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 118.881 0.764 . . . . 0.0 112.495 176.05 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -60.6 -46.26 90.93 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 119.234 0.925 . . . . 0.0 111.047 171.084 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 21.5 m-85 -61.81 -34.86 76.68 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 119.978 1.263 . . . . 0.0 113.137 176.117 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 71.9 mt -70.71 -43.99 67.84 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 123.783 0.833 . . . . 0.0 112.195 175.359 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 72.0 t -75.86 -40.9 39.31 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 CA-C-N 118.634 0.652 . . . . 0.0 112.021 -178.057 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 50.8 m -85.2 -23.31 28.35 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 114.011 1.115 . . . . 0.0 114.011 -179.104 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 79.53 -162.47 47.47 Favored Glycine 0 CA--C 1.53 0.999 0 C-N-CA 124.85 1.214 . . . . 0.0 112.673 -173.801 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -61.98 -11.84 15.44 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 125.053 1.341 . . . . 0.0 114.513 -178.58 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 87.9 mtm180 -60.02 -27.54 66.99 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 125.04 1.336 . . . . 0.0 113.537 173.786 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.05 -167.01 54.2 Favored Glycine 0 CA--C 1.533 1.182 0 C-N-CA 124.224 0.916 . . . . 0.0 112.05 -169.727 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 22.9 p90 -138.94 157.65 45.64 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.713 1.205 . . . . 0.0 113.969 -169.871 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 59.4 t80 -87.66 -14.46 39.91 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 126.265 1.826 . . . . 0.0 113.098 174.029 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 18.4 t80 -54.2 143.97 21.31 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 125.285 1.434 . . . . 0.0 113.562 178.27 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 15.3 t -153.89 141.21 13.46 Favored Pre-proline 0 CA--C 1.541 0.632 0 C-N-CA 127.382 2.273 . . . . 0.0 108.335 172.717 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -68.65 152.95 74.27 Favored 'Trans proline' 0 C--N 1.35 0.631 0 C-N-CA 122.637 2.225 . . . . 0.0 112.708 -171.923 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.15 -16.67 62.37 Favored 'General case' 0 CA--C 1.549 0.942 0 N-CA-C 114.691 1.367 . . . . 0.0 114.691 -174.432 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 12.9 m -67.53 -41.99 83.47 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 127.178 2.191 . . . . 0.0 111.645 -173.31 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 2.2 mtmm 172.86 150.46 0.07 Allowed 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 128.754 2.822 . . . . 0.0 111.485 178.175 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 40.7 ptt180 . . . . . 0 C--O 1.253 1.286 0 C-N-CA 125.382 1.473 . . . . 0.0 113.335 175.744 . . . . . . . . 0 0 . 1 . 048 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.647 0 N-CA-C 112.436 -0.265 . . . . 0.0 112.436 . . . . . . . . . 0 0 . 1 . 048 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 11.0 tp -74.44 -43.55 49.0 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.297 0 N-CA-C 114.031 1.123 . . . . 0.0 114.031 -170.581 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 70.3 t -57.53 -52.87 51.73 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.331 0 C-N-CA 124.622 1.169 . . . . 0.0 110.096 -177.876 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 25.6 pt-20 -66.55 0.76 2.05 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 125.468 1.507 . . . . 0.0 114.968 -179.098 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 17.9 tt0 -115.9 -50.81 2.67 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 119.097 0.862 . . . . 0.0 111.365 168.725 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 58.8 m -60.97 -28.41 68.98 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 114.283 1.216 . . . . 0.0 114.283 -177.565 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 87.8 m -73.1 -31.02 64.08 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 179.331 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 29.4 p -112.05 -44.83 3.37 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 125.579 1.552 . . . . 0.0 112.527 -169.055 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 63.2 m -101.99 168.15 9.59 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 125.908 1.683 . . . . 0.0 111.054 172.854 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 7.0 tt -81.57 132.31 31.82 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 O-C-N 120.822 -1.174 . . . . 0.0 109.151 170.865 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 17.0 p -121.61 158.65 28.14 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.447 1.099 . . . . 0.0 112.441 -176.133 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 34.1 t -98.08 151.93 19.85 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 124.322 1.049 . . . . 0.0 112.763 -173.923 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 39.8 mt -59.68 -29.7 68.26 Favored 'General case' 0 N--CA 1.471 0.585 0 O-C-N 121.632 -0.668 . . . . 0.0 111.46 171.597 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.6 t80 -62.23 -32.36 73.02 Favored 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 113.147 0.795 . . . . 0.0 113.147 172.231 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 64.9 mt-30 -78.08 -34.0 50.48 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 123.617 0.767 . . . . 0.0 111.084 175.558 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 81.5 mt -60.38 -47.88 84.17 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 118.639 0.654 . . . . 0.0 110.753 169.876 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -62.0 -32.32 72.78 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 175.191 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 15.5 t30 -59.23 -33.01 70.49 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 119.464 1.029 . . . . 0.0 113.03 179.446 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 67.6 m-85 -92.99 -0.63 57.16 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.708 1.203 . . . . 0.0 113.925 177.283 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 92.9 m -82.9 154.25 24.69 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 121.249 -0.907 . . . . 0.0 112.907 173.131 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.25 1.082 0 C-N-CA 125.819 1.648 . . . . 0.0 112.908 -176.646 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 65.8 m-85 . . . . . 0 N--CA 1.488 1.447 0 CA-C-O 118.617 -0.706 . . . . 0.0 109.403 . . . . . . . . . 0 0 . 1 . 048 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 5.9 m -82.58 83.81 1.69 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 CA-C-N 120.149 1.34 . . . . 0.0 110.079 175.127 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 27.9 m120 -124.88 140.71 52.68 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.092 1.357 . . . . 0.0 112.462 -170.869 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -148.06 160.78 42.51 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.45 1.5 . . . . 0.0 111.99 -178.804 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 90.7 m-70 -99.49 130.05 45.71 Favored 'General case' 0 CA--C 1.543 0.673 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 166.506 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 54.3 mt -148.16 136.54 21.41 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 124.89 1.276 . . . . 0.0 110.077 -171.682 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.3 t -147.34 150.8 35.45 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 113.035 0.754 . . . . 0.0 113.035 -178.376 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 53.55 -130.4 42.14 Favored Glycine 0 N--CA 1.469 0.853 0 C-N-CA 124.523 1.059 . . . . 0.0 113.181 173.167 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 39.0 m -59.11 -34.14 71.68 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 123.556 0.742 . . . . 0.0 112.931 -179.365 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 18.1 m-70 -70.41 -32.17 69.69 Favored 'General case' 0 CA--C 1.538 0.483 0 O-C-N 120.621 -1.299 . . . . 0.0 113.172 175.446 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 42.9 tp -69.6 -40.07 76.88 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 118.688 0.676 . . . . 0.0 111.24 171.16 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 78.5 t -60.83 -45.8 97.38 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.078 0 C-N-CA 123.947 0.899 . . . . 0.0 110.911 172.739 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -58.42 -48.17 81.55 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 123.558 0.743 . . . . 0.0 111.4 172.757 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.7 -41.81 99.32 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 123.631 0.772 . . . . 0.0 112.229 -178.655 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 31.0 mt -58.45 -43.97 89.02 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 118.558 0.617 . . . . 0.0 111.412 174.929 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 9.4 m-85 -70.88 -31.9 68.71 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 113.764 1.024 . . . . 0.0 113.764 174.898 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 64.4 mt -71.62 -41.41 68.89 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 119.382 0.992 . . . . 0.0 112.017 175.478 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 54.5 t -73.15 -47.8 45.9 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 C-N-CA 124.527 1.131 . . . . 0.0 111.501 179.97 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 66.8 m -94.73 -10.58 31.19 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 114.815 1.413 . . . . 0.0 114.815 -172.996 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 82.03 -164.53 44.48 Favored Glycine 0 CA--C 1.53 1.001 0 C-N-CA 124.867 1.222 . . . . 0.0 112.836 -177.372 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -61.68 -11.32 11.31 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 114.801 1.408 . . . . 0.0 114.801 -178.601 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 53.6 mtm180 -56.34 -33.49 65.69 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 125.056 1.342 . . . . 0.0 112.878 171.811 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 66.04 -154.51 51.3 Favored Glycine 0 CA--C 1.535 1.299 0 C-N-CA 123.692 0.663 . . . . 0.0 112.07 -172.422 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 54.5 p90 -141.69 155.41 45.67 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.802 1.241 . . . . 0.0 113.276 -172.159 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 75.1 t80 -87.47 -28.53 22.01 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.831 1.252 . . . . 0.0 113.185 -172.939 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 50.7 t80 -62.36 149.45 42.31 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.808 1.243 . . . . 0.0 113.14 179.841 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 13.5 t -111.61 126.12 29.14 Favored Pre-proline 0 N--CA 1.474 0.727 0 C-N-CA 124.216 1.007 . . . . 0.0 109.363 171.359 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -75.47 138.52 22.03 Favored 'Trans proline' 0 N--CA 1.455 -0.753 0 C-N-CA 122.674 2.249 . . . . 0.0 111.31 -171.118 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 18.9 ptmt -69.18 -15.7 63.46 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 113.362 0.875 . . . . 0.0 113.362 176.009 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 5.5 t -101.8 90.61 4.07 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 126.375 1.87 . . . . 0.0 107.831 168.182 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -83.56 132.82 34.89 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 123.601 0.76 . . . . 0.0 111.09 178.444 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 13.8 mtm105 . . . . . 0 N--CA 1.483 1.212 0 C-N-CA 126.488 1.915 . . . . 0.0 111.245 -173.098 . . . . . . . . 0 0 . 1 . 049 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.698 0 N-CA-C 110.71 -0.956 . . . . 0.0 110.71 . . . . . . . . . 0 0 . 1 . 049 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 20.7 tt -56.16 -34.86 40.3 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.13 0 N-CA-C 114.783 1.401 . . . . 0.0 114.783 -170.287 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 74.1 t -59.94 -40.86 84.15 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.028 0 C-N-CA 123.253 0.621 . . . . 0.0 111.166 -175.638 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -81.86 -2.75 52.16 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 113.149 0.796 . . . . 0.0 113.149 -179.509 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 20.8 tt0 -94.55 -58.72 2.11 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 123.56 0.744 . . . . 0.0 109.706 169.351 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 85.8 m -72.19 -30.37 64.9 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 113.962 1.097 . . . . 0.0 113.962 -170.054 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 71.2 m -69.93 -46.45 65.31 Favored 'General case' 0 N--CA 1.473 0.701 0 O-C-N 120.752 -1.218 . . . . 0.0 110.706 173.371 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 21.0 m -76.86 -37.95 54.62 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 126.756 2.023 . . . . 0.0 112.871 -170.084 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.7 t -144.19 -169.19 3.06 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.963 1.305 . . . . 0.0 111.77 -174.897 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 61.2 mt -79.91 127.27 39.37 Favored 'Isoleucine or valine' 0 C--O 1.238 0.448 0 O-C-N 120.818 -1.176 . . . . 0.0 111.707 -172.719 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 4.2 m -112.5 171.33 7.58 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 127.013 2.125 . . . . 0.0 110.832 168.166 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 35.4 t -163.34 163.26 25.22 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 126.422 1.889 . . . . 0.0 108.21 -170.715 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 9.8 mp -56.98 -33.71 67.35 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 119.231 0.923 . . . . 0.0 111.976 -176.092 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 73.2 t80 -61.11 -33.09 72.82 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 124.294 1.038 . . . . 0.0 113.572 173.4 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 36.9 mt-30 -86.8 -32.25 20.44 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 125.196 1.398 . . . . 0.0 111.333 177.682 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 96.1 mt -65.46 -50.56 64.88 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.624 1.17 . . . . 0.0 110.679 173.567 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -66.48 -23.23 66.23 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 113.35 0.87 . . . . 0.0 113.35 179.416 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 19.4 t30 -59.93 -29.74 68.59 Favored 'General case' 0 CA--C 1.545 0.788 0 O-C-N 121.118 -0.989 . . . . 0.0 113.031 177.427 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 51.9 m-85 -94.47 5.5 51.62 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.565 1.546 . . . . 0.0 113.717 176.946 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 75.0 m -101.09 129.1 46.92 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.016 0.927 . . . . 0.0 112.7 -179.646 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.252 1.211 0 C-N-CA 128.086 2.554 . . . . 0.0 112.393 -169.495 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 . . . . . 0 N--CA 1.486 1.338 0 CA-C-O 119.75 -0.167 . . . . 0.0 111.109 . . . . . . . . . 0 0 . 1 . 049 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 88.1 t -78.01 141.12 15.94 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.207 0 C-N-CA 124.721 1.208 . . . . 0.0 109.583 172.437 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 5.8 p-10 -134.0 158.36 43.71 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 124.919 1.288 . . . . 0.0 113.614 -174.427 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 2.6 mm-40 -176.2 -172.7 0.5 Allowed 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 127.417 2.287 . . . . 0.0 108.779 -173.052 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 5.9 m-70 -83.44 -105.37 0.04 OUTLIER 'General case' 0 CA--C 1.549 0.923 0 O-C-N 120.457 -1.402 . . . . 0.0 107.912 166.497 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 57.2 mt 113.17 124.48 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.946 1 C-N-CA 131.879 4.072 . . . . 0.0 109.425 171.478 . . . . . . . . 2 2 . 1 . 049 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 5.8 t -146.31 154.12 41.32 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.194 0.598 . . . . 0.0 112.431 -175.285 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 59.58 -136.29 50.58 Favored Glycine 0 N--CA 1.471 0.99 0 C-N-CA 123.801 0.715 . . . . 0.0 113.278 172.557 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 14.4 p -54.08 -36.99 63.75 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 124.541 1.136 . . . . 0.0 112.988 173.49 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 -69.67 -33.28 72.34 Favored 'General case' 0 CA--C 1.544 0.731 0 O-C-N 121.139 -0.975 . . . . 0.0 112.384 -179.751 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 53.7 tp -68.88 -42.48 76.92 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 118.562 0.619 . . . . 0.0 110.945 171.197 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 60.3 t -59.15 -46.77 91.79 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 C-N-CA 124.053 0.941 . . . . 0.0 111.064 174.488 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -65.69 -41.54 92.29 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 123.703 0.801 . . . . 0.0 112.137 176.679 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.75 -43.74 97.59 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 119.279 0.945 . . . . 0.0 111.529 174.823 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 62.5 mt -64.25 -40.22 95.55 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 118.299 0.499 . . . . 0.0 112.155 177.035 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 7.2 m-85 -58.14 -47.88 81.98 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.107 0.867 . . . . 0.0 111.86 170.744 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 78.5 mt -69.8 -41.63 74.78 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 124.146 0.979 . . . . 0.0 112.661 -177.156 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 60.6 t -76.82 -44.1 32.92 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 C-N-CA 123.754 0.822 . . . . 0.0 111.892 -177.268 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 73.7 m -95.9 -27.56 15.11 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 114.73 1.381 . . . . 0.0 114.73 -172.654 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 66.16 -134.76 34.14 Favored Glycine 0 N--CA 1.469 0.866 0 C-N-CA 124.216 0.913 . . . . 0.0 112.676 176.318 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -63.96 -17.92 63.76 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.248 1.419 . . . . 0.0 113.636 -177.847 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 84.9 mtm180 -61.66 -29.25 69.95 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 179.286 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.59 157.98 9.66 Favored Glycine 0 CA--C 1.534 1.234 0 C-N-CA 124.662 1.125 . . . . 0.0 113.144 -177.862 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 51.6 p90 -137.37 152.55 49.8 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.246 1.418 . . . . 0.0 113.334 -172.078 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 24.7 t80 -105.69 68.94 0.81 Allowed 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.748 1.619 . . . . 0.0 111.282 -179.749 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 50.5 t80 -67.34 117.71 9.7 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.469 1.108 . . . . 0.0 110.975 173.331 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 6.9 t -173.96 151.07 1.72 Allowed Pre-proline 0 N--CA 1.48 1.049 0 C-N-CA 125.637 1.575 . . . . 0.0 112.75 -175.656 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -89.5 -174.39 0.9 Allowed 'Trans proline' 0 CA--C 1.547 1.173 0 C-N-CA 124.493 3.462 . . . . 0.0 109.565 166.661 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 32.1 mtmm -76.85 -25.92 53.71 Favored 'General case' 0 N--CA 1.481 1.075 0 O-C-N 120.282 -1.511 . . . . 0.0 112.43 170.007 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 38.2 p -78.7 -24.41 45.02 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 126.604 1.962 . . . . 0.0 114.292 -170.305 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 60.6 tptt -74.76 112.89 11.43 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 123.633 0.773 . . . . 0.0 111.02 179.024 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 51.1 tpt85 . . . . . 0 C--O 1.252 1.209 0 C-N-CA 126.815 2.046 . . . . 0.0 111.678 -174.169 . . . . . . . . 0 0 . 1 . 050 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.69 0 N-CA-C 110.82 -0.912 . . . . 0.0 110.82 . . . . . . . . . 0 0 . 1 . 050 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 8.1 tp -57.12 -34.28 44.89 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 N-CA-C 114.243 1.201 . . . . 0.0 114.243 -170.196 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 40.1 t -65.22 -47.35 87.77 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 CA-C-N 118.452 0.569 . . . . 0.0 110.845 -179.14 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -64.34 -41.0 97.0 Favored 'General case' 0 CA--C 1.539 0.542 0 O-C-N 121.449 -0.782 . . . . 0.0 111.591 174.098 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 34.6 mt-30 -66.09 -35.74 81.31 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 118.374 -0.822 . . . . 0.0 112.955 -177.472 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 99.7 m -93.4 -31.18 14.73 Favored 'General case' 0 N--CA 1.47 0.525 0 N-CA-C 114.63 1.344 . . . . 0.0 114.63 179.281 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 78.2 m -86.76 -52.75 5.32 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 119.457 1.026 . . . . 0.0 111.602 -177.004 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 27.3 m -83.07 -40.8 19.4 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.731 1.212 . . . . 0.0 110.578 -174.067 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 7.9 t -112.5 -171.85 1.94 Allowed 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.398 1.079 . . . . 0.0 112.039 170.827 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 90.4 mt -96.24 128.68 47.22 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 C-N-CA 126.029 1.732 . . . . 0.0 108.522 175.596 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 21.1 p -107.9 -157.96 0.63 Allowed 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.987 0.915 . . . . 0.0 112.1 178.025 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 92.8 p -155.1 164.53 38.73 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 125.776 1.63 . . . . 0.0 111.387 -179.153 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 44.9 mt -62.01 -33.32 74.13 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 122.957 0.503 . . . . 0.0 111.601 174.381 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 93.2 t80 -63.29 -36.93 85.3 Favored 'General case' 0 CA--C 1.539 0.551 0 O-C-N 121.532 -0.73 . . . . 0.0 112.727 171.409 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -71.86 -34.58 69.34 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 118.757 -0.64 . . . . 0.0 111.739 174.687 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 95.5 mt -59.29 -49.57 77.32 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 119.503 1.047 . . . . 0.0 110.703 169.829 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -61.88 -34.37 75.91 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 113.562 0.949 . . . . 0.0 113.562 176.316 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 15.3 t30 -61.78 -27.78 68.99 Favored 'General case' 0 CA--C 1.546 0.821 0 O-C-N 121.129 -0.982 . . . . 0.0 112.79 177.92 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 66.3 m-85 -104.7 29.34 6.27 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.78 1.632 . . . . 0.0 112.814 176.008 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 93.7 m -125.59 172.97 9.3 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 126.681 1.992 . . . . 0.0 112.635 168.869 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 . . . . . 0 C--O 1.251 1.137 0 C-N-CA 124.551 1.141 . . . . 0.0 112.407 175.97 . . . . . . . . 0 0 . 1 . 050 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 66.3 m-85 . . . . . 0 N--CA 1.488 1.46 0 CA-C-O 118.896 -0.573 . . . . 0.0 109.999 . . . . . . . . . 0 0 . 1 . 050 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 9.1 p -62.28 -28.89 45.45 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.345 0 CA-C-N 120.145 1.338 . . . . 0.0 112.435 174.439 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 28.9 m120 -92.46 144.67 25.13 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.068 1.347 . . . . 0.0 111.94 171.54 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -175.22 167.77 3.4 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 125.699 1.599 . . . . 0.0 111.723 178.326 . . . . . . . . 2 2 . 1 . 050 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 83.8 m-70 -87.51 143.15 27.36 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 124.628 1.171 . . . . 0.0 108.967 166.049 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 73.9 mt -146.63 138.07 24.4 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 125.636 1.574 . . . . 0.0 109.346 174.825 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 1.8 t -150.09 157.6 43.3 Favored 'General case' 0 N--CA 1.469 0.491 0 O-C-N 121.291 -0.881 . . . . 0.0 113.214 176.337 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.99 -136.44 48.07 Favored Glycine 0 CA--C 1.531 1.037 0 C-N-CA 124.741 1.163 . . . . 0.0 113.388 175.038 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 21.0 m -53.58 -37.4 62.92 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.99 0.916 . . . . 0.0 112.69 177.049 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -69.7 -36.13 75.68 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 120.793 -1.192 . . . . 0.0 112.104 179.401 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 65.6 tp -64.59 -47.16 79.71 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 118.684 0.675 . . . . 0.0 110.721 170.579 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 59.0 t -61.78 -44.3 98.57 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 C-N-CA 123.91 0.884 . . . . 0.0 110.942 -179.221 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -64.12 -45.67 87.54 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 118.589 0.631 . . . . 0.0 112.18 174.408 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.94 -44.87 94.89 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 119.39 0.995 . . . . 0.0 111.747 178.388 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 28.0 tp -58.07 -47.01 84.46 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.009 1.324 . . . . 0.0 110.885 177.089 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 8.2 m-30 -63.54 -43.43 97.1 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 123.6 0.76 . . . . 0.0 112.312 176.721 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 73.9 mt -67.95 -39.37 83.41 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 123.719 0.807 . . . . 0.0 112.446 179.029 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 40.8 t -70.15 -45.94 74.13 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 123.972 0.909 . . . . 0.0 111.868 177.897 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 68.8 m -88.93 -21.64 23.48 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 114.831 1.419 . . . . 0.0 114.831 -172.343 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.24 -141.2 45.89 Favored Glycine 0 CA--C 1.53 0.97 0 C-N-CA 124.504 1.05 . . . . 0.0 113.646 170.981 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -66.11 -19.93 66.0 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.083 1.353 . . . . 0.0 113.588 -175.462 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 78.0 mtp85 -62.24 -33.71 75.11 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.827 0.851 . . . . 0.0 112.897 178.068 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.46 161.54 37.31 Favored Glycine 0 CA--C 1.534 1.259 0 C-N-CA 124.685 1.136 . . . . 0.0 113.734 -178.227 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 55.0 p90 -97.52 165.79 11.82 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.881 1.673 . . . . 0.0 112.899 -176.558 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 46.3 t80 -115.94 -36.94 3.99 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 124.82 1.248 . . . . 0.0 111.314 168.74 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 81.0 t80 52.74 98.27 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 127.45 2.3 . . . . 0.0 115.163 169.587 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 92.3 m -111.65 111.17 54.63 Favored Pre-proline 0 N--CA 1.477 0.88 0 C-N-CA 123.953 0.901 . . . . 0.0 110.836 -176.871 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -82.14 -153.21 0.04 OUTLIER 'Trans proline' 0 CA--C 1.539 0.743 0 C-N-CA 124.729 3.619 . . . . 0.0 110.391 169.89 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -51.6 -33.47 33.03 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 124.537 1.135 . . . . 0.0 113.583 170.904 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 25.5 m -134.05 -99.43 0.25 Allowed 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 126.558 1.943 . . . . 0.0 109.135 176.967 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 16.2 tppt? -168.65 -48.52 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 126.046 1.738 . . . . 0.0 111.561 -177.657 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 32.9 ptt-85 . . . . . 0 C--O 1.253 1.264 0 C-N-CA 125.443 1.497 . . . . 0.0 113.085 171.221 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 13.8 tt . . . . . 0 N--CA 1.483 1.188 0 N-CA-C 115.476 1.658 . . . . 0.0 115.476 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 18.2 t -52.14 -41.76 33.88 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 C-N-CA 124.224 1.009 . . . . 0.0 110.647 169.036 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 -70.74 -5.24 28.45 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 179.617 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 52.6 tt0 -104.3 -63.08 1.24 Allowed 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.007 0.923 . . . . 0.0 108.938 168.014 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 68.7 m -59.1 -33.51 70.92 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 113.674 0.99 . . . . 0.0 113.674 -170.15 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 13.6 t -77.75 -26.92 50.23 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 113.371 0.878 . . . . 0.0 113.371 -172.358 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 28.5 p -116.2 -35.05 4.47 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 125.718 1.607 . . . . 0.0 112.962 -175.611 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 9.0 t -113.95 -169.04 1.44 Allowed 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 126.449 1.9 . . . . 0.0 110.601 174.932 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 33.8 mm -92.39 145.55 7.45 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 C-N-CA 125.021 1.328 . . . . 0.0 110.456 179.543 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 15.6 p -141.64 176.84 8.58 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.776 1.23 . . . . 0.0 111.234 169.241 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 91.2 p -153.1 164.0 38.82 Favored 'General case' 0 N--CA 1.47 0.549 0 O-C-N 121.075 -1.016 . . . . 0.0 112.918 -169.661 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 21.5 mt -57.18 -37.13 71.68 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 123.945 0.898 . . . . 0.0 112.599 -173.661 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 87.2 t80 -62.05 -28.37 69.55 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.144 0.978 . . . . 0.0 113.475 175.381 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 46.8 mt-30 -87.5 -29.8 21.09 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.398 1.079 . . . . 0.0 111.04 176.141 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 72.5 mt -67.1 -38.17 85.2 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.969 0.908 . . . . 0.0 112.325 170.536 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -52.82 -31.59 39.71 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.743 1.217 . . . . 0.0 113.392 174.297 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -62.97 -19.32 64.19 Favored 'General case' 0 CA--C 1.548 0.886 0 N-CA-C 113.653 0.983 . . . . 0.0 113.653 178.894 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 95.4 m-85 -107.57 2.94 24.39 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.747 1.619 . . . . 0.0 113.937 -178.184 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 98.7 m -72.0 141.66 49.35 Favored 'General case' 0 CA--C 1.537 0.461 0 O-C-N 121.148 -0.97 . . . . 0.0 113.005 177.029 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 34.5 t30 . . . . . 0 C--O 1.252 1.208 0 C-N-CA 125.458 1.503 . . . . 0.0 111.327 171.566 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 37.9 t80 . . . . . 0 N--CA 1.49 1.573 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 24.3 t 79.27 -51.33 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 C-N-CA 128.404 2.682 . . . . 0.0 112.645 175.0 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -141.3 111.21 6.61 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 126.738 2.015 . . . . 0.0 107.896 175.997 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -170.86 174.73 4.73 Favored 'General case' 0 CA--C 1.543 0.695 0 O-C-N 121.496 -0.753 . . . . 0.0 111.949 -166.043 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 94.4 m-70 -81.41 142.2 33.2 Favored 'General case' 0 CA--C 1.55 0.968 0 N-CA-C 107.283 -1.377 . . . . 0.0 107.283 163.767 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 87.4 mt -145.09 135.98 24.66 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 125.819 1.648 . . . . 0.0 110.495 178.327 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.5 t -149.66 145.48 26.75 Favored 'General case' 0 N--CA 1.471 0.608 0 O-C-N 120.865 -1.147 . . . . 0.0 113.235 178.422 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 59.95 -126.68 42.38 Favored Glycine 0 CA--C 1.528 0.862 0 C-N-CA 124.49 1.043 . . . . 0.0 112.77 176.492 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 20.3 p -52.34 -40.79 62.38 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 124.884 1.274 . . . . 0.0 113.021 176.193 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 27.6 m80 -62.93 -42.27 99.75 Favored 'General case' 0 CA--C 1.543 0.687 0 O-C-N 121.206 -0.934 . . . . 0.0 111.66 178.855 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 48.6 tp -69.03 -41.36 77.81 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 124.085 0.954 . . . . 0.0 111.376 176.654 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 37.8 t -62.15 -44.71 99.38 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 C-N-CA 124.513 1.125 . . . . 0.0 111.267 175.407 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -66.59 -40.07 88.73 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 118.426 0.557 . . . . 0.0 111.977 175.262 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.48 -41.82 99.06 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 119.55 1.068 . . . . 0.0 111.938 174.958 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 43.2 mt -59.05 -47.17 86.22 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-O 118.818 -0.611 . . . . 0.0 111.046 171.754 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 24.2 m-85 -62.93 -33.89 76.29 Favored 'General case' 0 CA--C 1.545 0.762 0 CA-C-N 120.01 1.277 . . . . 0.0 113.711 175.359 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 70.2 mt -67.24 -42.44 83.96 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 119.395 0.998 . . . . 0.0 112.054 173.051 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 55.5 t -73.52 -46.67 47.95 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 C-N-CA 123.793 0.837 . . . . 0.0 112.097 -179.462 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 33.6 m -85.37 -18.56 33.39 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 113.758 1.022 . . . . 0.0 113.758 -174.064 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 70.55 -155.22 52.88 Favored Glycine 0 CA--C 1.531 1.067 0 C-N-CA 124.709 1.147 . . . . 0.0 112.434 -174.521 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -61.72 -21.12 64.23 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.072 1.349 . . . . 0.0 113.275 -178.733 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 76.9 mtp85 -62.7 -28.18 69.77 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.22 1.008 . . . . 0.0 113.297 175.051 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.86 -166.48 53.27 Favored Glycine 0 CA--C 1.533 1.193 0 C-N-CA 124.942 1.258 . . . . 0.0 113.801 -178.975 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 44.1 p90 -121.63 148.42 44.58 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 126.025 1.73 . . . . 0.0 111.411 -179.058 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 27.4 p90 -85.83 -13.75 47.11 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 113.299 0.851 . . . . 0.0 113.299 175.862 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 71.8 t80 -63.98 154.41 34.2 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 126.081 1.752 . . . . 0.0 114.39 -177.622 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 26.3 p -132.63 134.69 25.02 Favored Pre-proline 0 N--CA 1.477 0.914 0 C-N-CA 126.382 1.873 . . . . 0.0 108.31 170.874 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -63.12 101.42 0.28 Allowed 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 124.371 3.381 . . . . 0.0 112.891 -168.598 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . 0.311 61.5 pttt . . . . . 0 CA--C 1.549 0.94 0 C-N-CA 127.849 2.46 . . . . 0.0 116.83 -174.145 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 20.3 tt . . . . . 0 N--CA 1.488 1.453 0 N-CA-C 115.656 1.725 . . . . 0.0 115.656 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' VAL . . . . . 0.465 HG12 ' H ' ' B' ' 29' ' ' LYS . 6.4 p -62.32 -23.46 32.15 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.141 0 C-N-CA 124.124 0.969 . . . . 0.0 112.754 177.226 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -76.04 0.72 17.67 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.224 1.409 . . . . 0.0 112.508 175.336 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 63.4 tp60 -117.93 -54.71 2.31 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 125.042 1.337 . . . . 0.0 109.025 166.868 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 22.8 m -67.72 -26.1 65.99 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 115.419 1.637 . . . . 0.0 115.419 -170.713 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 37.7 t -103.0 -41.95 5.96 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 119.112 0.869 . . . . 0.0 113.085 -176.547 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 24.1 p -71.42 -33.2 69.22 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 125.986 1.715 . . . . 0.0 112.169 176.359 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.8 t -134.42 -157.81 0.83 Allowed 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.957 1.703 . . . . 0.0 109.606 173.509 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 86.4 mt -100.14 150.11 5.62 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 C-N-CA 125.887 1.675 . . . . 0.0 110.847 -176.003 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.1 p -143.42 -164.02 1.77 Allowed 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 124.148 0.979 . . . . 0.0 112.233 169.387 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 26.5 t -154.84 151.76 28.99 Favored 'General case' 0 N--CA 1.469 0.494 0 O-C-N 120.727 -1.233 . . . . 0.0 111.59 -171.98 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 62.6 mt -60.77 -28.52 68.8 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.888 0.875 . . . . 0.0 112.22 178.641 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 68.6 t80 -62.15 -31.05 71.49 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.529 1.132 . . . . 0.0 113.049 172.363 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 65.6 mt-30 -81.54 -35.26 30.52 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 123.736 0.814 . . . . 0.0 110.842 175.328 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 17.8 mt -58.71 -41.18 85.71 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 118.924 0.784 . . . . 0.0 111.464 172.787 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -56.3 -28.46 58.85 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.865 1.666 . . . . 0.0 114.167 176.776 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 15.2 t-20 -66.11 -22.26 66.39 Favored 'General case' 0 CA--C 1.547 0.829 0 O-C-N 121.264 -0.898 . . . . 0.0 112.917 176.658 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 56.7 m-85 -100.88 4.91 43.12 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.404 1.482 . . . . 0.0 113.655 -178.971 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 77.9 m -73.76 168.35 19.56 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.172 0.989 . . . . 0.0 112.897 171.818 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.248 0.989 0 C-N-CA 125.86 1.664 . . . . 0.0 111.966 -178.863 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 . . . . . 0 N--CA 1.483 1.194 0 CA-C-O 118.313 -0.851 . . . . 0.0 111.078 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 92.5 t -78.72 -39.39 22.61 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.252 0 CA-C-N 120.525 1.511 . . . . 0.0 111.488 -177.897 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 2.3 t30 59.23 75.05 0.42 Allowed 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 125.564 1.546 . . . . 0.0 112.525 169.145 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -149.51 160.79 43.18 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 124.428 1.091 . . . . 0.0 111.93 -178.146 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 98.0 m-70 -85.02 140.9 30.68 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.494 1.117 . . . . 0.0 111.214 170.833 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 62.0 mt -141.57 137.1 31.71 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 125.941 1.696 . . . . 0.0 110.112 174.918 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 1.8 t -140.16 143.67 36.27 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 113.132 0.79 . . . . 0.0 113.132 -175.056 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 49.91 -123.03 12.67 Favored Glycine 0 N--CA 1.469 0.896 0 C-N-CA 125.232 1.396 . . . . 0.0 114.175 169.432 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.1 p -56.28 -36.46 68.63 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 124.908 1.283 . . . . 0.0 113.048 177.242 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -73.14 -32.51 64.95 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 120.736 -1.227 . . . . 0.0 112.035 178.235 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 41.9 tp -70.74 -43.3 69.13 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.918 0.887 . . . . 0.0 111.475 172.733 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 39.1 t -59.89 -43.78 92.85 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 C-N-CA 124.497 1.119 . . . . 0.0 110.911 172.524 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -64.08 -43.66 94.76 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.598 0.759 . . . . 0.0 111.088 175.477 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.93 -41.68 99.56 Favored 'General case' 0 CA--C 1.54 0.589 0 O-C-N 121.329 -0.857 . . . . 0.0 112.249 177.009 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 21.6 mt -60.06 -46.38 89.74 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 118.547 0.612 . . . . 0.0 110.662 173.126 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 19.3 m-85 -62.05 -35.72 79.45 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 120.936 -1.102 . . . . 0.0 113.69 173.525 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 62.5 mt -70.24 -41.57 73.37 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 119.49 1.041 . . . . 0.0 111.999 176.091 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 63.0 t -71.7 -42.36 70.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 C-N-CA 123.578 0.751 . . . . 0.0 111.702 179.407 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 36.7 m -86.41 -15.21 41.01 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 114.328 1.233 . . . . 0.0 114.328 -178.144 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 72.9 -162.01 54.61 Favored Glycine 0 CA--C 1.534 1.262 0 C-N-CA 124.963 1.268 . . . . 0.0 112.781 -174.076 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -58.61 -20.72 49.83 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 125.033 1.333 . . . . 0.0 113.354 179.04 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 73.6 mtp85 -61.66 -24.16 66.55 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 125.483 1.513 . . . . 0.0 113.302 175.335 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.42 -178.45 44.76 Favored Glycine 0 CA--C 1.529 0.951 0 C-N-CA 124.74 1.162 . . . . 0.0 113.81 -179.164 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 55.3 p90 -119.01 156.54 29.44 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 125.399 1.48 . . . . 0.0 111.932 -178.671 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 84.6 t80 -91.38 -40.12 11.63 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.328 1.051 . . . . 0.0 113.042 -177.739 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 8.2 t80 -87.85 112.74 22.81 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 114.162 1.171 . . . . 0.0 114.162 -169.028 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 6.6 t -72.4 144.05 86.21 Favored Pre-proline 0 N--CA 1.476 0.84 0 C-N-CA 124.891 1.276 . . . . 0.0 111.275 179.183 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -73.99 167.03 28.21 Favored 'Trans proline' 0 CA--C 1.537 0.667 0 C-N-CA 123.086 2.524 . . . . 0.0 111.101 169.84 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 29' ' ' LYS . . . . . 0.465 ' H ' HG12 ' A' ' 3' ' ' VAL . 16.1 tptm . . . . . 0 CA--C 1.547 0.865 0 O-C-N 121.217 -0.927 . . . . 0.0 113.093 178.225 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.484 1.228 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 9.5 p -66.0 -36.69 78.08 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 N-CA-C 112.976 0.732 . . . . 0.0 112.976 -179.253 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 46.8 mp0 -68.6 -45.78 71.07 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 119.158 0.89 . . . . 0.0 110.759 169.836 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 22.5 tt0 -61.18 -49.99 74.96 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.397 1.079 . . . . 0.0 112.165 -172.87 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 1.5 m -68.99 -17.98 64.0 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 113.726 1.01 . . . . 0.0 113.726 176.503 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 48.7 t -98.83 -42.27 7.25 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 119.245 0.929 . . . . 0.0 113.214 -174.667 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 1.9 t -73.6 -26.56 60.86 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 125.352 1.461 . . . . 0.0 112.712 -179.5 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.5 t -137.34 -173.05 3.36 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 125.475 1.51 . . . . 0.0 110.821 174.525 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 63.0 mt -82.44 139.49 17.77 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 C-N-CA 124.748 1.219 . . . . 0.0 110.462 176.831 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 16.5 p -129.99 158.07 40.58 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.332 1.053 . . . . 0.0 111.558 168.831 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 22.6 t -108.63 154.96 21.24 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 124.424 1.09 . . . . 0.0 113.904 -169.714 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.529 HD22 ' H ' ' A' ' 13' ' ' LEU . 2.1 mm? -58.52 -31.15 67.64 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.32 1.048 . . . . 0.0 111.462 174.052 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 90.1 t80 -62.1 -33.07 73.74 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.081 0.952 . . . . 0.0 112.98 173.384 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 57.4 mt-30 -76.23 -42.14 46.93 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 123.433 0.693 . . . . 0.0 109.886 174.613 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 81.3 mt -59.14 -41.96 89.52 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 118.455 0.571 . . . . 0.0 111.876 174.668 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 23.5 mt-10 -63.51 -32.53 74.01 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 171.864 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.4 t-20 -69.95 -23.51 63.2 Favored 'General case' 0 CA--C 1.546 0.819 0 CA-C-N 119.038 0.836 . . . . 0.0 112.772 173.067 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 13.2 m-85 -86.94 -11.04 51.79 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 124.897 1.279 . . . . 0.0 113.614 174.869 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 61.3 m -63.1 151.35 40.3 Favored 'General case' 0 N--CA 1.47 0.549 0 O-C-N 120.988 -1.07 . . . . 0.0 111.68 169.996 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 . . . . . 0 C--O 1.252 1.215 0 C-N-CA 125.072 1.349 . . . . 0.0 112.618 179.383 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 77.7 m-85 . . . . . 0 N--CA 1.486 1.349 0 CA-C-O 118.94 -0.553 . . . . 0.0 112.43 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 27.4 m -129.39 -167.48 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.126 0 C-N-CA 125.816 1.646 . . . . 0.0 110.092 -179.024 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 17.8 p-10 -60.82 117.58 5.59 Favored 'General case' 0 CA--C 1.545 0.773 0 O-C-N 121.183 -0.948 . . . . 0.0 110.484 169.755 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 36.9 mt-30 -146.6 174.95 10.96 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.422 1.489 . . . . 0.0 111.333 -167.875 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 38.4 m-70 -79.51 135.01 36.52 Favored 'General case' 0 CA--C 1.545 0.776 0 O-C-N 121.366 -0.834 . . . . 0.0 109.249 167.373 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 82.7 mt -136.9 121.16 17.98 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 125.931 1.692 . . . . 0.0 109.688 178.215 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 80.9 m -121.19 132.87 55.09 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.772 1.229 . . . . 0.0 111.957 -174.932 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 50.28 -117.99 5.55 Favored Glycine 0 N--CA 1.476 1.307 0 C-N-CA 125.349 1.452 . . . . 0.0 114.838 168.827 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.1 p -53.85 -39.58 65.75 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 125.221 1.408 . . . . 0.0 112.91 176.678 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -69.67 -34.29 73.76 Favored 'General case' 0 CA--C 1.54 0.586 0 O-C-N 121.098 -1.001 . . . . 0.0 111.826 178.599 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 59.9 tp -68.89 -44.17 73.76 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 123.574 0.75 . . . . 0.0 111.69 172.19 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 47.6 t -60.87 -43.53 95.84 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 C-N-CA 123.948 0.899 . . . . 0.0 110.741 175.895 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 29.1 mm-40 -64.79 -41.54 95.75 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.434 0.694 . . . . 0.0 112.062 174.083 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.45 -40.75 97.63 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 119.293 0.952 . . . . 0.0 112.047 175.298 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 43.0 mt -61.22 -43.31 99.08 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.568 0.747 . . . . 0.0 111.608 173.84 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 20.1 m-85 -61.49 -42.65 99.11 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 119.635 1.107 . . . . 0.0 112.327 172.44 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 70.4 mt -67.51 -41.57 84.21 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.933 0.893 . . . . 0.0 112.466 179.489 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 51.5 t -73.1 -47.3 48.18 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 C-N-CA 123.962 0.905 . . . . 0.0 111.478 179.441 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 65.7 m -81.67 -30.11 32.83 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 113.621 0.971 . . . . 0.0 113.621 -174.383 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 66.66 -134.43 32.69 Favored Glycine 0 CA--C 1.527 0.814 0 C-N-CA 124.056 0.836 . . . . 0.0 111.127 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 2.5 pm0 -68.24 -13.94 62.62 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 114.229 1.196 . . . . 0.0 114.229 178.08 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 84.3 mtm180 -65.25 -36.2 83.4 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.943 0.897 . . . . 0.0 112.77 179.045 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.83 177.92 40.06 Favored Glycine 0 CA--C 1.535 1.282 0 C-N-CA 124.154 0.883 . . . . 0.0 112.609 -170.573 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 51.6 p90 -153.37 161.93 41.81 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 114.419 1.266 . . . . 0.0 114.419 -171.462 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -96.39 144.04 26.89 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.634 1.574 . . . . 0.0 110.11 168.815 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 69.6 t80 -161.28 142.67 11.58 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.882 1.273 . . . . 0.0 111.365 -174.526 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 40.4 p -126.59 108.57 23.13 Favored Pre-proline 0 C--O 1.239 0.512 0 C-N-CA 125.118 1.367 . . . . 0.0 110.903 179.79 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -67.89 106.2 1.27 Allowed 'Trans proline' 0 N--CA 1.457 -0.665 0 C-N-CA 121.82 1.68 . . . . 0.0 108.117 168.161 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 21.6 ttmm . . . . . 0 N--CA 1.472 0.653 0 C-N-CA 129.076 2.95 . . . . 0.0 114.281 -176.531 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 2' ' ' ILE . . . . . 0.463 ' N ' ' HG1' ' B' ' 27' ' ' THR . 10.4 tp . . . . . 0 N--CA 1.48 1.044 0 CA-C-O 118.898 -0.572 . . . . 0.0 112.485 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 96.0 t -63.11 -51.88 66.02 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 CA-C-N 118.519 0.6 . . . . 0.0 110.541 174.865 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -53.21 -48.15 68.37 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 123.571 0.748 . . . . 0.0 111.067 173.036 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 42.1 tp60 -65.64 -55.18 18.91 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.886 0.875 . . . . 0.0 111.354 -172.358 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 72.0 m -69.47 -26.45 64.58 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 -178.014 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 84.9 m -71.88 -50.44 29.3 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 119.453 1.024 . . . . 0.0 111.17 171.802 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -79.93 -19.34 48.29 Favored 'General case' 0 N--CA 1.478 0.965 0 N-CA-C 114.065 1.135 . . . . 0.0 114.065 -172.291 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 95.8 p -149.82 168.93 22.31 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.254 1.022 . . . . 0.0 113.09 -173.406 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 53.2 mt -69.63 125.27 27.34 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 O-C-N 121.244 -0.91 . . . . 0.0 109.504 170.848 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 15.3 p -117.13 -159.9 0.75 Allowed 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.693 1.197 . . . . 0.0 110.411 170.427 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 6.7 t -157.19 168.76 26.46 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 120.209 -1.557 . . . . 0.0 111.481 175.161 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 52.0 mt -63.28 -27.46 69.35 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.685 1.194 . . . . 0.0 112.839 -174.929 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.2 t80 -63.73 -32.43 73.93 Favored 'General case' 0 CA--C 1.546 0.79 0 O-C-N 121.282 -0.886 . . . . 0.0 113.081 169.874 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 44.6 mm-40 -75.07 -23.57 58.07 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 123.569 0.748 . . . . 0.0 111.245 175.701 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 30.5 mt -77.06 -48.29 18.26 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 123.892 0.877 . . . . 0.0 110.817 172.679 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 -63.11 -22.72 67.05 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 113.639 0.977 . . . . 0.0 113.639 178.026 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 16.8 t30 -54.48 -29.4 49.84 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 123.929 0.892 . . . . 0.0 112.856 169.964 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 97.3 m-85 -100.8 7.45 43.75 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.316 1.446 . . . . 0.0 113.429 176.807 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 22.8 t -89.76 167.78 12.61 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.885 1.274 . . . . 0.0 111.782 170.029 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 21.7 m-80 . . . . . 0 C--O 1.252 1.192 0 C-N-CA 125.136 1.374 . . . . 0.0 112.561 173.253 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 65.6 m-85 . . . . . 0 N--CA 1.487 1.413 0 N-CA-C 110.779 -0.082 . . . . 0.0 110.779 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 76.2 t -68.62 142.31 16.41 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.239 0 C-N-CA 124.438 1.095 . . . . 0.0 110.606 -179.627 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 6.4 t-20 65.08 64.55 0.62 Allowed 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 126.114 1.766 . . . . 0.0 112.679 173.425 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 47.4 mt-30 -143.33 -170.68 3.33 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 126.037 1.735 . . . . 0.0 110.308 -179.139 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 23.6 m-70 -73.7 146.24 44.59 Favored 'General case' 0 CA--C 1.545 0.761 0 O-C-N 120.897 -1.127 . . . . 0.0 109.815 167.025 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 62.9 mt -143.82 125.56 15.1 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 126.001 1.72 . . . . 0.0 109.072 174.713 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 5.6 t -137.99 149.91 46.53 Favored 'General case' 0 CA--C 1.537 0.475 0 O-C-N 121.275 -0.89 . . . . 0.0 112.993 -176.719 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 54.29 -130.46 44.7 Favored Glycine 0 N--CA 1.468 0.827 0 C-N-CA 125.028 1.299 . . . . 0.0 113.572 174.132 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.9 m -56.54 -32.02 64.71 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.306 1.043 . . . . 0.0 113.128 179.141 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -73.07 -35.91 66.76 Favored 'General case' 0 CA--C 1.543 0.696 0 O-C-N 120.862 -1.149 . . . . 0.0 112.024 177.576 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 58.9 tp -67.25 -44.89 78.29 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 123.66 0.784 . . . . 0.0 110.943 172.106 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 58.3 t -61.45 -42.46 93.94 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 123.907 0.883 . . . . 0.0 110.902 176.006 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -62.67 -44.55 95.96 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 123.329 0.652 . . . . 0.0 112.052 173.687 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.33 -40.47 96.47 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 118.784 0.72 . . . . 0.0 112.22 175.757 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 16.0 mt -59.71 -44.5 93.69 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.025 0.93 . . . . 0.0 111.774 172.68 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 20.7 m-85 -62.93 -40.66 98.32 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 119.499 1.045 . . . . 0.0 112.993 173.322 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 78.7 mt -66.92 -41.97 86.18 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.676 0.79 . . . . 0.0 112.556 177.128 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 38.9 t -71.73 -48.44 51.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 C-N-CA 124.482 1.113 . . . . 0.0 111.949 178.779 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 28.0 t -86.84 -37.24 17.93 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 113.31 0.856 . . . . 0.0 113.31 -170.124 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 69.63 -146.0 42.96 Favored Glycine 0 CA--C 1.533 1.187 0 C-N-CA 124.201 0.905 . . . . 0.0 112.097 -177.264 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -65.44 -15.63 62.82 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 125.136 1.375 . . . . 0.0 113.44 -178.805 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 80.1 mtm180 -60.83 -29.95 69.8 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.886 1.274 . . . . 0.0 113.734 -178.591 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 80.52 138.91 2.19 Favored Glycine 0 N--CA 1.472 1.077 0 C-N-CA 125.249 1.405 . . . . 0.0 113.336 178.875 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 44.2 p90 -118.75 153.24 34.74 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 125.284 1.434 . . . . 0.0 113.232 -178.057 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 26.3 p90 -120.31 37.96 4.11 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 127.844 2.458 . . . . 0.0 111.227 -177.016 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -49.34 142.16 7.88 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 125.87 1.668 . . . . 0.0 114.231 -178.892 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 27' ' ' THR . . . . . 0.463 ' HG1' ' N ' ' A' ' 2' ' ' ILE . 11.2 p -93.13 111.09 50.15 Favored Pre-proline 0 N--CA 1.474 0.766 0 C-N-CA 125.233 1.413 . . . . 0.0 112.806 -175.442 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_endo -79.62 161.08 25.01 Favored 'Trans proline' 0 C--N 1.353 0.807 0 C-N-CA 123.758 2.972 . . . . 0.0 110.597 169.35 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 43.5 tptt . . . . . 0 CA--C 1.549 0.908 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 -178.539 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 15.1 tt . . . . . 0 N--CA 1.486 1.366 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 7.1 p -65.56 -23.43 32.69 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.76 0 C-N-CA 124.511 1.124 . . . . 0.0 112.95 -177.661 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 26.0 pm0 -68.96 -11.53 60.8 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.338 1.455 . . . . 0.0 113.951 169.807 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 71.6 tp60 -105.92 -45.96 4.23 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 124.056 0.943 . . . . 0.0 110.542 169.454 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 54.4 m -79.33 -29.25 42.2 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 115.907 1.817 . . . . 0.0 115.907 -171.586 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 42.0 t -98.46 -56.92 2.32 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 119.86 1.209 . . . . 0.0 113.113 -173.436 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 17.0 p -66.47 -46.81 75.12 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.103 1.361 . . . . 0.0 111.074 178.892 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.9 t -102.15 -161.24 0.84 Allowed 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 124.771 1.228 . . . . 0.0 110.59 168.548 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 49.4 mt -110.01 150.16 12.71 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 C-N-CA 126.59 1.956 . . . . 0.0 110.28 -179.541 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 12.2 p -141.34 158.77 43.43 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 114.571 1.322 . . . . 0.0 114.571 174.153 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 78.6 p -98.3 167.59 10.76 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 126.195 1.798 . . . . 0.0 113.478 175.696 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 31.4 mt -65.0 -27.63 68.96 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 121.356 -0.84 . . . . 0.0 112.053 173.644 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.5 t80 -67.02 -34.74 78.38 Favored 'General case' 0 CA--C 1.542 0.643 0 O-C-N 121.449 -0.782 . . . . 0.0 112.253 171.456 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 81.7 mt-30 -73.39 -26.5 61.01 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 118.746 -0.645 . . . . 0.0 112.073 172.873 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 68.7 mt -68.61 -49.45 59.18 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 119.47 1.032 . . . . 0.0 110.523 168.404 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 18.1 mm-40 -56.35 -30.56 62.78 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.71 1.204 . . . . 0.0 113.256 175.729 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -59.45 -24.19 63.34 Favored 'General case' 0 CA--C 1.55 0.945 0 N-CA-C 113.68 0.993 . . . . 0.0 113.68 178.549 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 78.8 m-85 -100.48 -2.46 33.09 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.224 1.41 . . . . 0.0 114.037 175.462 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 75.1 m -86.99 153.62 21.42 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 121.03 -1.044 . . . . 0.0 113.506 179.395 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 31.6 m120 . . . . . 0 C--O 1.253 1.244 0 C-N-CA 125.277 1.431 . . . . 0.0 113.241 179.46 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 22.8 p90 . . . . . 0 N--CA 1.486 1.339 0 CA-C-O 119.471 -0.3 . . . . 0.0 110.78 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 34.8 m -66.29 -21.36 28.61 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.325 0 N-CA-C 114.757 1.391 . . . . 0.0 114.757 -171.103 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 22.0 t-20 -73.96 111.63 9.31 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 169.358 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -162.97 -179.07 6.48 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 113.158 0.799 . . . . 0.0 113.158 -167.915 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 89.0 m-70 -81.95 136.76 35.26 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 123.502 0.721 . . . . 0.0 110.719 168.588 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 65.7 mt -142.04 135.02 28.79 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 126.411 1.884 . . . . 0.0 108.872 173.697 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 1.3 t -139.32 145.27 38.87 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 112.878 0.696 . . . . 0.0 112.878 -174.767 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 48.57 -123.34 10.1 Favored Glycine 0 N--CA 1.47 0.948 0 C-N-CA 125.197 1.38 . . . . 0.0 114.146 170.071 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 18.3 m -54.9 -36.74 65.49 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 124.606 1.162 . . . . 0.0 113.393 178.409 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 73.4 m-70 -76.62 -29.41 56.47 Favored 'General case' 0 CA--C 1.538 0.486 0 O-C-N 120.777 -1.202 . . . . 0.0 112.693 177.875 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 39.4 tp -69.81 -44.59 69.7 Favored 'General case' 0 N--CA 1.468 0.431 0 O-C-N 121.658 -0.651 . . . . 0.0 111.304 170.483 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 42.7 t -60.15 -44.26 94.85 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 125.15 1.38 . . . . 0.0 111.141 173.036 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -59.98 -46.78 88.32 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.993 1.317 . . . . 0.0 111.866 173.305 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.47 -43.03 99.8 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 118.942 0.792 . . . . 0.0 112.093 177.082 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 29.0 mt -58.35 -45.01 89.01 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 123.617 0.767 . . . . 0.0 111.366 174.73 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 11.5 m-85 -61.8 -44.67 96.4 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 123.243 0.617 . . . . 0.0 112.436 173.686 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 73.3 mt -68.14 -41.56 81.46 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 123.852 0.861 . . . . 0.0 112.52 -178.515 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 65.6 t -72.14 -48.79 47.59 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 C-N-CA 123.658 0.783 . . . . 0.0 111.527 -179.461 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 71.3 m -96.97 -17.24 20.2 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 115.013 1.486 . . . . 0.0 115.013 -169.487 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 67.76 -145.48 45.29 Favored Glycine 0 CA--C 1.53 1.017 0 C-N-CA 124.533 1.064 . . . . 0.0 113.834 172.585 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -61.06 -20.4 62.52 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.363 1.465 . . . . 0.0 113.906 -176.114 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 40.4 mtp180 -56.23 -38.53 71.2 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.032 1.333 . . . . 0.0 112.973 177.262 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.38 175.48 45.42 Favored Glycine 0 CA--C 1.535 1.337 0 C-N-CA 124.729 1.156 . . . . 0.0 113.618 -176.002 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 51.9 p90 -153.1 160.87 42.97 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.315 1.446 . . . . 0.0 113.865 -172.794 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 70.7 t80 -89.06 146.24 24.96 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.607 1.563 . . . . 0.0 110.937 170.038 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 56.4 t80 -155.26 129.36 8.81 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.846 0.858 . . . . 0.0 112.412 -178.482 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 21.3 p -146.49 159.16 45.54 Favored Pre-proline 0 N--CA 1.477 0.899 0 C-N-CA 126.739 2.015 . . . . 0.0 110.343 176.374 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -74.56 -179.83 5.22 Favored 'Trans proline' 0 C--N 1.351 0.699 0 C-N-CA 123.767 2.978 . . . . 0.0 112.202 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 48.5 mtmt . . . . . 0 N--CA 1.477 0.888 0 C-N-CA 124.811 1.244 . . . . 0.0 113.544 -179.367 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 14.1 tt . . . . . 0 N--CA 1.481 1.114 0 N-CA-C 114.072 1.138 . . . . 0.0 114.072 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 50.5 t -62.93 -38.19 81.27 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.32 0 CA-C-N 119.488 1.04 . . . . 0.0 111.184 -175.181 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.1 pm0 -67.22 -7.61 25.28 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 114.105 1.15 . . . . 0.0 114.105 176.641 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 13.2 tp60 -105.6 -56.76 2.13 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.295 1.038 . . . . 0.0 110.224 168.921 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 19.2 m -77.29 -25.37 51.29 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 115.025 1.491 . . . . 0.0 115.025 -170.559 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 34.2 t -96.31 -42.37 8.18 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 119.569 1.077 . . . . 0.0 111.807 178.043 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 33.7 m -62.74 -37.89 88.36 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 125.263 1.425 . . . . 0.0 112.153 176.924 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.9 t -138.22 -170.49 2.82 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.587 1.155 . . . . 0.0 110.952 178.54 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 55.2 mt -79.0 139.87 17.73 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 C-N-CA 124.713 1.205 . . . . 0.0 110.089 175.801 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 8.7 p -136.05 157.4 46.93 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 121.907 0.86 . . . . 0.0 113.056 169.986 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.4 m -104.55 164.3 11.85 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 125.168 1.387 . . . . 0.0 111.749 -173.062 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 45.3 mt -56.27 -32.03 64.16 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 121.458 -0.776 . . . . 0.0 112.235 172.177 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.7 t80 -61.58 -29.78 70.24 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 124.113 0.965 . . . . 0.0 113.4 174.221 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 61.6 mm-40 -78.87 -36.43 42.23 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.317 0.647 . . . . 0.0 110.484 175.652 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 87.2 mt -64.13 -43.52 95.03 Favored 'General case' 0 CA--C 1.539 0.546 0 O-C-N 121.813 -0.554 . . . . 0.0 111.467 171.716 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -59.39 -24.19 63.24 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.601 1.56 . . . . 0.0 114.172 173.765 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.4 t30 -77.3 -29.49 53.7 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 123.951 0.901 . . . . 0.0 112.702 176.247 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 27.0 m-85 -86.23 -1.3 57.34 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 124.625 1.17 . . . . 0.0 113.884 175.16 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 57.2 m -73.5 132.2 42.62 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 123.405 0.682 . . . . 0.0 110.36 168.593 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.251 1.161 0 C-N-CA 127.168 2.187 . . . . 0.0 112.765 -172.31 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 12.5 t80 . . . . . 0 N--CA 1.489 1.478 0 CA-C-O 118.757 -0.639 . . . . 0.0 110.301 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 92.1 t -61.67 122.48 12.39 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 CA-C-N 120.224 1.375 . . . . 0.0 111.457 -174.212 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 47.4 t30 -168.27 103.0 0.44 Allowed 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 126.351 1.861 . . . . 0.0 109.312 -174.063 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 3.0 mm-40 -164.21 179.51 6.82 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.802 1.241 . . . . 0.0 111.563 -168.817 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 40.9 m-70 -72.73 138.54 46.61 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 123.775 0.83 . . . . 0.0 110.37 168.173 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 72.6 mt -140.39 126.79 20.03 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 126.925 2.09 . . . . 0.0 109.045 175.613 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 87.4 m -128.0 141.92 51.38 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.61 1.164 . . . . 0.0 112.614 -172.382 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 47.94 -121.04 6.66 Favored Glycine 0 C--N 1.343 0.941 0 C-N-CA 125.273 1.416 . . . . 0.0 114.552 169.11 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 18.1 m -54.65 -37.69 65.99 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.835 1.254 . . . . 0.0 113.105 178.382 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 77.2 m-70 -75.07 -28.52 60.39 Favored 'General case' 0 CA--C 1.543 0.68 0 O-C-N 120.958 -1.089 . . . . 0.0 112.759 176.882 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 28.5 tp -70.08 -43.54 70.94 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 121.353 -0.842 . . . . 0.0 111.371 170.051 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 60.8 t -61.75 -41.8 91.94 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.094 0 C-N-CA 124.348 1.059 . . . . 0.0 110.891 173.009 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -58.35 -49.87 75.69 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.894 1.277 . . . . 0.0 111.49 173.666 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.41 -42.4 96.08 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.532 0.733 . . . . 0.0 111.645 179.454 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 47.0 mt -56.69 -51.11 70.04 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-O 118.661 -0.685 . . . . 0.0 111.349 173.685 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -66.47 -35.18 79.65 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 119.897 1.226 . . . . 0.0 112.271 -178.193 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 83.8 mt -68.95 -41.14 78.44 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 123.611 0.765 . . . . 0.0 112.525 176.422 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 41.9 t -71.5 -46.58 62.82 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.984 0 C-N-CA 123.66 0.784 . . . . 0.0 112.002 177.389 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 72.0 m -78.13 -38.34 44.1 Favored 'General case' 0 N--CA 1.466 0.334 0 N-CA-C 113.306 0.854 . . . . 0.0 113.306 -173.072 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 56.36 -123.71 32.34 Favored Glycine 0 CA--C 1.53 1.013 0 C-N-CA 123.659 0.647 . . . . 0.0 111.912 -179.602 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 3.2 pm0 -67.01 -15.45 63.74 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.671 1.588 . . . . 0.0 114.705 178.374 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 81.8 mtp180 -67.99 -26.22 65.81 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 119.106 0.866 . . . . 0.0 112.732 178.607 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.42 168.69 20.11 Favored Glycine 0 CA--C 1.534 1.229 0 C-N-CA 124.616 1.103 . . . . 0.0 112.245 -169.859 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 34.3 p90 -152.96 165.68 34.78 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 125.026 1.33 . . . . 0.0 112.821 -178.423 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -132.11 104.81 7.0 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 123.933 0.893 . . . . 0.0 110.49 171.141 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 83.7 t80 -73.4 148.98 42.83 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 123.97 0.908 . . . . 0.0 111.394 171.139 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -158.02 115.51 1.81 Allowed Pre-proline 0 N--CA 1.472 0.657 0 C-N-CA 124.997 1.319 . . . . 0.0 109.659 178.694 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_endo -79.71 177.38 8.49 Favored 'Trans proline' 0 CA--C 1.534 0.508 0 C-N-CA 123.982 3.121 . . . . 0.0 112.686 -172.607 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt . . . . . 0 CA--C 1.548 0.901 0 C-N-CA 125.036 1.334 . . . . 0.0 112.605 176.034 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 14.2 tt . . . . . 0 N--CA 1.484 1.252 0 CA-C-O 119.991 -0.052 . . . . 0.0 110.96 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 2.7 t -65.73 -33.11 61.41 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.127 0 C-N-CA 123.556 0.743 . . . . 0.0 111.184 -171.655 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.5 pm0 -68.67 -8.96 47.2 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.961 1.305 . . . . 0.0 113.879 175.318 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 72.0 tp60 -103.72 -58.42 1.88 Allowed 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.108 0.963 . . . . 0.0 108.951 168.208 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 41.8 m -65.86 -31.17 71.97 Favored 'General case' 0 N--CA 1.469 0.486 0 N-CA-C 115.159 1.54 . . . . 0.0 115.159 -170.729 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 48.5 t -96.97 -47.34 5.85 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 119.09 0.859 . . . . 0.0 112.167 -178.398 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 32.1 m -69.95 -31.52 69.29 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 125.496 1.518 . . . . 0.0 111.887 -179.504 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.4 t -133.36 -152.87 0.51 Allowed 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.34 1.456 . . . . 0.0 109.974 172.503 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 78.5 mt -101.34 147.55 8.17 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 C-N-CA 126.522 1.929 . . . . 0.0 109.76 179.283 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.0 p -138.5 160.97 38.21 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 113.103 0.779 . . . . 0.0 113.103 169.252 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 76.6 p -105.74 163.01 13.04 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 125.46 1.504 . . . . 0.0 113.626 -174.811 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 81.6 mt -60.51 -33.24 72.34 Favored 'General case' 0 N--CA 1.471 0.581 0 O-C-N 121.47 -0.769 . . . . 0.0 111.984 170.18 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 91.6 t80 -65.25 -36.17 83.29 Favored 'General case' 0 N--CA 1.47 0.544 0 O-C-N 121.604 -0.685 . . . . 0.0 112.327 174.271 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 87.8 mt-30 -70.18 -40.15 74.81 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 118.563 -0.732 . . . . 0.0 111.054 172.177 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 73.0 mt -58.77 -41.52 86.78 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 119.549 1.068 . . . . 0.0 111.979 172.07 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.4 ' HA ' ' SG ' ' A' ' 20' ' ' CYS . 18.3 mt-10 -63.21 -35.68 81.13 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 113.527 0.936 . . . . 0.0 113.527 171.81 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 26.9 t30 -65.37 -24.07 67.14 Favored 'General case' 0 CA--C 1.547 0.837 0 O-C-N 120.94 -1.1 . . . . 0.0 112.429 174.355 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 47.6 m-85 -90.99 0.71 57.47 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 125.163 1.385 . . . . 0.0 114.056 173.935 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.4 ' SG ' ' HA ' ' A' ' 17' ' ' GLU . 67.2 m -71.74 149.59 45.25 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 120.93 -1.106 . . . . 0.0 111.307 169.172 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 . . . . . 0 C--O 1.251 1.184 0 C-N-CA 125.342 1.457 . . . . 0.0 112.999 -179.569 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 82.0 m-85 . . . . . 0 N--CA 1.486 1.326 0 CA-C-O 119.34 -0.362 . . . . 0.0 111.359 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 22.8 t 73.83 -50.28 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 C-N-CA 128.252 2.621 . . . . 0.0 113.21 172.633 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 3.6 m120 -99.79 134.03 43.28 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.236 1.415 . . . . 0.0 111.362 -178.671 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 2.4 mm-40 -159.75 169.94 22.57 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.977 1.311 . . . . 0.0 112.508 -178.065 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 97.0 m-70 -88.98 135.29 33.63 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.784 1.233 . . . . 0.0 109.372 167.191 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 77.5 mt -143.81 119.46 10.44 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 125.592 1.557 . . . . 0.0 109.521 -177.555 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 86.4 m -123.78 130.79 53.17 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.818 1.247 . . . . 0.0 112.543 -176.468 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 58.83 -121.12 25.54 Favored Glycine 0 N--CA 1.472 1.063 0 C-N-CA 124.815 1.198 . . . . 0.0 113.998 169.243 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 24.1 p -53.47 -43.15 67.92 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 124.437 1.095 . . . . 0.0 112.501 177.182 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 27.4 m80 -61.08 -40.74 94.84 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.313 1.045 . . . . 0.0 112.031 177.428 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 47.3 tp -66.72 -45.91 77.18 Favored 'General case' 0 C--O 1.223 -0.323 0 C-N-CA 124.117 0.967 . . . . 0.0 111.363 174.993 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 68.6 t -62.89 -42.16 95.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 C-N-CA 123.903 0.881 . . . . 0.0 111.241 178.339 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.7 mm-40 -59.01 -52.04 67.48 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.677 0.791 . . . . 0.0 111.216 173.436 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.79 -44.74 89.01 Favored 'General case' 0 CA--C 1.538 0.518 0 O-C-N 121.681 -0.637 . . . . 0.0 111.905 -177.842 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 62.5 tp -58.66 -50.03 75.38 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 125.023 1.329 . . . . 0.0 111.217 178.513 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -68.01 -35.83 78.96 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 119.437 1.017 . . . . 0.0 112.291 179.258 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 78.4 mt -67.47 -36.33 80.93 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 118.864 0.757 . . . . 0.0 112.195 176.129 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 33.4 t -67.04 -45.66 86.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 CA-C-N 118.906 0.776 . . . . 0.0 111.482 171.895 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 72.2 m -73.6 -34.54 65.11 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 113.655 0.983 . . . . 0.0 113.655 -176.763 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 64.49 -130.93 37.84 Favored Glycine 0 CA--C 1.529 0.931 0 C-N-CA 124.142 0.877 . . . . 0.0 111.041 -177.698 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -65.91 -15.25 62.78 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 114.47 1.285 . . . . 0.0 114.47 178.842 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 83.4 mtm180 -66.89 -32.75 74.21 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.21 1.004 . . . . 0.0 113.564 -176.641 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.09 176.63 44.36 Favored Glycine 0 CA--C 1.533 1.204 0 C-N-CA 123.867 0.746 . . . . 0.0 112.212 -169.587 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 45.3 p90 -149.14 159.62 44.08 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 114.881 1.437 . . . . 0.0 114.881 -168.99 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 76.8 t80 -100.35 136.44 40.24 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 126.601 1.961 . . . . 0.0 109.691 169.255 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 64.1 t80 -153.94 122.34 6.18 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.775 0.83 . . . . 0.0 112.283 -179.7 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 9.3 t 170.87 136.17 0.07 OUTLIER Pre-proline 0 N--CA 1.479 1.007 0 C-N-CA 129.316 3.046 . . . . 0.0 109.544 170.811 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -85.24 166.71 10.85 Favored 'Trans proline' 0 CA--C 1.536 0.624 0 C-N-CA 123.628 2.885 . . . . 0.0 112.07 174.857 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 94.0 mttt . . . . . 0 CA--C 1.542 0.651 0 N-CA-C 112.807 0.669 . . . . 0.0 112.807 169.408 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 17.8 tt . . . . . 0 N--CA 1.484 1.256 0 N-CA-C 114.026 1.121 . . . . 0.0 114.026 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 41.9 t -66.77 -32.55 58.53 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.99 0 C-N-CA 123.556 0.742 . . . . 0.0 111.745 -178.342 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -69.25 -48.07 62.89 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.398 0.679 . . . . 0.0 110.498 169.799 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 31.7 tt0 -69.1 -45.63 69.76 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 124.005 0.922 . . . . 0.0 111.979 -169.946 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 61.0 m -64.05 -24.49 67.72 Favored 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 113.617 0.969 . . . . 0.0 113.617 175.475 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 37.3 t -92.95 -42.6 9.38 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 118.746 0.703 . . . . 0.0 112.158 -177.714 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 69.6 p -79.67 -21.95 44.09 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 124.981 1.313 . . . . 0.0 113.64 179.361 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 9.0 t -142.14 -166.89 2.34 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.327 1.451 . . . . 0.0 111.099 175.326 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 71.0 mt -97.76 112.23 29.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 O-C-N 120.57 -1.331 . . . . 0.0 108.172 170.889 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 31.6 p -83.58 156.62 22.66 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 123.694 0.798 . . . . 0.0 111.298 171.036 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 48.7 m -83.59 149.64 26.43 Favored 'General case' 0 N--CA 1.471 0.613 0 O-C-N 120.747 -1.221 . . . . 0.0 111.72 -178.118 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 74.2 mt -60.81 -26.71 67.5 Favored 'General case' 0 CA--C 1.546 0.801 0 O-C-N 121.048 -1.032 . . . . 0.0 111.556 171.008 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 82.7 t80 -65.12 -28.53 69.49 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 124.885 1.274 . . . . 0.0 113.808 169.807 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 94.5 mt-30 -79.56 -36.15 38.72 Favored 'General case' 0 N--CA 1.472 0.628 0 O-C-N 121.048 -1.033 . . . . 0.0 110.279 174.59 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 82.1 mt -61.26 -42.99 99.57 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 118.598 0.635 . . . . 0.0 111.419 169.082 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 45.8 mm-40 -60.75 -34.3 74.23 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.561 1.144 . . . . 0.0 113.312 170.84 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 17.0 t30 -64.63 -28.65 69.76 Favored 'General case' 0 CA--C 1.546 0.817 0 O-C-N 121.021 -1.049 . . . . 0.0 112.703 179.2 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 23.8 m-85 -87.79 -12.22 45.7 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 124.547 1.139 . . . . 0.0 113.394 173.727 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 35.1 t -80.53 174.01 12.03 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.416 1.486 . . . . 0.0 111.525 168.784 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 12.6 m-80 . . . . . 0 C--O 1.251 1.146 0 C-N-CA 125.126 1.37 . . . . 0.0 112.672 171.336 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 71.1 m-85 . . . . . 0 N--CA 1.489 1.489 0 N-CA-C 111.466 0.173 . . . . 0.0 111.466 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 8.5 p -63.36 150.0 9.94 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.125 0 C-N-CA 124.734 1.214 . . . . 0.0 112.435 178.337 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 43.4 t30 81.24 178.96 0.08 Allowed 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 127.628 2.371 . . . . 0.0 113.421 172.262 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 38.0 mt-30 -134.99 -179.97 5.95 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 127.091 2.156 . . . . 0.0 110.218 -176.976 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 27.0 m-70 -69.68 135.67 50.13 Favored 'General case' 0 CA--C 1.546 0.821 0 O-C-N 121.202 -0.936 . . . . 0.0 110.246 168.691 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 87.7 mt -137.34 118.59 14.57 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 126.803 2.041 . . . . 0.0 109.601 -176.888 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 85.9 m -123.7 139.6 53.83 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.213 1.405 . . . . 0.0 111.307 -178.268 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 50.84 -123.88 18.31 Favored Glycine 0 N--CA 1.473 1.14 0 C-N-CA 124.693 1.14 . . . . 0.0 114.582 169.518 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 18.5 m -56.02 -32.74 64.28 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.542 1.137 . . . . 0.0 113.389 178.63 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 1.4 t-80 -72.72 -35.04 67.49 Favored 'General case' 0 CA--C 1.54 0.585 0 O-C-N 120.825 -1.172 . . . . 0.0 111.537 176.711 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 49.8 tp -68.43 -42.1 79.38 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 123.66 0.784 . . . . 0.0 111.474 171.446 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 65.3 t -59.94 -44.07 93.67 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 C-N-CA 123.577 0.751 . . . . 0.0 110.566 173.707 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -63.12 -44.24 96.16 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.52 0.728 . . . . 0.0 112.215 174.842 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.47 -39.87 94.82 Favored 'General case' 0 CA--C 1.537 0.479 0 O-C-N 121.221 -0.924 . . . . 0.0 112.179 175.896 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 37.0 mt -62.71 -41.7 99.28 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 123.612 0.765 . . . . 0.0 111.455 173.748 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 19.7 m-85 -61.42 -40.99 96.42 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-N 119.915 1.234 . . . . 0.0 112.376 171.601 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 77.8 mt -68.22 -42.59 79.59 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.772 0.829 . . . . 0.0 112.816 178.188 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 46.8 t -72.71 -47.43 50.23 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 124.005 0.922 . . . . 0.0 111.608 178.512 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 33.9 t -83.35 -41.37 18.29 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 113.432 0.901 . . . . 0.0 113.432 -170.393 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 70.62 -143.07 36.27 Favored Glycine 0 CA--C 1.53 1.025 0 C-N-CA 124.217 0.913 . . . . 0.0 112.514 -176.943 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -64.67 -18.58 65.09 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 125.234 1.414 . . . . 0.0 113.518 -178.161 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 71.0 mtm180 -60.84 -30.67 70.25 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.664 1.185 . . . . 0.0 114.084 -177.236 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 80.46 142.23 2.98 Favored Glycine 0 CA--C 1.534 1.237 0 C-N-CA 125.57 1.557 . . . . 0.0 113.352 179.628 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 52.7 p90 -129.41 155.85 45.01 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 125.199 1.4 . . . . 0.0 112.579 -177.764 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -85.83 143.67 28.14 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.485 1.114 . . . . 0.0 110.571 171.248 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 65.0 t80 -158.84 130.61 6.52 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.242 1.017 . . . . 0.0 112.732 -179.775 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 98.6 m -144.25 121.95 6.69 Favored Pre-proline 0 N--CA 1.475 0.803 0 C-N-CA 126.302 1.841 . . . . 0.0 108.065 170.09 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_endo -80.83 153.01 19.52 Favored 'Trans proline' 0 N--CA 1.458 -0.617 0 C-N-CA 123.053 2.502 . . . . 0.0 110.548 177.215 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 5.2 tmtt? . . . . . 0 CA--C 1.547 0.865 0 N-CA-C 114.081 1.141 . . . . 0.0 114.081 -178.079 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 9.2 tp . . . . . 0 N--CA 1.486 1.335 0 N-CA-C 114.544 1.313 . . . . 0.0 114.544 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 16.4 t -62.78 -33.25 59.09 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.888 0 C-N-CA 124.467 1.107 . . . . 0.0 111.72 -178.139 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -70.05 -21.53 63.16 Favored 'General case' 0 CA--C 1.544 0.72 0 O-C-N 121.508 -0.745 . . . . 0.0 112.485 176.946 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 72.0 tp60 -87.56 -59.34 2.28 Favored 'General case' 0 CA--C 1.535 0.375 0 O-C-N 121.516 -0.74 . . . . 0.0 110.025 170.927 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 63.0 m -70.52 -32.37 69.81 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 114.75 1.389 . . . . 0.0 114.75 -169.985 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 16.5 t -82.91 -53.62 5.71 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 119.523 1.056 . . . . 0.0 110.936 -176.875 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 17.7 m -77.95 -24.39 48.2 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 126.278 1.831 . . . . 0.0 112.655 -174.008 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.4 t -137.77 -167.28 2.11 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.085 1.354 . . . . 0.0 111.364 176.308 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 69.9 mt -86.04 145.26 8.01 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 C-N-CA 124.699 1.199 . . . . 0.0 109.946 175.694 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.0 p -137.83 159.27 42.46 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 114.146 1.165 . . . . 0.0 114.146 171.583 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 87.9 p -117.57 168.31 10.52 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.63 1.572 . . . . 0.0 113.394 -176.452 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 79.0 mt -57.11 -34.03 67.95 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 124.214 1.006 . . . . 0.0 112.78 177.971 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 89.3 t80 -61.43 -32.76 72.73 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.235 1.014 . . . . 0.0 112.583 175.189 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 90.9 mt-30 -82.75 -31.28 28.44 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.815 0.846 . . . . 0.0 111.107 177.699 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 76.1 mt -65.92 -41.35 91.52 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 118.725 0.693 . . . . 0.0 111.55 169.722 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 45.7 mm-40 -60.27 -37.51 80.65 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.911 1.285 . . . . 0.0 112.705 169.724 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.8 t-20 -61.97 -26.22 68.08 Favored 'General case' 0 CA--C 1.55 0.97 0 O-C-N 121.085 -1.009 . . . . 0.0 113.542 -175.829 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 51.5 m-85 -97.26 -2.0 43.6 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 125.267 1.427 . . . . 0.0 113.874 175.561 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 18.7 t -79.72 172.03 14.34 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.861 1.265 . . . . 0.0 111.394 168.826 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 9.1 m-80 . . . . . 0 C--O 1.256 1.407 0 C-N-CA 124.497 1.119 . . . . 0.0 112.494 171.723 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.48 0 CA-C-O 119.17 -0.443 . . . . 0.0 111.367 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 92.3 t -87.43 110.06 20.15 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 CA-C-N 119.513 1.051 . . . . 0.0 109.273 177.932 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 37.3 t30 -162.53 98.66 1.01 Allowed 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 127.312 2.245 . . . . 0.0 107.615 -179.279 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 6.1 tt0 -161.04 170.28 20.83 Favored 'General case' 0 N--CA 1.476 0.826 0 O-C-N 121.542 -0.724 . . . . 0.0 112.119 -166.264 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 31.6 m-70 -73.77 141.93 46.25 Favored 'General case' 0 CA--C 1.549 0.906 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 164.268 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 76.5 mt -145.21 133.55 21.78 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 126.884 2.073 . . . . 0.0 108.733 175.569 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.7 t -146.69 154.52 41.53 Favored 'General case' 0 N--CA 1.471 0.62 0 O-C-N 121.363 -0.836 . . . . 0.0 113.209 -178.814 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 54.99 -133.98 48.18 Favored Glycine 0 N--CA 1.471 0.989 0 C-N-CA 124.436 1.017 . . . . 0.0 113.021 176.612 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 18.4 m -54.36 -36.55 63.97 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.207 1.003 . . . . 0.0 113.028 177.889 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 17.5 t-160 -67.76 -39.05 84.18 Favored 'General case' 0 CA--C 1.544 0.733 0 O-C-N 120.942 -1.099 . . . . 0.0 111.721 179.598 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 39.8 tp -67.62 -42.75 81.87 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 123.569 0.747 . . . . 0.0 111.882 172.017 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 54.2 t -59.99 -43.41 92.41 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 C-N-CA 123.361 0.665 . . . . 0.0 110.867 175.244 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -64.86 -42.42 94.87 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 123.624 0.77 . . . . 0.0 112.4 174.339 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.28 -42.33 98.46 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 119.443 1.02 . . . . 0.0 112.106 174.459 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 51.0 mt -61.91 -43.08 99.57 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.688 0.795 . . . . 0.0 111.489 174.408 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 13.6 m-85 -59.79 -44.09 94.1 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 119.885 1.221 . . . . 0.0 112.329 172.224 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 74.5 mt -66.67 -42.03 87.21 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.829 0.852 . . . . 0.0 112.437 179.875 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 60.1 t -76.24 -49.38 25.27 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 123.359 0.664 . . . . 0.0 111.977 179.818 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 48.5 t -79.13 -39.62 33.11 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 113.014 0.746 . . . . 0.0 113.014 -172.209 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 69.39 -142.03 36.51 Favored Glycine 0 CA--C 1.53 1.016 0 C-N-CA 124.326 0.965 . . . . 0.0 112.296 -179.348 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -64.26 -19.08 65.15 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 125.221 1.408 . . . . 0.0 113.637 -176.658 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 80.3 mtm180 -60.73 -32.87 72.12 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.899 1.28 . . . . 0.0 113.797 -178.368 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 80.52 142.79 3.16 Favored Glycine 0 CA--C 1.534 1.263 0 C-N-CA 125.212 1.387 . . . . 0.0 113.419 -178.491 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 50.8 p90 -129.11 158.43 38.98 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.653 1.581 . . . . 0.0 112.766 -175.518 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 81.7 t80 -83.41 140.75 32.19 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.862 0.865 . . . . 0.0 110.893 169.625 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 65.1 t80 -149.46 142.47 24.86 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.714 1.206 . . . . 0.0 111.723 173.52 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 3.5 m -162.42 131.4 3.05 Favored Pre-proline 0 N--CA 1.478 0.938 0 C-N-CA 127.65 2.38 . . . . 0.0 107.325 173.077 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -72.07 113.09 3.58 Favored 'Trans proline' 0 C--N 1.35 0.656 0 C-N-CA 122.712 2.275 . . . . 0.0 110.239 178.376 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 28.4 tptp . . . . . 0 N--CA 1.47 0.567 0 C-N-CA 123.765 0.826 . . . . 0.0 111.574 -179.539 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 9.5 tt . . . . . 0 N--CA 1.484 1.255 0 N-CA-C 111.623 0.231 . . . . 0.0 111.623 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 8.4 p -67.56 -21.92 28.03 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 124.256 1.022 . . . . 0.0 112.445 -174.515 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -64.1 -10.19 20.99 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 125.882 1.673 . . . . 0.0 113.173 171.625 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 11.6 tt0 -113.06 -50.98 2.85 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 126.137 1.775 . . . . 0.0 109.452 168.368 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 61.0 m -67.49 -22.46 65.46 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 115.404 1.631 . . . . 0.0 115.404 -171.249 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 37.2 t -102.58 -33.76 9.35 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 119.398 0.999 . . . . 0.0 113.0 177.436 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 44.5 p -72.35 -34.53 68.08 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 125.211 1.404 . . . . 0.0 111.969 178.694 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 9.1 t -134.05 -161.32 1.13 Allowed 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 126.453 1.901 . . . . 0.0 110.031 172.844 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 66.9 mt -101.86 116.61 45.8 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 C-N-CA 124.628 1.171 . . . . 0.0 108.148 171.223 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 21.7 p -89.58 152.69 21.27 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.294 0.637 . . . . 0.0 111.111 169.777 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 36.9 t -80.61 151.32 29.1 Favored 'General case' 0 N--CA 1.47 0.561 0 O-C-N 120.902 -1.124 . . . . 0.0 112.089 -176.449 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 80.0 mt -57.96 -32.78 68.16 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 121.402 -0.811 . . . . 0.0 111.217 170.268 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 83.4 t80 -64.35 -27.43 69.01 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.053 0.941 . . . . 0.0 113.071 173.654 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 80.2 mt-30 -80.79 -39.0 27.5 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 123.399 0.68 . . . . 0.0 110.551 173.445 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 58.6 mt -57.24 -42.31 81.23 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 119.275 0.943 . . . . 0.0 111.783 172.045 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -60.54 -17.51 46.33 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 114.74 1.385 . . . . 0.0 114.74 174.927 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 14.6 t-20 -70.04 -24.06 63.2 Favored 'General case' 0 CA--C 1.547 0.843 0 CA-C-N 119.878 1.217 . . . . 0.0 112.963 176.014 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 88.4 m-85 -94.01 -2.06 53.59 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.118 1.367 . . . . 0.0 113.805 -177.916 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 82.9 m -70.03 132.2 45.52 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.61 1.164 . . . . 0.0 112.112 177.445 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.253 1.261 0 C-N-CA 128.229 2.611 . . . . 0.0 112.313 -172.447 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 72.1 m-85 . . . . . 0 N--CA 1.486 1.366 0 CA-C-O 119.439 -0.315 . . . . 0.0 110.541 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 7.6 p -161.5 144.99 4.23 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 C-N-CA 124.576 1.15 . . . . 0.0 111.245 -178.726 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 53.1 t30 -85.82 -157.8 0.35 Allowed 'General case' 0 CA--C 1.557 1.224 0 C-N-CA 125.423 1.489 . . . . 0.0 111.029 174.483 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 45.8 mm-40 -135.31 173.08 12.11 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 126.083 1.753 . . . . 0.0 110.792 175.247 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 32.4 m-70 -69.0 133.43 48.13 Favored 'General case' 0 CA--C 1.544 0.72 0 O-C-N 121.647 -0.658 . . . . 0.0 109.988 169.469 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 87.2 mt -133.84 120.47 20.49 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 125.871 1.669 . . . . 0.0 109.843 -176.244 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -121.5 140.04 52.71 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 125.05 1.34 . . . . 0.0 111.988 -179.321 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 52.94 -126.46 33.03 Favored Glycine 0 CA--C 1.53 1.006 0 C-N-CA 124.79 1.186 . . . . 0.0 114.484 169.867 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 20.6 m -56.41 -29.59 61.75 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 124.533 1.133 . . . . 0.0 113.325 178.499 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 29.6 m80 -69.47 -40.68 76.95 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 120.877 -1.139 . . . . 0.0 111.335 176.541 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 49.5 tp -65.9 -43.14 89.1 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.307 1.043 . . . . 0.0 111.153 173.657 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 41.5 t -59.87 -46.24 94.06 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 124.469 1.108 . . . . 0.0 111.188 174.364 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -64.24 -44.0 93.18 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 123.502 0.721 . . . . 0.0 111.404 177.151 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.41 -44.12 92.91 Favored 'General case' 0 CA--C 1.539 0.521 0 O-C-N 121.557 -0.715 . . . . 0.0 111.253 175.896 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 18.1 mt -60.31 -45.34 93.72 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.899 0.879 . . . . 0.0 111.878 175.538 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -57.51 -44.75 85.27 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 119.439 1.018 . . . . 0.0 112.759 174.236 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 10.0 mp -69.69 -41.18 75.78 Favored 'General case' 0 N--CA 1.471 0.575 0 C-N-CA 123.432 0.693 . . . . 0.0 112.454 178.888 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 29.9 t -66.46 -43.53 90.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 124.388 1.075 . . . . 0.0 111.485 178.629 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 71.2 m -72.94 -45.37 58.45 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 118.795 0.725 . . . . 0.0 112.763 -178.586 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.4 -129.68 40.21 Favored Glycine 0 CA--C 1.533 1.198 0 C-N-CA 124.269 0.938 . . . . 0.0 112.0 179.308 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -59.84 -21.16 60.55 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 125.081 1.352 . . . . 0.0 113.557 -179.514 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 83.5 mtm180 -67.94 -16.37 64.03 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.548 1.139 . . . . 0.0 113.841 177.226 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.87 159.93 25.4 Favored Glycine 0 CA--C 1.53 1.006 0 C-N-CA 125.35 1.452 . . . . 0.0 113.35 -179.919 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 68.8 t80 -159.15 148.27 18.48 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.482 1.113 . . . . 0.0 112.346 178.114 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 90.2 t80 -174.82 114.8 0.16 Allowed 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 127.778 2.431 . . . . 0.0 109.624 168.318 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 35.5 t80 -167.84 143.28 3.84 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 126.004 1.722 . . . . 0.0 110.439 178.558 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 10.3 p -103.4 129.21 25.89 Favored Pre-proline 0 N--CA 1.475 0.817 0 C-N-CA 124.825 1.25 . . . . 0.0 112.15 -169.71 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -85.82 150.11 9.81 Favored 'Trans proline' 0 C--N 1.352 0.734 0 C-N-CA 123.762 2.974 . . . . 0.0 111.403 176.178 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 81.7 tttt . . . . . 0 CA--C 1.549 0.928 0 C-N-CA 124.833 1.253 . . . . 0.0 113.867 -179.914 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 15.1 tt . . . . . 0 N--CA 1.481 1.092 0 N-CA-C 115.537 1.68 . . . . 0.0 115.537 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 4.7 p -59.64 -34.01 53.79 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.248 0 CA-C-N 119.87 1.214 . . . . 0.0 112.562 176.585 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -69.61 -14.71 62.97 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 123.982 0.913 . . . . 0.0 112.648 178.625 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 27.6 tt0 -99.89 -55.69 2.57 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.816 0.846 . . . . 0.0 111.098 171.683 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 59.6 m -59.08 -27.77 65.85 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 114.578 1.325 . . . . 0.0 114.578 -171.78 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 68.2 m -70.44 -29.86 66.56 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 113.641 0.978 . . . . 0.0 113.641 -179.086 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 33.5 p -122.66 -37.57 2.75 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 125.003 1.321 . . . . 0.0 112.781 -170.124 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 50.8 m -100.46 163.99 12.12 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.319 1.447 . . . . 0.0 110.992 171.072 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 16.0 tt -81.46 132.07 32.39 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 O-C-N 121.542 -0.724 . . . . 0.0 109.534 174.865 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 13.9 p -128.2 165.92 19.52 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.6 1.16 . . . . 0.0 111.975 -176.764 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 38.1 t -116.03 151.39 35.6 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 -169.456 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 9.6 mp -58.26 -28.89 65.34 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 123.707 0.803 . . . . 0.0 111.742 169.817 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 87.7 t80 -60.36 -32.37 71.22 Favored 'General case' 0 CA--C 1.541 0.622 0 O-C-N 121.623 -0.673 . . . . 0.0 112.567 171.583 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 56.9 mt-30 -80.49 -35.24 35.01 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 123.953 0.901 . . . . 0.0 111.017 176.676 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 82.4 mt -59.27 -43.12 92.52 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-N 118.459 0.572 . . . . 0.0 111.189 171.294 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -68.5 -33.68 74.57 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 123.675 0.79 . . . . 0.0 112.972 172.779 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 22.7 t-20 -66.22 -33.19 75.2 Favored 'General case' 0 CA--C 1.546 0.801 0 O-C-N 120.606 -1.309 . . . . 0.0 112.356 176.287 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 19.2 m-85 -82.59 -1.46 50.9 Favored 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 125.513 1.525 . . . . 0.0 113.658 171.161 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 10.6 t -86.78 179.5 6.74 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 124.844 1.257 . . . . 0.0 112.17 170.02 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 . . . . . 0 C--O 1.253 1.244 0 C-N-CA 125.578 1.551 . . . . 0.0 113.235 179.776 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 34.0 t80 . . . . . 0 N--CA 1.49 1.557 0 CA-C-O 119.435 -0.317 . . . . 0.0 110.829 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 7.0 p -60.76 -23.96 30.75 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 C-N-CA 124.731 1.212 . . . . 0.0 114.054 -173.742 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 2.9 p30 -137.99 136.65 37.13 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.949 1.3 . . . . 0.0 109.646 167.718 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 5.0 tt0 -169.23 169.31 9.32 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.163 0.985 . . . . 0.0 111.246 -167.336 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 99.6 m-70 -85.12 142.77 29.28 Favored 'General case' 0 CA--C 1.543 0.703 0 O-C-N 121.381 -0.825 . . . . 0.0 108.782 165.5 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 86.0 mt -148.66 132.15 16.7 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 125.827 1.651 . . . . 0.0 109.65 -179.039 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.7 t -145.16 136.09 24.68 Favored 'General case' 0 N--CA 1.469 0.522 0 O-C-N 121.346 -0.846 . . . . 0.0 113.068 -178.348 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 58.56 -122.8 31.2 Favored Glycine 0 N--CA 1.469 0.862 0 C-N-CA 124.564 1.078 . . . . 0.0 112.962 174.795 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 25.8 p -54.36 -34.77 61.83 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.767 1.227 . . . . 0.0 113.281 176.8 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 35.1 m80 -68.49 -40.77 80.78 Favored 'General case' 0 CA--C 1.543 0.708 0 O-C-N 120.909 -1.12 . . . . 0.0 111.599 177.311 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 63.4 tp -67.92 -43.43 79.21 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 123.807 0.843 . . . . 0.0 110.999 175.06 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 44.9 t -59.49 -46.02 93.26 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 124.131 0.973 . . . . 0.0 110.647 174.625 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -63.37 -43.31 97.99 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.524 0.729 . . . . 0.0 111.65 176.179 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.65 -42.89 97.91 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 118.911 0.778 . . . . 0.0 112.192 174.679 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 49.0 mt -62.16 -39.54 92.98 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 118.718 0.69 . . . . 0.0 111.879 175.474 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 30.4 m-85 -67.58 -38.32 83.87 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 119.407 1.003 . . . . 0.0 113.104 172.665 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 75.4 mt -69.33 -44.28 71.99 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 119.295 0.952 . . . . 0.0 112.079 176.943 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 73.9 t -77.54 -41.05 29.02 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 C-N-CA 124.49 1.116 . . . . 0.0 112.171 -177.297 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -139.43 8.77 2.44 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 115.925 1.824 . . . . 0.0 115.925 -168.75 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -61.95 -31.04 77.1 Favored Glycine 0 N--CA 1.476 1.359 0 CA-C-N 120.135 1.334 . . . . 0.0 114.725 -171.654 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -78.48 -33.96 47.88 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 118.198 0.999 . . . . 0.0 112.623 176.97 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 81.2 mtm180 -72.71 -29.01 63.02 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 124.079 0.952 . . . . 0.0 111.806 170.968 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 83.19 109.03 0.5 Allowed Glycine 0 CA--C 1.529 0.911 0 C-N-CA 126.549 2.023 . . . . 0.0 111.196 -179.262 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 50.6 p90 -86.83 145.27 26.67 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.44 0.696 . . . . 0.0 112.209 175.526 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -82.74 -28.57 30.33 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.205 1.002 . . . . 0.0 112.643 -177.176 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 49.6 t80 -66.04 151.63 46.42 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 114.822 1.416 . . . . 0.0 114.822 -171.49 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 49.0 m -138.45 122.48 11.5 Favored Pre-proline 0 CA--C 1.539 0.531 0 C-N-CA 125.957 1.703 . . . . 0.0 107.687 169.029 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 78.3 Cg_exo -56.58 156.92 20.49 Favored 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 123.729 2.953 . . . . 0.0 113.778 177.958 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 58.3 tptt . . . . . 0 CA--C 1.549 0.92 0 N-CA-C 113.032 0.753 . . . . 0.0 113.032 173.211 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 12.3 tt . . . . . 0 N--CA 1.482 1.132 0 N-CA-C 114.056 1.132 . . . . 0.0 114.056 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 9.3 p -63.83 -35.62 73.82 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.265 0 CA-C-N 120.458 1.481 . . . . 0.0 112.566 -177.847 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -72.04 -8.9 57.2 Favored 'General case' 0 CA--C 1.547 0.835 0 N-CA-C 113.471 0.915 . . . . 0.0 113.471 176.262 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 21.7 tt0 -93.73 -58.51 2.24 Favored 'General case' 0 N--CA 1.464 0.246 0 C-N-CA 124.788 1.235 . . . . 0.0 109.083 168.607 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 71.4 m -72.33 -22.3 61.2 Favored 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 114.555 1.317 . . . . 0.0 114.555 -169.945 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 4.7 t -77.51 -18.25 57.21 Favored 'General case' 0 N--CA 1.473 0.72 0 O-C-N 121.453 -0.779 . . . . 0.0 112.471 171.853 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 31.7 m -103.78 -42.56 5.58 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 126.663 1.985 . . . . 0.0 111.463 -173.216 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 67.3 m -124.54 168.7 12.75 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 126.795 2.038 . . . . 0.0 111.856 -179.478 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 31.8 mm -66.54 133.73 30.87 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 O-C-N 120.749 -1.219 . . . . 0.0 109.638 171.224 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.7 m -116.32 158.78 22.88 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 122.645 1.212 . . . . 0.0 113.534 175.614 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 20.9 t -122.43 162.29 21.94 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 126.443 1.897 . . . . 0.0 112.443 -176.244 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.485 ' H ' HD12 ' A' ' 13' ' ' LEU . 5.4 mp -64.12 -32.96 74.71 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 124.707 1.203 . . . . 0.0 111.923 -176.414 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 82.3 t80 -61.67 -30.79 70.96 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 123.701 0.8 . . . . 0.0 112.773 175.828 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 -78.21 -33.92 49.69 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.817 0.847 . . . . 0.0 110.667 176.766 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 90.2 mt -66.49 -46.49 76.11 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 118.644 0.656 . . . . 0.0 111.678 171.47 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 -64.11 -20.87 66.27 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 113.803 1.038 . . . . 0.0 113.803 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.7 t30 -57.01 -28.26 62.31 Favored 'General case' 0 CA--C 1.548 0.878 0 CA-C-N 119.356 0.98 . . . . 0.0 112.978 172.676 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 98.0 m-85 -98.61 -2.78 37.69 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.395 1.478 . . . . 0.0 113.487 178.547 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 12.3 t -84.65 -149.56 0.11 Allowed 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 125.989 1.716 . . . . 0.0 111.025 173.71 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 41.1 m-80 . . . . . 0 C--O 1.255 1.364 0 C-N-CA 127.045 2.138 . . . . 0.0 112.177 176.758 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 50.9 t80 . . . . . 0 N--CA 1.484 1.262 0 CA-C-O 119.627 -0.225 . . . . 0.0 111.019 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 7.1 p -70.18 -38.21 74.02 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.3 0 C-N-CA 124.023 0.929 . . . . 0.0 113.37 -173.541 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -74.23 111.68 9.64 Favored 'General case' 0 CA--C 1.544 0.718 0 N-CA-C 108.218 -1.03 . . . . 0.0 108.218 169.186 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 -170.64 172.34 5.89 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 123.932 0.893 . . . . 0.0 110.965 -165.219 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 95.1 m-70 -68.29 138.83 55.81 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 107.261 -1.385 . . . . 0.0 107.261 163.277 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 92.7 mt -138.2 126.39 22.95 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 125.177 1.391 . . . . 0.0 109.204 -178.334 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 6.3 t -146.42 145.11 30.13 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 123.312 0.645 . . . . 0.0 111.665 -174.651 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 51.92 -128.13 32.97 Favored Glycine 0 N--CA 1.472 1.091 0 C-N-CA 124.457 1.027 . . . . 0.0 112.75 175.822 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 36.2 m -58.73 -31.42 68.27 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 113.275 0.843 . . . . 0.0 113.275 179.277 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -72.05 -36.82 69.71 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 119.16 0.891 . . . . 0.0 111.641 176.571 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 57.5 tp -65.95 -47.29 75.14 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 118.591 0.632 . . . . 0.0 110.74 171.336 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 54.1 t -60.99 -43.76 96.76 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 C-N-CA 123.525 0.73 . . . . 0.0 110.618 -179.724 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -64.4 -46.25 84.11 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.602 0.761 . . . . 0.0 112.056 175.153 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.4 -42.3 99.32 Favored 'General case' 0 CA--C 1.539 0.548 0 O-C-N 121.408 -0.808 . . . . 0.0 111.857 177.5 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 46.0 tp -63.5 -41.22 98.55 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.652 1.181 . . . . 0.0 111.252 177.238 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 7.2 m-85 -60.41 -45.9 91.95 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 119.253 0.933 . . . . 0.0 112.435 169.831 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 72.2 mt -65.94 -43.5 87.86 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 123.305 0.642 . . . . 0.0 112.377 -179.378 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 53.2 t -76.97 -37.77 27.29 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 123.877 0.871 . . . . 0.0 112.327 -177.723 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 44.1 t -77.2 -41.82 39.92 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 118.779 0.718 . . . . 0.0 112.569 177.72 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 73.07 -148.21 40.8 Favored Glycine 0 CA--C 1.529 0.951 0 C-N-CA 124.646 1.117 . . . . 0.0 112.744 179.587 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -62.49 -19.98 64.13 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.257 1.423 . . . . 0.0 113.733 -177.522 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 86.9 mtm180 -57.32 -35.1 69.44 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 125.237 1.415 . . . . 0.0 114.043 179.153 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.07 144.9 2.42 Favored Glycine 0 CA--C 1.532 1.123 0 C-N-CA 125.272 1.415 . . . . 0.0 113.4 -178.148 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 48.0 p90 -113.23 151.2 31.34 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.186 1.395 . . . . 0.0 112.007 177.886 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 37.9 p90 -93.43 -10.09 36.32 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 114.34 1.237 . . . . 0.0 114.34 -178.646 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 74.7 t80 -70.2 148.25 48.84 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.934 1.294 . . . . 0.0 114.283 -177.761 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 85.7 m -127.47 131.2 23.71 Favored Pre-proline 0 N--CA 1.478 0.938 0 C-N-CA 126.389 1.876 . . . . 0.0 107.862 170.231 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -67.2 133.04 29.4 Favored 'Trans proline' 0 C--N 1.351 0.677 0 C-N-CA 122.888 2.392 . . . . 0.0 112.337 -173.14 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 84.0 tttt . . . . . 0 CA--C 1.546 0.816 0 C-N-CA 124.163 0.985 . . . . 0.0 112.971 177.875 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 8.7 tp . . . . . 0 N--CA 1.483 1.202 0 N-CA-C 114.114 1.153 . . . . 0.0 114.114 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 5.7 p -62.58 -29.67 47.44 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 C-N-CA 123.556 0.742 . . . . 0.0 112.89 -179.522 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -76.86 -8.24 56.97 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 119.566 1.075 . . . . 0.0 112.855 179.188 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 79.7 mm-40 -97.19 -59.95 1.68 Allowed 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.985 0.914 . . . . 0.0 108.869 169.039 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 94.5 m -69.09 -29.03 67.04 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 114.923 1.453 . . . . 0.0 114.923 -170.538 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 7.9 t -80.65 -43.26 20.73 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 119.392 0.996 . . . . 0.0 111.03 176.847 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 23.2 m -68.97 -38.14 79.19 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 127.011 2.124 . . . . 0.0 112.917 -175.966 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.4 t -146.79 -172.04 3.89 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.949 1.299 . . . . 0.0 111.146 179.459 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 50.1 mt -76.64 124.0 34.11 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 O-C-N 120.893 -1.129 . . . . 0.0 109.0 170.72 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 23.8 p -103.25 157.76 16.79 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.062 0.945 . . . . 0.0 111.453 170.635 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 34.4 t -92.8 156.21 17.14 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.57 0.748 . . . . 0.0 111.847 179.687 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 59.2 mt -58.4 -29.36 66.01 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 123.398 0.679 . . . . 0.0 111.719 172.684 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.3 t80 -62.84 -33.04 74.41 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 113.16 0.8 . . . . 0.0 113.16 172.289 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 60.6 mm-40 -77.02 -34.55 57.33 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 123.281 0.633 . . . . 0.0 110.721 175.919 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 95.6 mt -65.1 -44.37 89.05 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 118.552 0.614 . . . . 0.0 111.186 171.772 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.422 ' HA ' ' SG ' ' A' ' 20' ' ' CYS . 24.6 mt-10 -63.85 -25.5 68.19 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 113.907 1.077 . . . . 0.0 113.907 175.929 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 -63.05 -21.25 66.04 Favored 'General case' 0 CA--C 1.547 0.832 0 CA-C-N 119.14 0.882 . . . . 0.0 112.87 175.944 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 73.7 m-85 -102.01 -0.21 34.02 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.161 1.384 . . . . 0.0 114.389 177.024 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.422 ' SG ' ' HA ' ' A' ' 17' ' ' GLU . 67.4 m -65.31 144.75 56.93 Favored 'General case' 0 CA--C 1.544 0.746 0 CA-C-N 119.373 0.988 . . . . 0.0 110.473 169.132 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 21.4 t-20 . . . . . 0 C--O 1.255 1.347 0 C-N-CA 124.867 1.267 . . . . 0.0 113.105 -175.643 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 68.5 t80 . . . . . 0 N--CA 1.484 1.23 0 CA-C-O 119.931 -0.081 . . . . 0.0 110.898 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 16.9 m -67.66 148.82 11.78 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.025 0 C-N-CA 124.181 0.993 . . . . 0.0 112.566 -178.422 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 42.9 54.9 4.6 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 126.123 1.769 . . . . 0.0 114.483 174.696 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 3.1 mm-40 -145.54 -177.21 5.45 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.963 1.705 . . . . 0.0 110.832 -175.258 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 27.6 m-70 -64.48 131.21 46.47 Favored 'General case' 0 CA--C 1.546 0.809 0 O-C-N 121.312 -0.868 . . . . 0.0 109.836 168.238 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 78.4 mt -141.77 127.02 18.6 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 126.2 1.8 . . . . 0.0 109.07 -177.79 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.7 t -145.14 143.43 30.35 Favored 'General case' 0 N--CA 1.472 0.653 0 O-C-N 121.357 -0.839 . . . . 0.0 112.327 -175.322 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 56.68 -127.43 44.24 Favored Glycine 0 CA--C 1.531 1.081 0 C-N-CA 124.165 0.888 . . . . 0.0 113.252 175.293 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 31.6 p -56.82 -33.7 67.0 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.731 1.213 . . . . 0.0 113.706 177.277 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 19.1 t-160 -70.89 -37.32 73.01 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 121.119 -0.988 . . . . 0.0 111.576 176.377 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 43.1 tp -69.97 -41.68 74.14 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 123.78 0.832 . . . . 0.0 111.747 172.907 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 37.8 t -58.16 -46.14 88.52 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 C-N-CA 124.152 0.981 . . . . 0.0 110.472 172.812 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -64.48 -42.61 95.79 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.829 0.852 . . . . 0.0 112.219 176.517 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.35 -40.69 95.2 Favored 'General case' 0 CA--C 1.538 0.516 0 O-C-N 121.347 -0.846 . . . . 0.0 112.14 174.477 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 47.8 mt -65.16 -39.06 92.43 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.522 -0.736 . . . . 0.0 112.047 174.896 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 15.7 m-85 -59.56 -44.3 93.33 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 119.568 1.076 . . . . 0.0 112.037 170.052 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 80.8 mt -68.9 -43.2 75.73 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.95 0.9 . . . . 0.0 112.62 179.615 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 42.2 t -72.29 -48.23 49.38 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 124.204 1.002 . . . . 0.0 111.821 -179.048 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 84.6 m -77.54 -34.39 53.91 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 121.432 -0.793 . . . . 0.0 113.0 -177.344 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 65.02 -132.26 36.57 Favored Glycine 0 CA--C 1.527 0.821 0 C-N-CA 124.06 0.838 . . . . 0.0 111.748 179.079 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -63.12 -20.16 65.11 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 124.533 1.133 . . . . 0.0 113.257 178.874 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 85.3 mtm180 -63.83 -35.32 80.23 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.795 0.838 . . . . 0.0 113.022 179.127 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.53 179.14 34.37 Favored Glycine 0 CA--C 1.537 1.452 0 C-N-CA 124.488 1.042 . . . . 0.0 112.9 -169.868 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 46.6 p90 -158.29 169.47 24.41 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 125.416 1.486 . . . . 0.0 113.658 -172.572 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 69.6 t80 -121.85 112.95 18.97 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.302 1.441 . . . . 0.0 110.252 173.093 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 45.7 t80 -74.93 138.22 42.21 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 123.552 0.741 . . . . 0.0 111.739 177.814 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 23.2 p -128.09 108.03 19.87 Favored Pre-proline 0 N--CA 1.478 0.957 0 C-N-CA 124.375 1.07 . . . . 0.0 111.825 179.507 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 31.0 Cg_exo -66.85 171.06 11.6 Favored 'Trans proline' 0 CA--C 1.538 0.681 0 C-N-CA 124.237 3.291 . . . . 0.0 112.072 168.853 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 60.4 tttp . . . . . 0 CA--C 1.546 0.81 0 N-CA-C 112.847 0.684 . . . . 0.0 112.847 169.635 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 10.8 tp . . . . . 0 N--CA 1.483 1.214 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 58.2 t -68.64 -23.89 28.41 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 C-N-CA 123.71 0.804 . . . . 0.0 112.241 179.064 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -80.74 -46.47 15.42 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.639 -0.663 . . . . 0.0 110.063 168.909 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 13.2 tp60 -68.31 -46.69 69.57 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.191 0.996 . . . . 0.0 112.853 -169.509 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 61.5 m -72.15 -21.13 61.5 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 113.12 0.785 . . . . 0.0 113.12 176.874 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 10.8 t -88.11 -48.62 7.6 Favored 'General case' 0 N--CA 1.467 0.395 0 O-C-N 121.407 -0.808 . . . . 0.0 111.632 -176.821 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 68.2 p -75.75 -22.44 56.5 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 125.03 1.332 . . . . 0.0 113.558 -178.919 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.3 t -150.24 -175.28 5.01 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.652 1.181 . . . . 0.0 111.743 178.19 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 62.4 mt -76.79 134.53 28.6 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 C-N-CA 124.551 1.141 . . . . 0.0 110.019 176.248 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.9 p -126.31 160.63 29.82 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.964 1.306 . . . . 0.0 110.973 170.271 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 90.3 p -110.82 165.36 11.91 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.44 1.096 . . . . 0.0 112.714 -179.103 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 10.2 mp -58.29 -28.34 64.91 Favored 'General case' 0 N--CA 1.473 0.681 0 O-C-N 121.609 -0.682 . . . . 0.0 112.515 173.602 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 78.3 t80 -64.31 -33.92 76.95 Favored 'General case' 0 CA--C 1.542 0.666 0 O-C-N 121.59 -0.694 . . . . 0.0 112.857 172.521 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 65.7 mm-40 -75.66 -24.24 56.36 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.623 0.769 . . . . 0.0 111.984 173.209 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 81.2 mt -75.93 -47.24 26.02 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 119.238 0.926 . . . . 0.0 111.447 172.268 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -65.29 -20.42 66.4 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 113.192 0.812 . . . . 0.0 113.192 177.146 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.5 t30 -54.79 -30.29 56.52 Favored 'General case' 0 CA--C 1.549 0.92 0 CA-C-N 119.144 0.884 . . . . 0.0 113.235 171.732 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 98.2 m-85 -98.18 -2.06 40.72 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.583 1.553 . . . . 0.0 113.646 178.567 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 11.3 t -78.31 169.5 18.16 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.465 1.506 . . . . 0.0 111.533 171.192 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 9.9 m-80 . . . . . 0 C--O 1.252 1.233 0 C-N-CA 124.857 1.263 . . . . 0.0 112.409 173.943 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 67.6 t80 . . . . . 0 N--CA 1.486 1.347 0 CA-C-O 119.681 -0.2 . . . . 0.0 110.697 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 13.0 m -80.71 68.56 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 C-N-CA 125.042 1.337 . . . . 0.0 111.144 177.149 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 39.7 p-10 -156.2 147.9 22.86 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.47 1.508 . . . . 0.0 113.426 -174.49 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 1.6 mm-40 -176.44 177.26 1.49 Allowed 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 126.982 2.113 . . . . 0.0 110.569 -177.551 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 27.0 m-70 -77.44 141.45 39.72 Favored 'General case' 0 CA--C 1.548 0.885 0 O-C-N 120.948 -1.095 . . . . 0.0 109.603 166.458 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 69.8 mt -144.12 135.56 25.77 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 126.521 1.928 . . . . 0.0 109.119 174.141 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 5.5 t -149.33 142.7 25.23 Favored 'General case' 0 N--CA 1.473 0.676 0 O-C-N 121.138 -0.976 . . . . 0.0 112.944 -177.464 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 62.57 -131.1 43.87 Favored Glycine 0 CA--C 1.529 0.941 0 C-N-CA 124.613 1.102 . . . . 0.0 113.321 175.46 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 26.1 p -56.02 -35.26 66.66 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 124.734 1.214 . . . . 0.0 113.026 177.6 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 23.6 m80 -64.48 -42.15 96.06 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.193 0.997 . . . . 0.0 111.613 176.541 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 48.0 tp -70.41 -42.51 71.56 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 123.928 0.891 . . . . 0.0 111.68 176.583 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 55.9 t -60.37 -44.28 95.68 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 123.293 0.637 . . . . 0.0 110.694 174.829 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -64.45 -43.09 95.35 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.819 0.848 . . . . 0.0 111.999 175.343 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.37 -44.01 96.02 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 118.609 0.64 . . . . 0.0 111.684 174.449 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 31.8 mt -59.9 -43.67 94.68 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 118.87 0.759 . . . . 0.0 111.345 175.606 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 20.8 m-85 -60.59 -44.87 95.76 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 119.131 0.878 . . . . 0.0 112.624 173.546 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 81.3 mt -69.36 -43.92 72.62 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 123.694 0.797 . . . . 0.0 112.493 -179.502 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 69.6 t -78.03 -40.92 26.9 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 124.766 1.226 . . . . 0.0 111.796 -174.074 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 48.7 t -78.19 -41.43 34.58 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 118.781 0.718 . . . . 0.0 112.282 176.459 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 72.25 -146.83 39.96 Favored Glycine 0 CA--C 1.531 1.064 0 C-N-CA 124.325 0.964 . . . . 0.0 112.741 178.524 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -60.79 -21.1 62.75 Favored 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 125.465 1.506 . . . . 0.0 113.561 -176.663 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 89.1 mtm180 -56.8 -36.12 69.53 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.968 1.307 . . . . 0.0 113.029 175.889 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 80.07 140.71 2.41 Favored Glycine 0 CA--C 1.534 1.273 0 C-N-CA 125.352 1.453 . . . . 0.0 112.935 -178.482 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 38.7 p90 -119.04 162.91 17.78 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.819 1.248 . . . . 0.0 112.258 179.857 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 4.1 t80 -145.31 85.1 1.71 Allowed 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.891 1.276 . . . . 0.0 109.452 175.373 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -78.4 169.4 18.31 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 115.614 1.709 . . . . 0.0 115.614 -173.089 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 87.7 m -106.31 100.92 32.18 Favored Pre-proline 0 N--CA 1.476 0.857 0 C-N-CA 125.572 1.549 . . . . 0.0 109.53 173.824 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -92.55 143.55 2.44 Favored 'Trans proline' 0 C--N 1.35 0.647 0 C-N-CA 123.406 2.738 . . . . 0.0 113.162 -177.959 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt . . . . . 0 N--CA 1.478 0.948 0 C-N-CA 128.801 2.84 . . . . 0.0 115.761 168.607 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 11.2 tp . . . . . 0 N--CA 1.482 1.174 0 N-CA-C 114.25 1.204 . . . . 0.0 114.25 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 47.9 t -62.24 -35.66 70.31 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.134 0 CA-C-N 118.624 0.647 . . . . 0.0 111.334 176.267 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -76.67 -7.66 55.73 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.463 1.105 . . . . 0.0 112.91 -179.454 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 35.9 tp60 -103.01 -57.52 2.03 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.935 1.294 . . . . 0.0 109.861 173.941 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 83.4 m -74.34 -25.55 59.61 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 115.16 1.541 . . . . 0.0 115.16 -169.522 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 72.3 m -77.24 -23.31 51.32 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 119.373 0.988 . . . . 0.0 113.019 -179.692 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 18.0 p -114.09 -48.13 2.91 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 125.966 1.707 . . . . 0.0 111.747 -171.315 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 73.2 m -96.67 169.91 9.56 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.505 1.522 . . . . 0.0 111.437 172.087 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 61.8 mt -77.69 130.1 36.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 O-C-N 120.939 -1.101 . . . . 0.0 109.034 172.964 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.3 m -97.56 155.81 16.79 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 122.343 1.068 . . . . 0.0 112.756 173.223 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 90.5 p -118.33 162.76 17.76 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 126.665 1.986 . . . . 0.0 110.996 177.504 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 58.3 mt -62.55 -28.13 69.65 Favored 'General case' 0 CA--C 1.536 0.437 0 O-C-N 121.884 -0.51 . . . . 0.0 111.797 175.484 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 89.4 t80 -65.01 -38.87 92.34 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 123.795 0.838 . . . . 0.0 112.766 172.204 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -72.74 -28.37 62.59 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 123.074 0.55 . . . . 0.0 112.011 175.631 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 86.3 mt -72.39 -44.63 62.22 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-N 118.531 0.605 . . . . 0.0 111.971 169.89 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.0 mm-40 -55.38 -38.4 68.82 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.041 1.336 . . . . 0.0 112.569 172.394 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 -60.09 -22.55 62.9 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 113.554 0.946 . . . . 0.0 113.554 177.351 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 18.7 m-85 -103.39 1.69 32.93 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.672 1.589 . . . . 0.0 114.288 175.982 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 86.4 m -71.97 154.22 41.32 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 120.566 -1.334 . . . . 0.0 111.765 169.07 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 21.4 t-20 . . . . . 0 C--O 1.254 1.313 0 C-N-CA 124.496 1.118 . . . . 0.0 112.933 176.98 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . 0.251 23.4 p90 . . . . . 0 N--CA 1.488 1.448 0 CA-C-O 118.249 -0.881 . . . . 0.0 111.209 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 18.6 m -69.7 161.62 4.33 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.281 0 CA-C-N 120.569 1.532 . . . . 0.0 111.98 170.66 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 8.5 p-10 -55.46 135.85 50.2 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.735 1.214 . . . . 0.0 112.401 171.837 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -166.73 163.23 16.57 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 124.991 1.316 . . . . 0.0 110.979 -169.344 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 98.4 m-70 -69.77 136.47 50.92 Favored 'General case' 0 CA--C 1.545 0.778 0 O-C-N 121.224 -0.922 . . . . 0.0 110.385 168.663 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 72.4 mt -140.67 131.45 25.8 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 124.808 1.243 . . . . 0.0 109.518 -177.472 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.6 t -145.6 147.18 31.78 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -176.71 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 56.1 -123.52 31.33 Favored Glycine 0 CA--C 1.528 0.873 0 C-N-CA 124.742 1.163 . . . . 0.0 113.174 172.441 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 23.8 p -55.85 -41.38 74.24 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.299 1.04 . . . . 0.0 112.986 176.263 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 14.7 m-70 -70.28 -32.21 69.91 Favored 'General case' 0 CA--C 1.541 0.63 0 O-C-N 120.682 -1.261 . . . . 0.0 112.575 178.619 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 46.5 tp -68.14 -41.18 82.04 Favored 'General case' 0 N--CA 1.471 0.59 0 O-C-N 121.581 -0.699 . . . . 0.0 111.003 171.221 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 25.5 t -61.57 -45.74 98.01 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 C-N-CA 124.23 1.012 . . . . 0.0 110.774 173.321 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -59.59 -46.29 89.37 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 123.97 0.908 . . . . 0.0 111.652 174.299 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.89 -41.32 99.38 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 121.505 -0.747 . . . . 0.0 112.215 178.372 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 73.6 mt -64.18 -41.25 97.18 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 118.768 -0.634 . . . . 0.0 111.521 174.542 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 -59.31 -44.55 92.55 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-N 119.798 1.181 . . . . 0.0 112.286 171.0 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 67.8 mt -67.16 -42.28 84.59 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.172 0.989 . . . . 0.0 112.965 -179.636 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 53.8 t -74.93 -49.39 29.03 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 123.419 0.688 . . . . 0.0 111.659 178.975 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 58.1 m -78.03 -33.46 51.06 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 113.267 0.84 . . . . 0.0 113.267 -172.352 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 64.8 -135.33 38.02 Favored Glycine 0 CA--C 1.53 1.006 0 C-N-CA 124.024 0.821 . . . . 0.0 112.125 179.095 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -62.05 -23.21 66.34 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 124.539 1.136 . . . . 0.0 113.554 -178.423 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 88.2 mtm180 -59.79 -38.29 81.48 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.087 0.955 . . . . 0.0 112.876 176.893 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 76.78 178.22 46.12 Favored Glycine 0 CA--C 1.533 1.215 0 C-N-CA 124.12 0.867 . . . . 0.0 112.117 -168.606 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 54.4 p90 -141.41 157.46 45.15 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 113.898 1.073 . . . . 0.0 113.898 -171.612 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -96.42 158.36 15.47 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 126.304 1.841 . . . . 0.0 108.943 167.93 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 26.2 t80 -148.1 143.77 27.38 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 121.403 -0.811 . . . . 0.0 111.906 -173.861 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 18.6 m -141.33 115.54 7.0 Favored Pre-proline 0 N--CA 1.475 0.82 0 C-N-CA 124.725 1.21 . . . . 0.0 109.676 179.592 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -83.55 166.06 13.88 Favored 'Trans proline' 0 CA--C 1.538 0.701 0 C-N-CA 124.316 3.344 . . . . 0.0 111.97 179.496 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 40.6 ttpt . . . . . 0 CA--C 1.545 0.78 0 C-N-CA 123.692 0.797 . . . . 0.0 112.667 170.628 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 2' ' ' ILE . . . . . 0.544 ' N ' ' HG1' ' B' ' 27' ' ' THR . 8.3 tt . . . . . 0 N--CA 1.482 1.141 0 N-CA-C 113.63 0.974 . . . . 0.0 113.63 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 55.6 t -62.52 -30.51 49.33 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 CA-C-N 119.069 0.85 . . . . 0.0 111.176 178.862 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -69.5 -36.89 76.9 Favored 'General case' 0 CA--C 1.541 0.608 0 O-C-N 120.813 -1.18 . . . . 0.0 111.009 174.94 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 19.8 tp60 -77.73 -36.47 50.85 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.757 0.823 . . . . 0.0 112.219 -179.754 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 56.2 m -97.47 -27.26 14.52 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 115.069 1.507 . . . . 0.0 115.069 -175.85 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 22.8 t -102.01 -58.0 1.96 Allowed 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 120.006 1.275 . . . . 0.0 111.964 -176.927 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 15.5 m -65.8 -55.62 16.21 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 124.413 1.085 . . . . 0.0 109.498 177.32 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 74.8 m -89.89 176.0 6.99 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 124.112 0.965 . . . . 0.0 111.035 167.329 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 11.3 tt -92.65 147.09 5.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 124.033 0.933 . . . . 0.0 110.466 171.453 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.6 p -130.3 154.73 47.32 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 114.034 1.124 . . . . 0.0 114.034 176.643 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 47.0 t -92.95 153.94 18.47 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.698 1.599 . . . . 0.0 112.824 178.59 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 10.8 mp -59.36 -28.49 66.91 Favored 'General case' 0 N--CA 1.47 0.548 0 O-C-N 121.321 -0.862 . . . . 0.0 111.824 172.214 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.8 t80 -60.85 -36.22 78.57 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 121.466 -0.772 . . . . 0.0 112.529 170.647 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -76.22 -37.5 57.66 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 123.809 0.844 . . . . 0.0 110.392 177.637 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 93.7 mt -59.48 -43.13 93.35 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 123.288 0.635 . . . . 0.0 111.539 172.708 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -67.64 -33.05 74.19 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 113.412 0.894 . . . . 0.0 113.412 172.578 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 -70.59 -27.48 64.14 Favored 'General case' 0 CA--C 1.544 0.749 0 CA-C-N 119.652 1.115 . . . . 0.0 113.504 177.04 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 17.2 m-85 -79.0 -5.38 53.77 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 124.069 0.948 . . . . 0.0 113.482 169.351 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 2.8 t -82.04 168.35 17.89 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.785 1.234 . . . . 0.0 112.367 171.065 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.251 1.177 0 C-N-CA 125.34 1.456 . . . . 0.0 113.0 -174.303 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 65.6 m-85 . . . . . 0 N--CA 1.487 1.416 0 CA-C-O 119.642 -0.218 . . . . 0.0 110.525 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 26.8 t -84.97 115.76 27.37 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 N-CA-C 106.742 -1.577 . . . . 0.0 106.742 168.689 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -154.89 146.25 22.98 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.352 1.061 . . . . 0.0 112.92 -169.554 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 29.3 tt0 -158.62 160.36 36.45 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.13 0.972 . . . . 0.0 111.144 -169.831 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 70.7 m-70 -86.56 128.74 35.0 Favored 'General case' 0 CA--C 1.545 0.762 0 O-C-N 121.509 -0.745 . . . . 0.0 110.578 168.89 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 66.3 mt -143.03 133.91 25.44 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 126.604 1.962 . . . . 0.0 109.582 -173.224 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -137.76 140.08 40.44 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 123.89 0.876 . . . . 0.0 112.24 -172.074 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 52.94 -123.35 24.07 Favored Glycine 0 N--CA 1.474 1.171 0 C-N-CA 124.387 0.994 . . . . 0.0 114.39 169.536 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 25.2 p -58.64 -36.38 74.01 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.174 0.989 . . . . 0.0 113.119 177.109 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 93.3 m-70 -66.87 -36.83 83.2 Favored 'General case' 0 CA--C 1.54 0.559 0 O-C-N 120.739 -1.225 . . . . 0.0 111.791 175.001 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 40.2 tp -67.97 -41.75 81.9 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 123.721 0.808 . . . . 0.0 111.753 173.506 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 50.9 t -59.44 -47.67 89.88 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.137 0 C-N-CA 124.329 1.051 . . . . 0.0 111.038 172.808 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -63.57 -40.45 97.0 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 123.116 0.567 . . . . 0.0 112.042 176.336 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.1 -42.65 99.64 Favored 'General case' 0 CA--C 1.534 0.342 0 O-C-N 121.273 -0.892 . . . . 0.0 112.292 174.807 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 49.2 mt -58.94 -43.1 91.15 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 118.887 0.767 . . . . 0.0 111.566 174.925 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 23.7 m-85 -61.19 -47.29 86.81 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 118.479 0.581 . . . . 0.0 112.319 172.641 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 72.3 mt -68.85 -42.29 77.3 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.587 0.755 . . . . 0.0 112.807 -177.713 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 74.0 t -79.17 -41.79 23.21 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 C-N-CA 124.403 1.081 . . . . 0.0 111.821 -173.905 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 21.7 t -85.8 -33.2 21.43 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 113.809 1.04 . . . . 0.0 113.809 178.607 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 83.84 -153.78 30.08 Favored Glycine 0 CA--C 1.53 1.023 0 C-N-CA 124.468 1.032 . . . . 0.0 112.464 -174.768 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -68.56 -7.34 31.76 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 115.296 1.591 . . . . 0.0 115.296 -172.815 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 85.0 mtm180 -58.96 -36.58 75.05 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 124.906 1.282 . . . . 0.0 113.29 -178.579 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 86.48 147.16 10.5 Favored Glycine 0 CA--C 1.534 1.273 0 C-N-CA 125.2 1.381 . . . . 0.0 113.748 175.085 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 54.0 p90 -138.72 175.2 9.76 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.96 1.704 . . . . 0.0 112.594 -170.714 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -136.65 109.71 7.72 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.12 1.368 . . . . 0.0 109.236 169.46 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -88.68 149.72 23.36 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 113.215 0.82 . . . . 0.0 113.215 -179.292 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 27' ' ' THR . . . . . 0.544 ' HG1' ' N ' ' A' ' 2' ' ' ILE . 19.0 p -120.39 73.25 21.15 Favored Pre-proline 0 N--CA 1.475 0.79 0 C-N-CA 125.868 1.667 . . . . 0.0 112.543 -172.356 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_endo -72.12 144.84 43.03 Favored 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 123.338 2.692 . . . . 0.0 110.789 169.48 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 70.3 tttt . . . . . 0 CA--C 1.551 1.01 0 C-N-CA 124.046 0.938 . . . . 0.0 113.517 -175.883 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 16.6 tt . . . . . 0 N--CA 1.48 1.045 0 N-CA-C 113.954 1.094 . . . . 0.0 113.954 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 23.5 t -61.08 -39.97 84.13 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.062 0 CA-C-N 118.924 0.784 . . . . 0.0 110.408 -177.962 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -64.7 -16.62 63.15 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 126.07 1.748 . . . . 0.0 113.138 176.551 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 40.2 tt0 -90.68 -59.58 2.14 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 123.535 0.734 . . . . 0.0 109.247 168.964 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 76.0 m -55.91 -35.39 66.52 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 114.612 1.338 . . . . 0.0 114.612 -171.379 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 74.1 m -81.29 -20.8 40.07 Favored 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 113.885 1.068 . . . . 0.0 113.885 -178.967 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 38.3 m -114.83 -36.9 4.34 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 124.886 1.275 . . . . 0.0 112.534 -168.406 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 7.6 t -125.61 -164.91 1.35 Allowed 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 126.207 1.803 . . . . 0.0 109.911 171.343 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 13.9 tt -86.36 145.9 7.12 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.676 0 C-N-CA 124.387 1.075 . . . . 0.0 110.79 174.528 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 13.7 p -137.08 156.1 48.82 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.144 0.978 . . . . 0.0 112.334 174.389 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 14.5 m -107.24 149.21 28.0 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 113.953 1.094 . . . . 0.0 113.953 -167.749 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 27.4 mt -61.45 -29.93 70.26 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 121.272 -0.892 . . . . 0.0 111.696 174.959 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 91.7 t80 -59.95 -30.87 69.37 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.304 1.441 . . . . 0.0 113.05 170.693 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 59.1 mt-30 -80.88 -36.26 31.54 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 123.617 0.767 . . . . 0.0 110.921 174.731 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 59.7 mt -62.69 -40.54 97.46 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 118.656 0.662 . . . . 0.0 112.354 173.478 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 26.8 mt-10 -60.29 -20.38 58.86 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 114.814 1.413 . . . . 0.0 114.814 175.204 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 26.6 t30 -59.69 -27.39 66.38 Favored 'General case' 0 CA--C 1.546 0.813 0 CA-C-N 119.579 1.081 . . . . 0.0 112.723 174.343 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 76.9 m-85 -100.8 -0.06 37.78 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.331 1.452 . . . . 0.0 114.293 -174.495 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 65.8 m -75.18 126.59 31.33 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.431 0.692 . . . . 0.0 111.822 176.503 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.252 1.228 0 C-N-CA 129.169 2.988 . . . . 0.0 112.154 -171.925 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 5.9 p90 . . . . . 0 N--CA 1.483 1.221 0 N-CA-C 111.587 0.217 . . . . 0.0 111.587 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 72.3 t -90.26 146.51 6.1 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.222 0 C-N-CA 124.874 1.27 . . . . 0.0 109.503 171.333 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 53.1 p-10 -149.89 151.32 33.24 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 124.761 1.224 . . . . 0.0 113.568 -178.983 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 2.9 mm-40 -163.71 172.23 14.49 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.359 1.464 . . . . 0.0 111.944 -170.075 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 99.8 m-70 -90.62 135.05 33.95 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.615 1.166 . . . . 0.0 109.905 168.523 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 78.6 mt -149.41 139.44 22.06 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 124.775 1.23 . . . . 0.0 110.359 -174.607 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 2.4 t -151.57 152.36 32.8 Favored 'General case' 0 C--O 1.237 0.402 0 O-C-N 121.072 -1.018 . . . . 0.0 113.405 177.029 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 56.31 -128.1 45.22 Favored Glycine 0 CA--C 1.53 0.988 0 C-N-CA 124.738 1.161 . . . . 0.0 113.743 171.602 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 29.6 p -57.29 -37.53 72.57 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 124.36 1.064 . . . . 0.0 112.91 177.38 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 66.9 m-70 -72.31 -29.03 63.47 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 119.589 1.086 . . . . 0.0 113.027 176.665 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 50.8 tp -72.08 -45.27 61.35 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 119.035 0.834 . . . . 0.0 110.926 170.51 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 45.1 t -58.59 -40.91 80.55 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.159 0 C-N-CA 124.205 1.002 . . . . 0.0 111.231 174.184 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 13' ' ' GLU . . . . . 0.409 ' HA ' ' CE2' ' B' ' 16' ' ' TYR . 39.9 tt0 -61.25 -46.38 90.6 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 125.234 1.414 . . . . 0.0 112.036 171.092 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.23 -41.36 96.73 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 121.55 -0.719 . . . . 0.0 111.799 176.637 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -55.96 -51.98 65.79 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 119.138 0.881 . . . . 0.0 110.728 172.011 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 16' ' ' TYR . . . . . 0.409 ' CE2' ' HA ' ' B' ' 13' ' ' GLU 0.265 1.0 OUTLIER -69.47 -29.41 67.06 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 113.819 1.044 . . . . 0.0 113.819 -177.718 . . . . . . . . 4 4 . 1 . 017 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 82.4 mt -74.33 -41.74 60.6 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.161 0.984 . . . . 0.0 112.551 173.931 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 38.8 t -67.84 -47.91 77.56 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 C-N-CA 123.698 0.799 . . . . 0.0 110.786 177.81 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 86.2 m -73.75 -39.12 64.45 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 112.682 0.623 . . . . 0.0 112.682 -177.619 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.25 -129.0 40.06 Favored Glycine 0 CA--C 1.528 0.876 0 C-N-CA 123.913 0.768 . . . . 0.0 111.687 -179.624 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -60.37 -23.97 64.73 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.905 1.282 . . . . 0.0 113.182 177.527 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 85.3 mtm180 -65.39 -30.15 70.94 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.042 0.937 . . . . 0.0 113.248 178.738 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.89 175.99 11.76 Favored Glycine 0 CA--C 1.536 1.372 0 C-N-CA 124.889 1.233 . . . . 0.0 113.164 -173.766 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 15.9 p90 -143.15 161.12 39.05 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.759 1.224 . . . . 0.0 111.669 174.448 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 9.0 t80 -127.78 -13.7 5.23 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 113.822 1.045 . . . . 0.0 113.822 -176.115 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 88.3 t80 -61.18 127.12 29.99 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 124.198 0.999 . . . . 0.0 113.622 -179.569 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 12.2 p -92.49 128.71 43.39 Favored Pre-proline 0 CA--C 1.54 0.569 0 C-N-CA 125.466 1.507 . . . . 0.0 110.212 174.539 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_endo -67.38 131.47 24.91 Favored 'Trans proline' 0 C--N 1.35 0.655 0 C-N-CA 123.273 2.649 . . . . 0.0 111.421 -169.94 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 96.8 mttt . . . . . 0 N--CA 1.482 1.134 0 C-N-CA 126.787 2.035 . . . . 0.0 114.281 -179.028 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 44.6 pt . . . . . 0 N--CA 1.48 1.061 0 N-CA-C 115.5 1.667 . . . . 0.0 115.5 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 3' ' ' VAL . . . . . 0.648 HG21 ' HA ' ' B' ' 28' ' ' PRO . 75.2 t -56.07 -35.98 43.44 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.313 0 CA-C-N 120.462 1.483 . . . . 0.0 111.193 178.23 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 18.4 tt0 -70.81 -17.92 62.75 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 123.735 0.814 . . . . 0.0 112.769 179.102 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 37.5 tt0 -88.69 -51.76 5.5 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 124.816 1.246 . . . . 0.0 109.434 168.826 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 88.5 m -55.92 -38.77 70.72 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.444 1.098 . . . . 0.0 112.747 -176.231 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 96.0 m -76.14 -27.87 57.19 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 113.74 1.015 . . . . 0.0 113.74 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 82.0 p -102.95 -22.85 13.77 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 124.829 1.252 . . . . 0.0 113.161 -172.783 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 10.6 t -151.2 -166.2 2.46 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.289 1.836 . . . . 0.0 110.371 -174.868 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 56.7 mt -81.1 139.36 18.17 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 O-C-N 120.448 -1.407 . . . . 0.0 110.594 174.658 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 11.8 p -133.81 161.08 35.72 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 124.532 1.133 . . . . 0.0 111.207 168.628 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 24.2 p -103.1 159.28 15.67 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 113.669 0.989 . . . . 0.0 113.669 -171.552 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 56.4 mt -68.04 -27.46 66.55 Favored 'General case' 0 CA--C 1.537 0.451 0 O-C-N 121.193 -0.942 . . . . 0.0 111.86 174.805 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.9 t80 -66.05 -34.03 77.14 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 123.595 0.758 . . . . 0.0 112.766 171.471 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 70.1 mt-30 -67.12 -43.29 82.81 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 118.834 -0.603 . . . . 0.0 110.804 170.704 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 36.9 mt -58.65 -45.9 88.3 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 118.932 0.787 . . . . 0.0 111.852 175.502 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 11.3 tt0 -65.47 -23.01 66.81 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 113.78 1.03 . . . . 0.0 113.78 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 13.8 t-20 -62.55 -22.4 66.3 Favored 'General case' 0 CA--C 1.549 0.91 0 O-C-N 120.983 -1.073 . . . . 0.0 113.089 176.8 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -98.55 2.86 47.88 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 125.626 1.571 . . . . 0.0 113.794 175.57 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 11.5 t -76.64 169.93 17.36 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.627 1.171 . . . . 0.0 111.46 169.534 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 8.2 m-80 . . . . . 0 C--O 1.251 1.165 0 C-N-CA 124.036 0.934 . . . . 0.0 112.109 172.343 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 44.0 t80 . . . . . 0 N--CA 1.484 1.225 0 CA-C-O 119.784 -0.15 . . . . 0.0 110.876 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 13.8 p -66.54 150.55 10.95 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 C-N-CA 124.539 1.136 . . . . 0.0 111.708 175.337 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . 0.269 0.8 OUTLIER 47.98 59.03 4.5 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 126.244 1.818 . . . . 0.0 113.861 -179.998 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 -129.85 162.44 28.53 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.327 1.451 . . . . 0.0 111.028 -172.744 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 28.2 m80 -76.44 135.41 39.41 Favored 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 164.942 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 82.3 mt -141.76 126.83 18.4 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 124.993 1.317 . . . . 0.0 109.856 -176.993 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 3.7 t -144.89 151.2 38.34 Favored 'General case' 0 N--CA 1.468 0.456 0 O-C-N 121.383 -0.823 . . . . 0.0 112.851 176.976 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.13 -124.93 34.36 Favored Glycine 0 CA--C 1.53 0.973 0 C-N-CA 125.018 1.294 . . . . 0.0 112.847 172.025 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 11.4 p -50.16 -48.64 53.74 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 125.361 1.464 . . . . 0.0 112.981 175.69 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -67.07 -34.56 77.93 Favored 'General case' 0 CA--C 1.541 0.63 0 O-C-N 121.171 -0.956 . . . . 0.0 112.216 -178.261 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 11' ' ' LEU . . . . . 0.592 HD21 HG22 ' A' ' 3' ' ' VAL . 52.2 tp -70.91 -42.57 69.77 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.623 0.769 . . . . 0.0 111.723 175.007 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 50.9 t -62.1 -43.09 97.3 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.858 0 C-N-CA 124.063 0.945 . . . . 0.0 110.547 174.531 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 27.1 mm-40 -63.82 -42.07 97.74 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 123.25 0.62 . . . . 0.0 112.175 173.573 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.03 -41.68 99.59 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 119.512 1.051 . . . . 0.0 111.811 175.571 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 28.0 mt -58.67 -44.54 90.21 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.822 0.849 . . . . 0.0 111.438 172.804 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 20.0 m-85 -63.01 -41.74 99.65 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 119.243 0.929 . . . . 0.0 112.952 173.268 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 64.7 mt -67.52 -41.09 84.97 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 123.919 0.887 . . . . 0.0 112.274 179.268 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 41.8 t -72.25 -48.56 48.09 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 C-N-CA 124.05 0.94 . . . . 0.0 111.934 177.583 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 48.6 t -81.62 -37.31 27.76 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 112.887 0.699 . . . . 0.0 112.887 -171.839 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 69.65 -144.27 40.02 Favored Glycine 0 CA--C 1.529 0.964 0 C-N-CA 124.111 0.862 . . . . 0.0 112.567 178.364 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -62.59 -21.52 65.68 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 125.091 1.356 . . . . 0.0 113.384 -177.211 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 90.4 mtm180 -58.76 -35.96 73.6 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.866 1.266 . . . . 0.0 113.262 178.82 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.12 142.42 1.92 Allowed Glycine 0 CA--C 1.535 1.313 0 C-N-CA 125.519 1.533 . . . . 0.0 113.517 -178.937 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 52.8 p90 -113.36 147.54 37.49 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.102 1.361 . . . . 0.0 111.077 176.397 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 45.4 p90 -94.97 -14.83 24.04 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.378 1.071 . . . . 0.0 113.709 -176.105 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 25.4 t80 -87.26 107.07 18.33 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.139 1.376 . . . . 0.0 113.506 -169.627 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 20.8 p -76.38 145.63 76.34 Favored Pre-proline 0 N--CA 1.475 0.802 0 C-N-CA 124.657 1.183 . . . . 0.0 110.064 168.831 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 28' ' ' PRO . . . . . 0.648 ' HA ' HG21 ' A' ' 3' ' ' VAL . 73.4 Cg_endo -72.6 151.84 53.05 Favored 'Trans proline' 0 CA--C 1.537 0.651 0 C-N-CA 122.612 2.208 . . . . 0.0 112.59 -172.406 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 22.2 tptm . . . . . 0 CA--C 1.548 0.89 0 C-N-CA 123.956 0.903 . . . . 0.0 112.26 171.584 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 10.8 tp . . . . . 0 N--CA 1.479 0.988 0 N-CA-C 114.179 1.177 . . . . 0.0 114.179 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 5.4 p -66.32 -44.25 91.08 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.102 0 CA-C-N 120.394 1.452 . . . . 0.0 112.621 -172.7 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -75.06 -32.96 61.65 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 118.778 0.717 . . . . 0.0 111.468 174.826 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -65.96 -29.93 70.41 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 124.424 1.09 . . . . 0.0 112.35 -179.858 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 65.6 m -100.6 -26.53 13.79 Favored 'General case' 0 CA--C 1.543 0.703 0 N-CA-C 114.987 1.477 . . . . 0.0 114.987 174.141 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 15.1 t -96.14 -43.97 7.51 Favored 'General case' 0 N--CA 1.479 1.021 0 CA-C-N 120.021 1.282 . . . . 0.0 112.814 -174.974 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 25.5 m -86.18 -44.81 11.9 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 124.652 1.181 . . . . 0.0 110.167 176.898 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 75.4 m -101.36 175.4 5.59 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.976 1.31 . . . . 0.0 111.801 170.109 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 7.7 mt -96.98 141.88 14.94 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 C-N-CA 125.157 1.383 . . . . 0.0 109.468 -179.409 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 12.8 p -136.6 156.29 48.76 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 115.155 1.539 . . . . 0.0 115.155 -177.913 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 34.4 t -101.09 160.85 14.04 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 127.121 2.168 . . . . 0.0 111.334 173.916 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 54.9 mt -58.06 -27.5 63.68 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 123.844 0.858 . . . . 0.0 112.094 171.484 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 86.6 t80 -61.53 -32.11 72.16 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.292 1.037 . . . . 0.0 113.465 172.354 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 37.4 mt-30 -80.31 -33.29 37.7 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 123.901 0.88 . . . . 0.0 110.958 176.625 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 55.5 mt -61.3 -43.94 98.04 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.143 0.577 . . . . 0.0 111.679 169.469 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.3 tt0 -55.58 -28.75 56.81 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.721 1.608 . . . . 0.0 113.849 179.918 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 -63.04 -20.99 65.85 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 113.551 0.945 . . . . 0.0 113.551 178.213 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 73.3 m-85 -102.8 -1.23 30.18 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 125.527 1.531 . . . . 0.0 113.449 -179.165 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 72.0 m -69.47 148.9 48.9 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.162 0.985 . . . . 0.0 113.162 174.443 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 28.4 m120 . . . . . 0 C--O 1.251 1.176 0 C-N-CA 125.024 1.33 . . . . 0.0 112.35 169.325 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 54.8 p90 . . . . . 0 N--CA 1.482 1.168 0 CA-C-O 119.761 -0.161 . . . . 0.0 110.867 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 13.4 p -70.61 122.17 21.9 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.975 0 C-N-CA 123.585 0.754 . . . . 0.0 111.582 -178.909 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 55.7 t30 -169.49 118.21 0.63 Allowed 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.876 1.67 . . . . 0.0 109.901 -177.33 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 2.7 mm-40 -161.25 171.62 18.07 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.816 1.246 . . . . 0.0 111.301 -171.065 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 82.4 m-70 -83.19 141.32 32.0 Favored 'General case' 0 CA--C 1.545 0.782 0 O-C-N 121.51 -0.744 . . . . 0.0 110.829 169.054 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 72.6 mt -141.88 138.88 32.41 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 126.349 1.859 . . . . 0.0 109.049 174.982 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 2.7 t -151.77 148.0 27.34 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 123.176 0.59 . . . . 0.0 112.232 -175.786 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.19 -130.63 47.69 Favored Glycine 0 N--CA 1.472 1.043 0 C-N-CA 124.501 1.048 . . . . 0.0 113.128 174.43 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 18.6 m -53.93 -37.11 63.51 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 124.829 1.252 . . . . 0.0 113.121 177.838 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 88.9 m-70 -68.57 -39.29 81.06 Favored 'General case' 0 CA--C 1.543 0.687 0 O-C-N 121.116 -0.99 . . . . 0.0 111.685 178.612 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 58.3 tp -65.96 -44.5 84.78 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 123.645 0.778 . . . . 0.0 111.462 173.365 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 50.2 t -60.48 -44.89 97.36 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 C-N-CA 124.178 0.991 . . . . 0.0 111.141 176.962 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 27.3 mm-40 -65.28 -42.72 92.87 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.161 0.584 . . . . 0.0 111.943 175.003 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.58 -40.16 96.24 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 119.401 1.0 . . . . 0.0 112.295 177.19 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 32.1 mt -58.46 -50.53 73.4 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 123.217 0.607 . . . . 0.0 110.422 171.671 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 23.5 m-85 -61.86 -33.47 74.24 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 119.637 1.108 . . . . 0.0 113.453 176.52 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 69.4 mt -69.05 -41.9 77.02 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 119.174 0.897 . . . . 0.0 112.419 173.866 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 56.0 t -70.66 -44.36 76.67 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 CA-C-N 118.781 0.719 . . . . 0.0 111.872 177.951 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 34.9 m -81.32 -18.77 44.6 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 114.094 1.146 . . . . 0.0 114.094 -176.281 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 66.99 -146.78 48.64 Favored Glycine 0 CA--C 1.531 1.042 0 C-N-CA 124.229 0.919 . . . . 0.0 111.703 -174.247 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 2.5 pm0 -67.22 -15.51 63.74 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.926 1.291 . . . . 0.0 113.95 179.659 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 76.9 mtp85 -68.71 -31.43 70.51 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.848 0.859 . . . . 0.0 112.52 177.216 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.61 -177.03 49.96 Favored Glycine 0 CA--C 1.533 1.206 0 C-N-CA 125.191 1.377 . . . . 0.0 113.831 -179.156 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 42.4 p90 -123.22 161.95 23.53 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.058 1.343 . . . . 0.0 111.861 178.348 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 82.7 t80 -128.08 115.34 18.29 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.194 0.998 . . . . 0.0 110.056 172.925 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 49.0 t80 -169.28 153.52 5.4 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 125.478 1.511 . . . . 0.0 112.635 -175.089 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 17.4 p -128.29 106.94 19.46 Favored Pre-proline 0 N--CA 1.473 0.714 0 C-N-CA 126.424 1.889 . . . . 0.0 109.933 173.845 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -56.4 142.81 88.54 Favored 'Trans proline' 0 C--N 1.351 0.71 0 C-N-CA 124.255 3.303 . . . . 0.0 112.75 173.451 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 62.1 pttt . . . . . 0 N--CA 1.476 0.859 0 N-CA-C 114.852 1.427 . . . . 0.0 114.852 -175.82 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.068 0 N-CA-C 114.477 1.288 . . . . 0.0 114.477 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 84.2 t -65.76 -52.91 44.32 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 CA-C-N 118.75 0.705 . . . . 0.0 110.452 -175.328 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -64.25 -36.95 85.74 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 117.842 0.292 . . . . 0.0 111.131 178.156 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 52.5 tt0 -62.85 -53.97 45.99 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.812 1.245 . . . . 0.0 111.671 -179.199 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 51.9 m -70.24 -26.52 63.88 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 113.13 0.789 . . . . 0.0 113.13 178.008 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 89.8 m -71.14 -53.29 15.07 Favored 'General case' 0 N--CA 1.472 0.662 0 O-C-N 120.965 -1.085 . . . . 0.0 111.274 173.894 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 82.4 p -83.97 -16.92 42.3 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 124.599 1.16 . . . . 0.0 114.11 -171.308 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 77.6 p -143.48 168.33 20.1 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.904 0.882 . . . . 0.0 112.677 -179.011 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 20.4 mt -68.2 131.57 33.32 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 O-C-N 121.265 -0.897 . . . . 0.0 110.038 172.555 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 13.6 p -126.23 179.12 5.41 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.505 1.122 . . . . 0.0 111.914 171.789 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 88.2 p -139.78 165.14 28.08 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 125.258 1.423 . . . . 0.0 111.759 -171.547 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 11.2 mp -61.5 -29.42 69.97 Favored 'General case' 0 CA--C 1.54 0.562 0 O-C-N 121.29 -0.881 . . . . 0.0 112.306 -179.409 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 81.9 t80 -63.51 -37.48 87.47 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 112.872 0.693 . . . . 0.0 112.872 170.92 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 60.1 mt-30 -74.43 -33.74 63.04 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 124.063 0.945 . . . . 0.0 111.403 175.45 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 89.2 mt -63.28 -51.5 65.83 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 118.604 0.638 . . . . 0.0 110.988 171.601 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 25.0 mt-10 -66.28 -27.94 68.32 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 113.483 0.92 . . . . 0.0 113.483 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 16.1 t30 -58.84 -28.72 66.34 Favored 'General case' 0 CA--C 1.546 0.822 0 CA-C-N 119.317 0.962 . . . . 0.0 112.84 176.9 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 52.0 m-85 -98.09 5.69 48.38 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.615 1.566 . . . . 0.0 113.308 176.606 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 81.1 m -98.7 163.84 12.47 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.837 1.255 . . . . 0.0 112.62 170.911 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 73.4 m-80 . . . . . 0 C--O 1.251 1.17 0 CA-C-O 117.935 -1.031 . . . . 0.0 112.779 177.223 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 26.6 t80 . . . . . 0 N--CA 1.487 1.383 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 4.3 p -60.89 148.75 8.64 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 CA-C-N 120.409 1.459 . . . . 0.0 112.482 -178.803 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 1.9 t30 65.45 52.63 1.36 Allowed 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 125.319 1.447 . . . . 0.0 111.586 172.562 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 2.9 mm-40 -149.21 167.6 25.55 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.32 1.048 . . . . 0.0 111.7 -177.725 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 28.0 m-70 -78.55 143.84 36.15 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 123.35 0.66 . . . . 0.0 109.382 167.991 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 60.8 mt -140.86 126.25 18.74 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 125.596 1.558 . . . . 0.0 109.483 174.425 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 5.2 t -142.53 149.62 39.36 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 121.598 -0.689 . . . . 0.0 112.414 -175.687 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 59.5 -132.06 51.49 Favored Glycine 0 CA--C 1.529 0.955 0 C-N-CA 124.392 0.996 . . . . 0.0 113.488 172.362 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 24.4 p -57.15 -36.22 70.47 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.81 1.244 . . . . 0.0 113.11 177.927 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 67.5 m-70 -71.97 -29.65 64.47 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 119.665 1.12 . . . . 0.0 113.001 175.643 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 58.3 tp -70.75 -42.75 70.06 Favored 'General case' 0 N--CA 1.471 0.581 0 O-C-N 121.287 -0.883 . . . . 0.0 111.403 170.367 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 43.5 t -58.95 -48.39 86.65 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 124.415 1.086 . . . . 0.0 110.533 173.909 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -55.96 -49.7 72.83 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.354 1.462 . . . . 0.0 111.692 173.611 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.27 -47.91 83.86 Favored 'General case' 0 CA--C 1.534 0.359 0 O-C-N 121.618 -0.676 . . . . 0.0 111.937 178.487 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 50.4 mt -60.23 -40.9 91.83 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 118.884 0.765 . . . . 0.0 111.524 178.568 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 11.8 m-85 -63.63 -47.13 82.63 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-N 119.139 0.881 . . . . 0.0 112.716 173.575 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 9.2 mp -69.7 -38.23 76.9 Favored 'General case' 0 N--CA 1.472 0.632 0 O-C-N 121.614 -0.679 . . . . 0.0 112.463 -178.373 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 73.8 t -76.08 -43.76 37.94 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 C-N-CA 124.391 1.077 . . . . 0.0 111.633 -177.559 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 64.5 m -96.71 -20.62 18.12 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 114.763 1.394 . . . . 0.0 114.763 -173.81 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 71.68 -143.56 35.47 Favored Glycine 0 CA--C 1.533 1.2 0 C-N-CA 124.584 1.087 . . . . 0.0 112.466 179.243 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -63.67 -17.7 63.22 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 125.012 1.325 . . . . 0.0 113.65 -178.531 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 61.6 mtm180 -61.23 -31.2 70.99 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.354 1.062 . . . . 0.0 113.729 -179.516 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.18 171.81 29.66 Favored Glycine 0 CA--C 1.533 1.173 0 C-N-CA 124.192 0.901 . . . . 0.0 113.872 178.634 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 51.7 p90 -137.67 155.98 48.54 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 125.682 1.593 . . . . 0.0 113.333 -169.793 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 2.8 t80 -100.43 114.17 27.52 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.548 1.539 . . . . 0.0 108.944 169.108 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 15.6 t80 -85.36 57.2 4.32 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 124.953 1.301 . . . . 0.0 112.245 -173.285 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 2.7 m -65.89 122.69 82.18 Favored Pre-proline 0 N--CA 1.476 0.869 0 C-N-CA 125.255 1.422 . . . . 0.0 112.413 -169.598 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -80.01 -171.84 1.36 Allowed 'Trans proline' 0 CA--C 1.537 0.655 0 C-N-CA 124.165 3.244 . . . . 0.0 111.305 175.151 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 61.4 tttm . . . . . 0 CA--C 1.547 0.842 0 O-C-N 121.273 -0.892 . . . . 0.0 113.284 174.025 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 18.1 tt . . . . . 0 N--CA 1.482 1.144 0 N-CA-C 115.921 1.823 . . . . 0.0 115.921 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 5.4 p -62.24 -27.21 42.14 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 O-C-N 121.294 -0.879 . . . . 0.0 112.492 176.105 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -73.71 -1.25 18.35 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 124.808 1.243 . . . . 0.0 112.862 174.821 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 12.2 tt0 -111.3 -57.46 2.24 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.046 1.338 . . . . 0.0 108.978 168.129 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 67.2 m -67.0 -27.61 67.58 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 114.802 1.408 . . . . 0.0 114.802 -170.604 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 11.9 t -92.64 -30.65 15.48 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.459 0.703 . . . . 0.0 112.819 -177.592 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 37.8 p -87.85 -31.65 19.42 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 126.344 1.857 . . . . 0.0 112.251 -178.965 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 9.1 t -142.59 -164.81 1.9 Allowed 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 126.268 1.827 . . . . 0.0 109.997 179.798 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 23.1 mm -86.52 144.66 8.94 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 C-N-CA 125.28 1.432 . . . . 0.0 110.469 177.057 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 15.0 p -137.29 172.81 12.43 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.119 1.368 . . . . 0.0 111.337 169.087 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 46.3 t -120.1 151.32 39.22 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 124.249 1.019 . . . . 0.0 112.354 -175.846 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 26.1 mt -60.77 -27.38 67.94 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.76 0.824 . . . . 0.0 112.116 175.431 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 87.1 t80 -60.87 -32.29 71.73 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 123.885 0.874 . . . . 0.0 113.178 170.262 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 68.6 mt-30 -77.73 -31.77 52.42 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.785 0.834 . . . . 0.0 110.934 176.989 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 41.2 mt -59.96 -50.37 74.0 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 122.95 0.5 . . . . 0.0 110.309 169.707 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -60.96 -28.92 69.34 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 113.294 0.85 . . . . 0.0 113.294 175.333 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 31.6 t30 -73.28 -33.88 65.46 Favored 'General case' 0 CA--C 1.545 0.778 0 CA-C-N 118.859 0.754 . . . . 0.0 112.415 176.674 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -70.81 -48.59 53.36 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.972 0.909 . . . . 0.0 112.09 171.937 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 85.0 m -54.13 134.61 44.23 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.067 1.347 . . . . 0.0 113.244 179.399 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 5.4 p30 . . . . . 0 C--O 1.252 1.189 0 C-N-CA 126.13 1.772 . . . . 0.0 113.518 -174.999 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 60.5 t80 . . . . . 0 N--CA 1.486 1.361 0 CA-C-O 119.618 -0.23 . . . . 0.0 110.527 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 10.3 t 78.37 -34.65 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 C-N-CA 128.346 2.658 . . . . 0.0 111.336 -175.99 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 11.4 p-10 -71.19 135.08 47.38 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 125.863 1.665 . . . . 0.0 112.459 169.594 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 3.3 tt0 -167.85 169.88 11.16 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.881 1.272 . . . . 0.0 111.701 179.705 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 98.5 m-70 -86.75 147.48 25.83 Favored 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 165.02 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 64.5 mt -149.22 141.26 23.86 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.784 1.634 . . . . 0.0 109.632 174.91 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.7 t -147.88 144.35 28.04 Favored 'General case' 0 N--CA 1.474 0.75 0 O-C-N 120.97 -1.081 . . . . 0.0 112.997 -178.076 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 50.04 -125.23 19.24 Favored Glycine 0 N--CA 1.471 1.003 0 C-N-CA 125.123 1.344 . . . . 0.0 113.841 171.496 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 20.0 m -56.83 -33.15 66.47 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.568 1.147 . . . . 0.0 113.248 178.492 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -73.25 -36.27 66.36 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.075 -1.016 . . . . 0.0 111.802 176.727 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 26.8 tp -68.49 -43.41 76.95 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 123.889 0.876 . . . . 0.0 111.041 173.253 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 50.4 t -60.45 -44.25 95.87 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.984 0 C-N-CA 124.731 1.212 . . . . 0.0 111.253 173.277 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -64.56 -43.88 92.52 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 123.446 0.698 . . . . 0.0 111.537 175.68 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.07 -45.18 94.65 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 123.33 0.652 . . . . 0.0 111.677 176.594 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 18.9 mt -53.66 -51.0 64.56 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.196 0.999 . . . . 0.0 111.118 172.869 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 21.1 m-85 -60.46 -46.52 89.77 Favored 'General case' 0 CA--C 1.542 0.662 0 O-C-N 121.479 -0.763 . . . . 0.0 113.025 177.207 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 84.4 mt -67.72 -40.72 84.22 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 123.672 0.789 . . . . 0.0 112.907 -178.998 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 49.5 t -75.21 -44.56 43.0 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 C-N-CA 123.826 0.85 . . . . 0.0 111.598 -178.599 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 78.3 m -87.53 -23.79 24.27 Favored 'General case' 0 N--CA 1.466 0.348 0 N-CA-C 114.413 1.264 . . . . 0.0 114.413 -171.619 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 52.35 -103.88 0.14 Allowed Glycine 0 CA--C 1.533 1.18 0 C-N-CA 124.428 1.013 . . . . 0.0 114.04 169.43 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -80.1 -16.11 55.7 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 126.181 1.792 . . . . 0.0 114.729 -177.468 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -70.76 -31.05 67.72 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 119.077 0.853 . . . . 0.0 112.385 175.753 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 82.64 142.16 4.26 Favored Glycine 0 CA--C 1.535 1.314 0 C-N-CA 125.027 1.299 . . . . 0.0 112.213 -173.913 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -80.62 173.39 12.65 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 114.197 1.184 . . . . 0.0 114.197 -175.387 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 19.3 t80 -156.37 39.82 0.35 Allowed 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.444 1.097 . . . . 0.0 112.033 -174.388 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 60.3 t80 -54.66 140.56 35.08 Favored 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 113.74 1.015 . . . . 0.0 113.74 -177.861 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 38.6 m -140.02 117.79 8.39 Favored Pre-proline 0 N--CA 1.474 0.765 0 C-N-CA 125.119 1.368 . . . . 0.0 109.651 177.688 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_exo -56.36 -178.71 0.08 OUTLIER 'Trans proline' 0 C--N 1.353 0.8 1 C-N-CA 125.668 4.245 . . . . 0.0 115.427 170.136 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 45.1 mttm . . . . . 0 N--CA 1.474 0.733 0 C-N-CA 125.373 1.469 . . . . 0.0 113.387 -179.038 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.483 1.214 0 N-CA-C 114.875 1.435 . . . . 0.0 114.875 . . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 23.2 t -59.45 -41.58 85.03 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.171 0 CA-C-N 119.879 1.218 . . . . 0.0 110.618 -174.248 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -70.3 -9.2 55.37 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.93 1.692 . . . . 0.0 113.472 -179.569 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 54.8 tt0 -103.54 -62.98 1.23 Allowed 'General case' 0 C--O 1.226 -0.178 0 C-N-CA 124.38 1.072 . . . . 0.0 109.24 169.815 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 86.8 m -55.48 -32.67 63.01 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 114.656 1.354 . . . . 0.0 114.656 -169.547 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 84.1 m -76.0 -20.59 57.72 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 113.889 1.07 . . . . 0.0 113.889 -176.456 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 39.5 p -126.09 -43.49 1.81 Allowed 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 125.564 1.545 . . . . 0.0 112.251 -171.053 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 67.5 m -102.84 176.51 5.13 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 127.136 2.174 . . . . 0.0 110.963 171.527 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 69.1 mt -82.24 145.57 8.44 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 O-C-N 120.619 -1.3 . . . . 0.0 110.077 173.781 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 15.0 p -136.57 -179.9 5.97 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.113 1.365 . . . . 0.0 111.432 170.492 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 93.4 p -138.49 159.86 41.02 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 121.149 -0.969 . . . . 0.0 112.02 -171.798 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 39.7 mt -62.42 -30.94 71.59 Favored 'General case' 0 CA--C 1.541 0.597 0 O-C-N 122.043 -0.411 . . . . 0.0 111.516 174.956 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.3 t80 -63.93 -34.15 77.32 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 123.784 0.833 . . . . 0.0 113.17 172.168 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 36.1 mt-30 -76.82 -26.59 54.54 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 123.639 0.776 . . . . 0.0 111.914 172.888 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 38.0 mt -71.05 -41.67 70.46 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 119.427 1.012 . . . . 0.0 111.901 169.673 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -53.55 -33.1 53.46 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.401 1.08 . . . . 0.0 113.182 175.055 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.0 t-20 -60.08 -22.44 62.73 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 178.075 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 70.1 m-85 -107.91 9.26 28.75 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.718 1.607 . . . . 0.0 114.184 177.357 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 75.9 m -83.39 147.31 27.96 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 121.113 -0.992 . . . . 0.0 111.795 169.545 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 83.4 m-20 . . . . . 0 C--O 1.254 1.3 0 CA-C-O 117.774 -1.107 . . . . 0.0 112.074 173.086 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . 0.277 8.8 p90 . . . . . 0 N--CA 1.496 1.83 0 CA-C-O 117.978 -1.011 . . . . 0.0 108.984 . . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 48.8 t -140.76 91.46 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 C-N-CA 126.33 1.852 . . . . 0.0 106.718 169.523 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 -162.36 152.1 16.15 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.617 1.167 . . . . 0.0 113.088 -167.836 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -174.98 177.68 1.92 Allowed 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 126.646 1.978 . . . . 0.0 110.688 -174.977 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -83.19 145.25 29.28 Favored 'General case' 0 CA--C 1.546 0.794 0 O-C-N 120.983 -1.073 . . . . 0.0 109.692 167.454 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 77.2 mt -147.99 138.43 22.93 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 125.892 1.677 . . . . 0.0 110.106 177.261 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 3.6 t -148.0 155.45 41.53 Favored 'General case' 0 CA--C 1.535 0.401 0 O-C-N 120.977 -1.077 . . . . 0.0 113.117 175.342 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 53.93 -130.6 43.69 Favored Glycine 0 N--CA 1.469 0.894 0 C-N-CA 124.874 1.226 . . . . 0.0 113.402 171.791 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.8 m -52.3 -39.35 60.42 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 124.529 1.132 . . . . 0.0 112.768 178.667 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 12.9 t60 -76.19 -30.67 58.12 Favored 'General case' 0 CA--C 1.541 0.626 0 O-C-N 121.097 -1.002 . . . . 0.0 112.578 -177.209 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 50.2 tp -67.94 -41.2 82.87 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 121.54 -0.725 . . . . 0.0 110.899 169.091 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 53.8 t -63.43 -43.1 98.31 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 C-N-CA 124.267 1.027 . . . . 0.0 111.389 174.64 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 57.0 mt-10 -56.88 -50.33 72.83 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.64 0.776 . . . . 0.0 111.341 170.58 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.63 -43.69 93.72 Favored 'General case' 0 CA--C 1.539 0.546 0 O-C-N 121.693 -0.629 . . . . 0.0 111.715 179.628 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 31.3 mt -59.02 -45.11 91.53 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.656 0.782 . . . . 0.0 111.842 173.682 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 18.4 m-85 -62.01 -42.33 99.04 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-N 119.585 1.084 . . . . 0.0 112.918 174.328 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 8.9 mp -68.41 -40.88 81.12 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 118.673 0.67 . . . . 0.0 112.029 178.472 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 54.7 t -70.7 -45.37 74.19 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 123.78 0.832 . . . . 0.0 111.852 179.46 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 57.2 m -80.38 -27.86 38.08 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 113.632 0.975 . . . . 0.0 113.632 -177.859 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 67.42 -138.94 34.7 Favored Glycine 0 CA--C 1.53 0.992 0 C-N-CA 123.891 0.758 . . . . 0.0 111.711 -176.426 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 2.4 pm0 -69.37 -15.49 63.32 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.786 1.234 . . . . 0.0 113.757 178.104 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 54.6 mtm180 -69.06 -34.36 75.04 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.296 1.039 . . . . 0.0 112.646 179.706 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.09 177.64 36.97 Favored Glycine 0 CA--C 1.533 1.175 0 C-N-CA 124.453 1.025 . . . . 0.0 113.711 -175.415 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 7.3 p90 -117.26 166.44 12.28 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 126.485 1.914 . . . . 0.0 112.922 -176.529 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 47.0 p90 -128.7 8.99 5.87 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.276 1.43 . . . . 0.0 113.731 175.145 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 5.2 p90 -55.13 147.43 16.15 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 115.167 1.543 . . . . 0.0 115.167 -171.951 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 23.6 p -89.25 134.75 32.37 Favored Pre-proline 0 N--CA 1.47 0.529 0 C-N-CA 124.596 1.158 . . . . 0.0 110.041 170.015 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -80.06 177.54 8.18 Favored 'Trans proline' 0 CA--C 1.538 0.712 0 C-N-CA 123.145 2.564 . . . . 0.0 111.397 176.859 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 40.6 ttpt . . . . . 0 N--CA 1.474 0.736 0 C-N-CA 123.751 0.82 . . . . 0.0 113.06 177.156 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 10.2 tt . . . . . 0 N--CA 1.479 0.997 0 N-CA-C 112.902 0.705 . . . . 0.0 112.902 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 87.4 t -65.83 -46.19 89.43 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 CA-C-N 119.418 1.008 . . . . 0.0 112.151 -169.244 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -73.69 -29.59 62.38 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 119.235 0.925 . . . . 0.0 112.084 174.474 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 -67.95 -35.77 78.95 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.586 1.155 . . . . 0.0 112.219 179.398 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 14.8 m -97.48 -25.57 15.13 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 114.992 1.479 . . . . 0.0 114.992 176.842 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 27.8 t -95.06 -59.18 1.96 Allowed 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 120.014 1.279 . . . . 0.0 112.157 -176.305 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 20.9 m -71.26 -50.48 32.34 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.39 1.076 . . . . 0.0 109.847 179.265 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 75.2 m -91.22 171.16 9.43 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 124.203 1.001 . . . . 0.0 111.129 168.623 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 12.3 tt -91.87 147.38 5.34 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 124.124 0.97 . . . . 0.0 110.893 175.411 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 18.9 p -135.71 150.98 49.72 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 113.568 0.951 . . . . 0.0 113.568 177.325 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 13.2 t -106.53 164.14 12.31 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 125.262 1.425 . . . . 0.0 111.206 176.092 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 78.0 mt -59.39 -25.88 64.65 Favored 'General case' 0 CA--C 1.541 0.617 0 O-C-N 121.355 -0.841 . . . . 0.0 113.037 -177.755 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.8 t80 -60.01 -32.53 70.96 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 123.832 0.853 . . . . 0.0 113.224 170.397 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -81.08 -30.51 34.7 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.452 1.101 . . . . 0.0 110.927 176.181 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -64.89 -44.49 89.44 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 119.546 1.066 . . . . 0.0 110.626 169.238 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -59.84 -28.59 67.63 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 124.449 1.1 . . . . 0.0 113.822 176.421 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 22.4 t30 -59.36 -28.24 66.68 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 123.764 0.825 . . . . 0.0 113.095 177.446 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 97.6 m-85 -99.99 2.2 43.27 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.848 1.259 . . . . 0.0 113.899 -179.292 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 64.8 m -72.28 170.08 14.88 Favored 'General case' 0 CA--C 1.549 0.907 0 O-C-N 120.959 -1.088 . . . . 0.0 111.951 169.642 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.253 1.261 0 C-N-CA 125.374 1.469 . . . . 0.0 112.678 176.402 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 64.2 m-85 . . . . . 0 N--CA 1.488 1.469 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 8.0 t -85.92 57.48 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.369 0 CA-C-N 120.228 1.376 . . . . 0.0 109.223 174.456 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -97.32 130.36 44.5 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.535 1.534 . . . . 0.0 113.027 -170.749 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 41.1 mt-30 -148.01 163.77 35.85 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.872 1.669 . . . . 0.0 111.124 -174.903 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 57.5 m-70 -94.44 129.55 41.14 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 167.439 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 69.8 mt -137.06 135.1 37.21 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 126.184 1.794 . . . . 0.0 109.03 -176.36 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 1.4 t -143.02 142.95 31.72 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.256 0.622 . . . . 0.0 111.87 -171.918 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 51.17 -121.6 12.12 Favored Glycine 0 CA--C 1.53 0.973 0 C-N-CA 124.567 1.08 . . . . 0.0 113.957 170.439 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 16.3 t -55.51 -39.82 70.98 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.13 0.972 . . . . 0.0 112.701 178.199 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 72.6 m-70 -73.56 -27.93 61.59 Favored 'General case' 0 CA--C 1.542 0.661 0 O-C-N 120.455 -1.403 . . . . 0.0 113.348 178.013 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 41.8 tp -72.86 -41.79 64.39 Favored 'General case' 0 N--CA 1.467 0.415 0 O-C-N 121.437 -0.789 . . . . 0.0 111.654 170.836 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 24.9 t -60.67 -43.31 94.66 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.851 0 C-N-CA 124.495 1.118 . . . . 0.0 111.0 172.084 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -60.34 -46.8 88.65 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.312 1.445 . . . . 0.0 111.68 173.011 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.15 -40.99 95.91 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 121.461 -0.774 . . . . 0.0 112.23 175.907 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 59.6 mt -63.14 -42.18 99.42 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 118.915 0.779 . . . . 0.0 111.846 174.51 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 21.7 m-85 -61.58 -40.04 93.34 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 119.269 0.94 . . . . 0.0 112.521 172.309 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 79.0 mt -69.46 -44.51 71.07 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 123.824 0.849 . . . . 0.0 112.28 177.997 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 79.3 t -74.66 -44.46 46.56 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 C-N-CA 123.921 0.888 . . . . 0.0 112.095 -177.63 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 40.5 m -87.55 -26.61 23.05 Favored 'General case' 0 N--CA 1.474 0.772 0 N-CA-C 113.599 0.963 . . . . 0.0 113.599 -176.159 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 73.48 -153.09 47.29 Favored Glycine 0 CA--C 1.531 1.069 0 C-N-CA 125.188 1.375 . . . . 0.0 112.998 -179.698 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -59.14 -22.12 60.4 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.372 1.469 . . . . 0.0 113.867 -176.741 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.97 -26.98 68.82 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.759 1.223 . . . . 0.0 113.087 178.009 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 79.09 -172.62 55.27 Favored Glycine 0 CA--C 1.53 0.969 0 C-N-CA 124.543 1.068 . . . . 0.0 113.657 -176.098 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 40.4 p90 -148.92 161.02 42.7 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.011 1.324 . . . . 0.0 113.658 -169.321 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 57.3 m-85 -88.48 149.19 23.78 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 125.35 1.46 . . . . 0.0 109.364 167.89 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 48.4 t80 -138.5 130.36 28.08 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 121.455 -0.778 . . . . 0.0 112.864 -176.097 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 78.5 m -141.13 108.18 6.27 Favored Pre-proline 0 N--CA 1.472 0.666 0 C-N-CA 124.688 1.195 . . . . 0.0 110.267 -179.348 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_endo -80.88 168.65 17.25 Favored 'Trans proline' 0 N--CA 1.455 -0.756 0 C-N-CA 123.528 2.819 . . . . 0.0 110.908 169.487 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 39.7 ttpt . . . . . 0 CA--C 1.546 0.807 0 C-N-CA 123.351 0.66 . . . . 0.0 112.291 172.009 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 2' ' ' ILE . . . . . 0.528 ' N ' ' HH ' ' B' ' 26' ' ' TYR . 9.8 tt . . . . . 0 N--CA 1.484 1.251 0 N-CA-C 114.332 1.234 . . . . 0.0 114.332 . . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 9.0 p -58.9 -35.67 57.63 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 O-C-N 121.106 -0.996 . . . . 0.0 113.636 -169.809 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 55.1 mt-10 -73.13 -10.46 59.8 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 119.178 0.899 . . . . 0.0 113.325 175.864 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 -93.26 -60.34 1.81 Allowed 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 108.565 -0.902 . . . . 0.0 108.565 169.053 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 56.1 m -62.83 -29.97 71.13 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 115.304 1.594 . . . . 0.0 115.304 -173.461 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 13.9 t -89.7 -29.0 19.05 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.581 0.752 . . . . 0.0 112.802 -175.847 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 28.1 m -97.07 -39.09 9.49 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 125.835 1.654 . . . . 0.0 111.502 -176.171 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 70.2 m -124.96 -173.21 2.75 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.247 1.819 . . . . 0.0 110.017 176.062 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 11.6 tt -88.41 143.47 11.15 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 O-C-N 120.336 -1.478 . . . . 0.0 110.577 176.281 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 18.9 p -130.92 166.08 21.69 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.438 1.095 . . . . 0.0 111.754 175.677 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 44.9 p -108.08 159.98 16.15 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 113.718 1.007 . . . . 0.0 113.718 -174.199 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 77.0 mt -64.53 -30.83 71.86 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 121.332 -0.855 . . . . 0.0 111.433 172.369 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 87.6 t80 -65.63 -34.67 78.76 Favored 'General case' 0 CA--C 1.542 0.645 0 O-C-N 121.481 -0.762 . . . . 0.0 112.816 174.153 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -71.46 -26.53 62.75 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 123.6 0.76 . . . . 0.0 112.07 172.837 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 98.5 mt -74.49 -41.82 60.05 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 119.143 0.883 . . . . 0.0 112.01 169.769 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -55.97 -29.07 59.66 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 124.21 1.004 . . . . 0.0 113.237 176.735 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 17.8 t30 -52.88 -32.04 42.92 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.729 1.211 . . . . 0.0 113.511 174.376 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 87.4 m-85 -97.69 2.03 49.26 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 125.398 1.479 . . . . 0.0 114.695 -175.766 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 73.0 m -78.43 150.83 32.99 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.005 0.922 . . . . 0.0 113.239 178.575 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 . . . . . 0 C--O 1.25 1.101 0 C-N-CA 124.31 1.044 . . . . 0.0 112.243 170.535 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 52.8 p90 . . . . . 0 N--CA 1.485 1.288 0 CA-C-O 118.832 -0.604 . . . . 0.0 110.721 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . 0.3 24.0 m 58.59 -37.3 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 C-N-CA 130.39 3.476 . . . . 0.0 116.44 -173.809 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 17.6 m120 -126.95 138.53 53.29 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 127.329 2.251 . . . . 0.0 109.209 169.011 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 33.0 tp60 -158.95 160.43 36.02 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 123.51 0.724 . . . . 0.0 111.483 -169.365 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 95.9 m-70 -98.13 133.03 43.14 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 123.881 0.872 . . . . 0.0 109.017 167.724 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 88.5 mt -146.57 141.88 27.42 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 124.986 1.314 . . . . 0.0 110.383 -171.799 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 2.0 t -153.25 146.26 24.55 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.157 0.583 . . . . 0.0 111.823 -177.247 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 52.3 -126.47 30.93 Favored Glycine 0 N--CA 1.475 1.263 0 C-N-CA 124.766 1.174 . . . . 0.0 114.086 171.952 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 31.4 p -58.97 -33.87 71.15 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.628 1.171 . . . . 0.0 113.142 178.301 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 22.4 t-160 -71.55 -37.22 71.13 Favored 'General case' 0 CA--C 1.544 0.731 0 O-C-N 121.036 -1.04 . . . . 0.0 111.57 176.497 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 64.0 tp -65.15 -44.99 86.8 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 123.587 0.755 . . . . 0.0 111.525 171.689 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 40.4 t -60.82 -43.85 96.32 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 C-N-CA 124.286 1.034 . . . . 0.0 111.177 175.414 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -64.42 -42.75 95.88 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 123.59 0.756 . . . . 0.0 111.725 175.628 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.37 -41.61 98.76 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 121.677 -0.639 . . . . 0.0 111.885 175.782 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 36.6 mt -58.78 -47.84 83.34 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 118.46 0.573 . . . . 0.0 110.852 172.906 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 26.2 m-85 -59.47 -41.54 89.98 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 119.679 1.127 . . . . 0.0 112.876 175.252 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 77.6 mt -67.0 -41.32 86.94 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.998 0.919 . . . . 0.0 112.424 177.511 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 44.3 t -69.86 -42.37 79.88 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 C-N-CA 124.239 1.016 . . . . 0.0 111.798 178.62 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 61.4 m -81.6 -32.0 32.23 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 113.837 1.051 . . . . 0.0 113.837 -176.003 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 82.04 -148.21 26.84 Favored Glycine 0 CA--C 1.53 1.01 0 C-N-CA 124.616 1.103 . . . . 0.0 112.686 -177.832 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 3.8 pm0 -62.88 -23.43 67.33 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 126.292 1.837 . . . . 0.0 115.494 -169.032 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 18.1 mtm-85 -83.7 -20.18 33.96 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 124.663 1.185 . . . . 0.0 113.221 -177.951 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.9 -161.63 54.3 Favored Glycine 0 CA--C 1.532 1.155 0 C-N-CA 124.611 1.101 . . . . 0.0 113.38 -174.96 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 9.9 p90 -125.73 164.83 19.8 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 126.252 1.821 . . . . 0.0 112.993 -172.947 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 43.0 p90 -101.58 3.71 40.26 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 124.793 1.237 . . . . 0.0 112.394 168.301 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 26' ' ' TYR . . . . . 0.528 ' HH ' ' N ' ' A' ' 2' ' ' ILE . 79.8 t80 -48.86 141.91 6.99 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 126.623 1.969 . . . . 0.0 115.438 -177.166 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 24.1 p -136.77 137.2 22.86 Favored Pre-proline 0 N--CA 1.472 0.659 0 C-N-CA 126.084 1.753 . . . . 0.0 109.247 168.322 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -77.06 162.47 31.77 Favored 'Trans proline' 0 N--CA 1.459 -0.531 0 C-N-CA 123.358 2.705 . . . . 0.0 110.915 173.989 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 52.3 mtpt . . . . . 0 CA--C 1.547 0.858 0 N-CA-C 114.057 1.132 . . . . 0.0 114.057 -177.779 . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 10.0 tp . . . . . 0 N--CA 1.478 0.96 0 N-CA-C 113.265 0.839 . . . . 0.0 113.265 . . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 10.6 p -69.53 -38.76 77.46 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 C-N-CA 123.534 0.734 . . . . 0.0 112.503 -171.185 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 21.3 pm0 -72.51 -2.51 19.95 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 123.964 0.906 . . . . 0.0 113.333 174.855 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -105.17 -57.46 2.03 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.77 1.228 . . . . 0.0 110.417 172.23 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 21.4 m -68.22 -28.33 67.15 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 114.58 1.326 . . . . 0.0 114.58 -175.462 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 73.5 m -73.62 -47.15 42.43 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-N 119.644 1.111 . . . . 0.0 111.078 170.941 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 27.4 m -71.3 -37.17 71.84 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 126.538 1.935 . . . . 0.0 112.291 -170.737 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 48.2 m -137.2 167.7 21.05 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 125.326 1.45 . . . . 0.0 111.572 -176.313 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 39.2 mt -63.31 132.88 29.29 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 O-C-N 121.289 -0.882 . . . . 0.0 109.958 170.774 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 7.1 p -135.12 156.63 48.67 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.179 0.992 . . . . 0.0 112.635 176.254 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 34.2 t -108.79 160.83 15.66 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 126.138 1.775 . . . . 0.0 111.558 -175.229 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 23.7 mt -57.46 -28.01 62.98 Favored 'General case' 0 N--CA 1.469 0.504 0 O-C-N 121.62 -0.675 . . . . 0.0 111.838 173.17 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 85.9 t80 -61.85 -31.16 71.4 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 124.237 1.015 . . . . 0.0 113.665 173.06 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 34.5 mt-30 -79.16 -32.0 44.17 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.725 0.81 . . . . 0.0 111.015 174.381 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 55.0 mt -67.58 -41.14 84.62 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.36 0.664 . . . . 0.0 112.255 171.578 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -55.31 -33.15 63.06 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 124.866 1.266 . . . . 0.0 113.099 175.184 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 17.3 t30 -61.27 -26.5 67.81 Favored 'General case' 0 CA--C 1.547 0.839 0 N-CA-C 113.141 0.793 . . . . 0.0 113.141 176.811 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 49.2 m-85 -99.6 -1.77 37.31 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.409 1.484 . . . . 0.0 114.168 -179.293 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 73.5 m -67.26 151.03 48.23 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 120.867 -1.146 . . . . 0.0 112.957 173.202 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 90.0 m-20 . . . . . 0 C--O 1.252 1.208 0 C-N-CA 124.376 1.07 . . . . 0.0 111.95 169.754 . . . . . . . . 0 0 . 1 . 025 nuclear build core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 43.8 p90 . . . . . 0 N--CA 1.487 1.378 0 CA-C-O 119.11 -0.471 . . . . 0.0 110.7 . . . . . . . . . 0 0 . 1 . 025 nuclear build core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 15.4 m -77.78 63.94 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.444 0 C-N-CA 125.513 1.525 . . . . 0.0 112.914 -173.17 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 38.8 t30 -157.87 109.7 2.31 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.917 1.687 . . . . 0.0 109.654 -175.35 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 2.6 mm-40 -168.09 175.65 6.51 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 125.291 1.436 . . . . 0.0 110.713 -169.626 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 49.0 m-70 -68.22 134.73 50.91 Favored 'General case' 0 CA--C 1.544 0.728 0 O-C-N 120.7 -1.25 . . . . 0.0 109.485 168.017 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 76.4 mt -135.31 126.89 28.87 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 125.631 1.572 . . . . 0.0 109.119 176.083 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.7 t -143.76 150.16 38.19 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 113.093 0.775 . . . . 0.0 113.093 -174.041 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 54.98 -128.27 43.14 Favored Glycine 0 N--CA 1.469 0.86 0 C-N-CA 124.68 1.133 . . . . 0.0 113.059 173.755 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 15.8 m -54.78 -36.17 64.61 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.518 1.127 . . . . 0.0 113.282 177.832 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 73.9 m-70 -76.76 -29.21 56.02 Favored 'General case' 0 CA--C 1.539 0.526 0 O-C-N 120.895 -1.128 . . . . 0.0 113.036 178.061 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 56.3 tp -69.54 -44.75 70.3 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 118.888 0.767 . . . . 0.0 110.689 169.908 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 25.3 t -60.22 -43.72 93.93 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.981 0 C-N-CA 124.904 1.282 . . . . 0.0 111.017 175.027 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -59.45 -50.44 73.92 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 125.142 1.377 . . . . 0.0 111.45 172.317 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.59 -40.75 97.91 Favored 'General case' 0 CA--C 1.537 0.466 0 O-C-N 121.397 -0.815 . . . . 0.0 111.978 179.683 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 40.0 mt -61.27 -42.66 99.02 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 123.661 0.784 . . . . 0.0 111.683 173.771 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 19.3 m-85 -61.97 -42.0 98.63 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-N 119.885 1.221 . . . . 0.0 112.678 172.702 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 9.0 mp -68.3 -42.39 79.5 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 118.613 0.642 . . . . 0.0 112.145 178.676 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 54.5 t -71.19 -45.31 71.7 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 C-N-CA 123.622 0.769 . . . . 0.0 111.809 -179.806 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 43.9 m -89.33 -20.01 24.57 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 114.027 1.121 . . . . 0.0 114.027 -173.023 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 66.91 -149.52 51.35 Favored Glycine 0 CA--C 1.532 1.132 0 C-N-CA 124.544 1.068 . . . . 0.0 113.078 177.956 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -61.26 -23.3 65.56 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 125.248 1.419 . . . . 0.0 113.531 -177.062 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 78.2 mtp85 -64.14 -29.44 70.56 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.34 1.056 . . . . 0.0 112.921 177.441 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.42 -169.69 54.64 Favored Glycine 0 CA--C 1.531 1.093 0 C-N-CA 124.464 1.031 . . . . 0.0 113.14 -175.238 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 54.9 p90 -147.07 157.71 43.7 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.503 1.121 . . . . 0.0 113.684 -171.164 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 60.1 t80 -88.77 147.36 24.49 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.89 1.676 . . . . 0.0 109.869 169.192 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 65.1 t80 -151.02 139.92 20.92 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.816 0.846 . . . . 0.0 111.997 -175.975 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 15.4 t -168.12 141.51 2.65 Favored Pre-proline 0 N--CA 1.472 0.65 0 C-N-CA 126.421 1.889 . . . . 0.0 109.681 -178.318 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -87.8 -163.69 0.17 Allowed 'Trans proline' 0 CA--C 1.54 0.819 0 C-N-CA 124.15 3.234 . . . . 0.0 111.821 178.099 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 39.8 ttmt . . . . . 0 CA--C 1.544 0.734 0 C-N-CA 124.861 1.264 . . . . 0.0 113.924 -175.407 . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 2' ' ' ILE . . . . . 0.495 ' N ' ' HG1' ' B' ' 27' ' ' THR . 12.4 tt . . . . . 0 N--CA 1.482 1.174 0 N-CA-C 113.687 0.995 . . . . 0.0 113.687 . . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 5.4 p -63.11 -27.92 44.08 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 O-C-N 121.518 -0.738 . . . . 0.0 112.92 178.901 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -72.14 -11.97 60.98 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 123.633 0.773 . . . . 0.0 112.833 176.27 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 22.6 tt0 -95.16 -66.49 0.91 Allowed 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 123.855 0.862 . . . . 0.0 109.144 169.165 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 57.0 m -68.94 -26.73 65.22 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 115.797 1.777 . . . . 0.0 115.797 -168.803 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 15.4 t -84.14 -43.26 15.18 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 119.631 1.105 . . . . 0.0 111.179 176.696 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 24.2 m -69.4 -32.33 71.27 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 126.116 1.766 . . . . 0.0 112.609 -179.245 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 91.8 p -147.26 169.12 20.07 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.946 1.298 . . . . 0.0 112.498 -174.967 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 38.7 mt -64.73 134.14 29.58 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.864 0 O-C-N 120.935 -1.103 . . . . 0.0 110.52 174.144 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 9.7 p -133.34 177.37 7.74 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 125.079 1.351 . . . . 0.0 111.195 169.907 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.4 t -139.69 167.33 22.35 Favored 'General case' 0 N--CA 1.466 0.366 0 O-C-N 120.927 -1.108 . . . . 0.0 112.786 179.433 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 46.8 mt -62.59 -30.11 71.09 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.445 1.098 . . . . 0.0 112.71 -169.658 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 83.3 t80 -63.61 -28.14 69.72 Favored 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 172.918 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 60.9 mt-30 -82.83 -23.18 33.86 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 123.84 0.856 . . . . 0.0 111.674 175.804 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 47.7 mt -67.83 -43.57 79.27 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 118.905 0.775 . . . . 0.0 110.742 171.661 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -56.13 -24.99 44.36 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 113.894 1.072 . . . . 0.0 113.894 175.707 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 29.4 t30 -60.47 -27.83 67.86 Favored 'General case' 0 CA--C 1.548 0.871 0 CA-C-N 119.628 1.104 . . . . 0.0 113.072 175.242 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.406 ' CD1' HD12 ' A' ' 2' ' ' ILE . 89.1 m-85 -96.71 2.33 51.92 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.505 1.522 . . . . 0.0 112.874 177.865 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 70.4 m -98.55 161.03 13.89 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.973 1.309 . . . . 0.0 112.535 177.357 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 75.7 m-20 . . . . . 0 C--O 1.25 1.126 0 C-N-CA 123.629 0.772 . . . . 0.0 112.355 175.911 . . . . . . . . 0 0 . 1 . 026 nuclear build core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 55.0 t80 . . . . . 0 N--CA 1.491 1.609 0 N-CA-C 110.077 -0.342 . . . . 0.0 110.077 . . . . . . . . . 0 0 . 1 . 026 nuclear build core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 15.4 m -64.27 144.61 14.55 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 O-C-N 121.05 -1.031 . . . . 0.0 111.864 176.303 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 5.3 t30 54.49 60.29 3.64 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 125.517 1.527 . . . . 0.0 113.268 174.419 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 29.8 mm-40 -145.69 171.05 15.3 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 125.853 1.661 . . . . 0.0 111.601 -178.852 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 25.3 m-70 -81.02 143.19 32.68 Favored 'General case' 0 CA--C 1.545 0.776 0 O-C-N 120.956 -1.09 . . . . 0.0 109.607 167.356 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 67.0 mt -140.73 130.45 24.26 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 126.123 1.769 . . . . 0.0 109.148 175.26 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.6 t -135.68 144.31 45.9 Favored 'General case' 0 N--CA 1.472 0.645 0 O-C-N 121.53 -0.731 . . . . 0.0 112.784 -174.826 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 49.78 -123.33 13.11 Favored Glycine 0 N--CA 1.471 1.0 0 C-N-CA 125.287 1.423 . . . . 0.0 114.043 170.955 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 20.2 m -55.12 -38.25 67.94 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.322 1.049 . . . . 0.0 112.55 177.92 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 1.4 t-80 -70.04 -34.2 72.94 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 120.881 -1.137 . . . . 0.0 111.748 179.023 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 43.2 tp -69.99 -41.43 74.4 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 123.889 0.876 . . . . 0.0 111.507 173.653 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 55.0 t -62.15 -42.69 96.08 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 124.755 1.222 . . . . 0.0 110.91 173.313 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -64.39 -41.22 96.78 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.596 0.759 . . . . 0.0 112.233 173.071 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.1 -42.84 99.62 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 119.661 1.119 . . . . 0.0 111.792 174.977 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 26.2 mt -59.36 -44.75 92.67 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 123.362 0.665 . . . . 0.0 111.893 173.166 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 6.1 m-85 -57.76 -48.32 79.99 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.605 0.762 . . . . 0.0 112.208 172.999 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 7.9 mp -67.87 -41.27 83.11 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 123.704 0.801 . . . . 0.0 112.321 -178.077 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 61.5 t -74.33 -46.77 42.95 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.693 0 CA-C-N 118.188 0.449 . . . . 0.0 111.774 -177.061 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 86.3 m -99.96 -25.95 14.15 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 114.178 1.177 . . . . 0.0 114.178 -169.931 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 55.05 -121.64 22.79 Favored Glycine 0 CA--C 1.531 1.051 0 C-N-CA 124.386 0.993 . . . . 0.0 113.477 169.85 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -62.18 -22.9 66.28 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.721 1.608 . . . . 0.0 113.365 -177.073 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 24.6 mmm180 -62.31 -37.34 85.2 Favored 'General case' 0 N--CA 1.472 0.674 0 O-C-N 121.438 -0.788 . . . . 0.0 112.255 175.848 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.2 164.91 9.04 Favored Glycine 0 CA--C 1.535 1.296 0 C-N-CA 124.462 1.029 . . . . 0.0 112.911 -171.105 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 54.7 p90 -146.99 155.09 41.98 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.467 1.107 . . . . 0.0 113.689 -172.483 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 53.7 t80 -105.38 84.17 2.06 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.659 1.584 . . . . 0.0 109.672 175.197 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 66.5 t80 -68.12 140.18 56.19 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.675 -0.641 . . . . 0.0 111.11 172.632 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 27' ' ' THR . . . . . 0.495 ' HG1' ' N ' ' A' ' 2' ' ' ILE . 15.7 p -133.29 119.22 15.31 Favored Pre-proline 0 CA--C 1.539 0.543 0 C-N-CA 125.132 1.373 . . . . 0.0 110.647 179.583 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -77.58 -179.13 5.14 Favored 'Trans proline' 0 CA--C 1.538 0.7 0 C-N-CA 123.287 2.658 . . . . 0.0 111.023 173.944 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 28.9 ttpp . . . . . 0 CA--C 1.548 0.882 0 C-N-CA 124.258 1.023 . . . . 0.0 112.804 170.725 . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 7.8 tp . . . . . 0 N--CA 1.48 1.069 0 N-CA-C 113.039 0.755 . . . . 0.0 113.039 . . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 10.0 p -66.85 -34.9 72.99 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.19 0 CA-C-N 119.873 1.215 . . . . 0.0 111.297 179.962 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -69.38 -11.46 60.84 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.941 1.296 . . . . 0.0 113.535 172.103 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 27.2 tt0 -91.07 -61.18 1.72 Allowed 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 123.681 0.792 . . . . 0.0 108.973 168.751 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 59.9 m -66.31 -21.5 66.27 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 114.647 1.351 . . . . 0.0 114.647 -169.961 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 7.6 t -86.87 -19.1 29.41 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 124.592 1.157 . . . . 0.0 113.008 176.232 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 34.4 m -104.11 -45.96 4.58 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 125.996 1.719 . . . . 0.0 111.28 -174.816 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 66.9 m -120.89 178.1 4.85 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 127.26 2.224 . . . . 0.0 110.11 177.087 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 10.7 tt -84.28 137.13 21.41 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 O-C-N 120.679 -1.263 . . . . 0.0 110.708 178.178 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.8 m -106.75 172.5 6.78 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 125.249 1.419 . . . . 0.0 111.586 176.989 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 34.6 t -122.13 149.17 43.96 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 125.32 1.448 . . . . 0.0 112.08 176.98 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 82.6 mt -60.08 -29.12 68.36 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 121.422 -0.799 . . . . 0.0 111.747 171.076 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 79.1 t80 -63.98 -28.15 69.61 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 113.272 0.842 . . . . 0.0 113.272 173.776 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 90.3 mt-30 -76.26 -37.68 57.27 Favored 'General case' 0 CA--C 1.534 0.328 0 O-C-N 121.621 -0.675 . . . . 0.0 110.466 172.689 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 31.7 mt -64.09 -40.33 96.0 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 118.668 0.667 . . . . 0.0 112.13 175.181 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -54.92 -34.26 62.97 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.297 1.039 . . . . 0.0 113.309 171.631 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 -69.03 -21.43 64.12 Favored 'General case' 0 CA--C 1.549 0.912 0 O-C-N 121.309 -0.869 . . . . 0.0 113.158 179.005 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 75.0 m-85 -96.45 -0.96 48.38 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.186 1.394 . . . . 0.0 114.009 175.758 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 72.7 m -71.31 150.32 45.25 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 119.237 0.926 . . . . 0.0 112.88 173.565 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 . . . . . 0 C--O 1.255 1.383 0 C-N-CA 125.259 1.424 . . . . 0.0 112.762 176.243 . . . . . . . . 0 0 . 1 . 027 nuclear build core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 46.2 t80 . . . . . 0 N--CA 1.486 1.365 0 CA-C-O 119.752 -0.166 . . . . 0.0 111.398 . . . . . . . . . 0 0 . 1 . 027 nuclear build core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 21.0 t 74.98 -57.29 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.325 0 C-N-CA 128.321 2.648 . . . . 0.0 111.114 -175.996 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 25.1 m120 -111.99 134.99 53.2 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.729 1.212 . . . . 0.0 112.326 177.864 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -151.63 155.52 38.56 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 125.28 1.432 . . . . 0.0 111.646 -175.569 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 95.4 m-70 -93.15 133.37 36.4 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 108.004 -1.109 . . . . 0.0 108.004 166.148 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 84.0 mt -143.52 134.71 25.78 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 124.687 1.195 . . . . 0.0 110.538 -170.972 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.6 t -149.49 132.41 16.13 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 123.399 0.68 . . . . 0.0 111.883 -175.107 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 58.65 -124.41 36.46 Favored Glycine 0 N--CA 1.472 1.047 0 C-N-CA 124.356 0.979 . . . . 0.0 112.861 177.295 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.8 m -52.02 -37.77 54.54 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.789 1.236 . . . . 0.0 112.827 177.454 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 40.8 m80 -66.21 -40.18 90.16 Favored 'General case' 0 CA--C 1.543 0.684 0 O-C-N 121.084 -1.01 . . . . 0.0 111.582 -179.143 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 53.3 tp -66.86 -41.62 87.01 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.056 0.942 . . . . 0.0 111.171 174.636 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 40.1 t -62.63 -43.06 98.21 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 C-N-CA 124.337 1.055 . . . . 0.0 111.457 175.313 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -61.05 -49.33 77.81 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.565 0.746 . . . . 0.0 111.259 173.797 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.99 -42.15 98.83 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 123.493 0.717 . . . . 0.0 111.501 -179.397 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 29.9 mt -57.37 -52.11 66.7 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 118.613 -0.708 . . . . 0.0 111.339 173.561 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -66.87 -31.83 72.7 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 120.118 1.326 . . . . 0.0 112.484 -178.627 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 79.5 mt -69.64 -39.09 77.33 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 123.903 0.881 . . . . 0.0 112.475 174.82 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 42.4 t -70.73 -44.6 76.24 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 C-N-CA 123.904 0.882 . . . . 0.0 111.954 175.285 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 59.2 m -80.52 -26.45 38.11 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 113.575 0.954 . . . . 0.0 113.575 -174.399 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 71.1 -147.81 43.42 Favored Glycine 0 CA--C 1.532 1.097 0 C-N-CA 124.437 1.018 . . . . 0.0 111.535 -173.256 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -63.24 -14.99 55.62 Favored 'General case' 0 CA--C 1.544 0.732 0 N-CA-C 114.451 1.278 . . . . 0.0 114.451 -178.559 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 59.1 mtm180 -65.36 -35.59 81.43 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.891 1.277 . . . . 0.0 112.742 177.092 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.04 -178.69 51.0 Favored Glycine 0 CA--C 1.533 1.202 0 C-N-CA 124.234 0.921 . . . . 0.0 113.611 -172.852 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 45.7 p90 -124.99 165.86 17.38 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.791 1.636 . . . . 0.0 112.709 -175.056 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 34.6 t80 -142.19 41.99 1.65 Allowed 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 126.669 1.987 . . . . 0.0 110.081 -179.281 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -64.59 156.08 31.12 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 124.685 1.194 . . . . 0.0 114.161 -177.79 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 22.9 p -122.68 67.22 29.39 Favored Pre-proline 0 N--CA 1.48 1.062 0 C-N-CA 125.041 1.336 . . . . 0.0 112.807 -170.618 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -72.76 157.23 52.29 Favored 'Trans proline' 0 C--N 1.348 0.509 0 C-N-CA 123.103 2.536 . . . . 0.0 111.672 176.237 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 94.1 mttt . . . . . 0 N--CA 1.476 0.835 0 C-N-CA 129.114 2.965 . . . . 0.0 112.455 172.075 . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 17.2 tt . . . . . 0 N--CA 1.483 1.221 0 N-CA-C 115.972 1.841 . . . . 0.0 115.972 . . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 3.7 p -58.88 -29.54 40.86 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 CA-C-N 120.413 1.46 . . . . 0.0 112.17 173.399 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -73.04 -10.4 59.76 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.567 1.147 . . . . 0.0 112.693 177.033 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -99.74 -58.92 1.81 Allowed 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 124.387 1.075 . . . . 0.0 109.115 168.831 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 90.8 m -62.46 -29.85 70.82 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 115.085 1.513 . . . . 0.0 115.085 -172.74 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 8.1 t -87.93 -27.52 22.08 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 123.829 0.851 . . . . 0.0 112.562 179.188 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 23.1 m -90.47 -34.51 15.56 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 126.251 1.821 . . . . 0.0 111.992 -175.418 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.7 t -145.65 -163.68 1.78 Allowed 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 126.356 1.862 . . . . 0.0 110.18 178.654 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 17.8 mm -80.35 146.1 8.11 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 C-N-CA 124.927 1.291 . . . . 0.0 110.713 173.598 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 18.1 p -135.1 170.43 15.91 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.31 1.444 . . . . 0.0 111.886 169.433 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 74.7 m -124.89 153.43 42.64 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.184 1.394 . . . . 0.0 112.627 -170.05 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 43.1 mt -60.36 -31.65 70.53 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 113.619 0.97 . . . . 0.0 113.619 -173.87 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 91.9 t80 -62.43 -31.63 72.36 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 123.886 0.874 . . . . 0.0 113.243 172.909 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 68.5 mt-30 -75.44 -34.94 61.02 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.754 0.822 . . . . 0.0 110.53 176.014 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 57.9 mt -64.05 -48.17 77.32 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 123.334 0.654 . . . . 0.0 110.938 173.344 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -56.35 -28.87 60.42 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.802 1.241 . . . . 0.0 113.715 176.06 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 27.7 t30 -58.25 -26.97 63.55 Favored 'General case' 0 CA--C 1.546 0.823 0 O-C-N 120.931 -1.105 . . . . 0.0 113.523 178.3 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -97.86 -2.81 39.99 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.284 1.434 . . . . 0.0 113.606 179.614 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 80.3 m -82.83 161.3 22.0 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.456 1.103 . . . . 0.0 113.022 177.698 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 16.5 t-20 . . . . . 0 C--O 1.253 1.257 0 C-N-CA 124.911 1.284 . . . . 0.0 113.453 -175.727 . . . . . . . . 0 0 . 1 . 028 nuclear build core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 36.9 p90 . . . . . 0 N--CA 1.487 1.402 0 N-CA-C 111.914 0.338 . . . . 0.0 111.914 . . . . . . . . . 0 0 . 1 . 028 nuclear build core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 49.0 t 71.69 -58.68 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.342 0 C-N-CA 128.463 2.705 . . . . 0.0 113.871 171.431 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 34.6 m120 -78.48 125.46 29.39 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.388 1.475 . . . . 0.0 111.911 -174.71 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -150.79 159.94 44.2 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.281 1.032 . . . . 0.0 112.165 -179.352 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 86.2 m-70 -97.71 136.31 38.25 Favored 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 107.066 -1.457 . . . . 0.0 107.066 165.365 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 87.0 mt -147.2 137.2 23.17 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.505 1.122 . . . . 0.0 110.814 -177.16 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.8 t -152.38 138.76 18.51 Favored 'General case' 0 N--CA 1.47 0.559 0 O-C-N 121.318 -0.864 . . . . 0.0 113.024 -177.901 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 58.32 -128.16 46.91 Favored Glycine 0 N--CA 1.47 0.965 0 C-N-CA 124.35 0.976 . . . . 0.0 113.334 174.303 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.7 m -55.25 -32.54 62.41 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.528 1.131 . . . . 0.0 113.046 176.993 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 25.0 m80 -69.85 -41.41 74.93 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 121.16 -0.962 . . . . 0.0 111.325 177.328 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 64.1 tp -64.89 -45.92 83.91 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.132 0.973 . . . . 0.0 110.782 173.763 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 38.6 t -57.55 -46.31 86.13 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.928 0 C-N-CA 124.717 1.207 . . . . 0.0 111.229 175.494 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -64.84 -42.99 94.48 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.429 0.691 . . . . 0.0 111.811 176.0 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.22 -41.62 98.56 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 121.574 -0.704 . . . . 0.0 112.21 176.766 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -56.66 -46.79 80.86 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.533 0.733 . . . . 0.0 110.963 173.51 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 31.6 m-85 -65.37 -36.51 84.22 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 113.453 0.909 . . . . 0.0 113.453 175.534 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 77.9 mt -71.31 -42.34 68.74 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 118.98 0.809 . . . . 0.0 112.684 177.4 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 54.8 t -72.07 -47.82 52.73 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.726 0 C-N-CA 124.334 1.054 . . . . 0.0 111.292 -177.885 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 81.4 m -93.75 -9.63 36.99 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 114.243 1.201 . . . . 0.0 114.243 -174.734 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 70.82 -154.33 52.12 Favored Glycine 0 CA--C 1.532 1.122 0 C-N-CA 124.998 1.285 . . . . 0.0 112.929 177.387 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -64.03 -9.07 13.92 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.972 1.309 . . . . 0.0 114.335 176.252 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 14.6 ttp180 -61.53 -30.99 70.99 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.668 1.587 . . . . 0.0 113.038 179.195 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 82.09 173.97 49.21 Favored Glycine 0 CA--C 1.53 1.024 0 C-N-CA 125.31 1.433 . . . . 0.0 114.17 174.639 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 23.4 p90 -151.16 155.22 38.43 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.26 1.424 . . . . 0.0 113.42 -176.159 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 74.9 t80 -90.99 -29.85 17.15 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.367 1.067 . . . . 0.0 113.71 -170.924 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 85.3 t80 -70.21 153.32 43.23 Favored 'General case' 0 CA--C 1.546 0.808 0 N-CA-C 114.915 1.45 . . . . 0.0 114.915 -170.266 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 24.3 p -136.02 142.75 41.4 Favored Pre-proline 0 N--CA 1.476 0.829 0 C-N-CA 126.903 2.081 . . . . 0.0 108.784 169.045 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -70.29 124.29 10.73 Favored 'Trans proline' 0 C--N 1.35 0.619 0 C-N-CA 122.78 2.32 . . . . 0.0 111.099 -170.658 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 25.3 mmmt . . . . . 0 CA--C 1.546 0.807 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 -178.198 . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 2' ' ' ILE . . . . . 0.443 HG22 ' H ' ' B' ' 27' ' ' THR . 9.0 tp . . . . . 0 N--CA 1.483 1.204 0 N-CA-C 113.626 0.973 . . . . 0.0 113.626 . . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 5.0 p -63.74 -26.92 41.79 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 O-C-N 121.088 -1.008 . . . . 0.0 112.982 176.651 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 65.4 tt0 -72.05 -13.61 61.64 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.857 1.263 . . . . 0.0 112.351 175.154 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 31.9 tt0 -104.97 -45.32 4.58 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.223 1.409 . . . . 0.0 110.946 176.269 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 29.7 m -80.95 -25.91 37.03 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 115.502 1.667 . . . . 0.0 115.502 -175.672 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 49.4 t -87.99 -55.25 3.84 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 120.249 1.386 . . . . 0.0 112.6 -173.416 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 25.9 p -77.86 -20.23 53.41 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 125.471 1.508 . . . . 0.0 113.371 -176.574 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.4 t -132.83 -173.36 3.16 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.533 1.533 . . . . 0.0 111.257 171.723 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 71.0 mt -87.5 139.72 16.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 124.785 1.234 . . . . 0.0 110.209 178.241 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.3 p -131.26 153.8 49.14 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 122.081 0.943 . . . . 0.0 112.125 169.424 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 41.5 t -95.24 153.91 17.44 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 125.802 1.641 . . . . 0.0 112.77 -178.695 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 11.1 mp -58.99 -27.85 65.79 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 121.466 -0.771 . . . . 0.0 111.613 169.305 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 74.5 t80 -62.41 -31.72 72.45 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 123.884 0.873 . . . . 0.0 113.093 171.729 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 35.4 mt-30 -77.28 -42.39 37.15 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 123.961 0.905 . . . . 0.0 110.49 174.34 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 80.7 mt -56.71 -52.72 63.85 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 123.764 0.826 . . . . 0.0 111.612 174.565 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -60.54 -34.66 74.45 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 123.841 0.857 . . . . 0.0 112.854 178.428 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -71.38 -32.19 68.18 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 123.688 0.795 . . . . 0.0 112.627 175.483 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -72.8 -43.4 62.8 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.117 0.967 . . . . 0.0 111.811 175.284 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 87.9 m -55.49 136.35 49.94 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 125.695 1.598 . . . . 0.0 112.229 170.92 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 4.4 p30 . . . . . 0 C--O 1.252 1.237 0 C-N-CA 126.945 2.098 . . . . 0.0 112.882 -171.399 . . . . . . . . 0 0 . 1 . 029 nuclear build core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 82.7 m-85 . . . . . 0 N--CA 1.485 1.307 0 N-CA-C 111.125 0.046 . . . . 0.0 111.125 . . . . . . . . . 0 0 . 1 . 029 nuclear build core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 57.4 t -66.77 137.59 24.55 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 C-N-CA 123.723 0.809 . . . . 0.0 109.334 171.884 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -158.48 150.48 21.48 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.451 1.101 . . . . 0.0 112.504 -170.64 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -175.85 176.9 1.75 Allowed 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 125.994 1.718 . . . . 0.0 110.703 -178.277 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 53.9 m-70 -77.94 135.72 37.88 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 124.5 1.12 . . . . 0.0 109.672 166.155 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 49.5 mt -141.81 135.82 30.02 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 126.607 1.963 . . . . 0.0 109.779 175.731 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 2.1 t -139.27 145.23 38.91 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 -174.315 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 50.21 -125.02 19.48 Favored Glycine 0 N--CA 1.471 0.976 0 C-N-CA 125.102 1.334 . . . . 0.0 114.277 169.957 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 18.9 m -55.65 -37.24 67.98 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.777 1.231 . . . . 0.0 113.09 178.223 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 70.3 m-70 -74.69 -30.29 61.51 Favored 'General case' 0 CA--C 1.541 0.599 0 O-C-N 120.79 -1.194 . . . . 0.0 112.79 176.99 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 39.2 tp -68.38 -44.68 74.62 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 118.805 0.73 . . . . 0.0 111.296 169.687 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 53.4 t -60.0 -46.21 94.43 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.014 0 C-N-CA 124.023 0.929 . . . . 0.0 110.919 173.993 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -58.61 -47.18 85.21 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 125.038 1.335 . . . . 0.0 111.869 174.33 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.53 -46.39 88.61 Favored 'General case' 0 CA--C 1.532 0.271 0 O-C-N 121.674 -0.641 . . . . 0.0 111.799 176.731 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 28.7 mt -54.84 -45.81 74.54 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 123.837 0.855 . . . . 0.0 111.138 175.788 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 11.0 m-85 -60.61 -51.51 69.11 Favored 'General case' 0 CA--C 1.544 0.722 0 O-C-N 121.041 -1.037 . . . . 0.0 112.819 173.972 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 91.9 mt -68.67 -40.23 80.26 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.133 0.973 . . . . 0.0 113.348 -175.395 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 54.3 t -73.58 -43.98 54.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 124.858 1.263 . . . . 0.0 111.365 -177.209 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 69.3 m -87.93 -27.91 21.84 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 114.705 1.372 . . . . 0.0 114.705 -170.147 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 56.17 -121.56 24.33 Favored Glycine 0 CA--C 1.531 1.045 0 C-N-CA 124.114 0.864 . . . . 0.0 112.799 174.575 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 3.7 pm0 -64.78 -14.62 59.69 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.809 1.643 . . . . 0.0 115.045 -177.064 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 61.1 mtp85 -62.77 -28.43 69.98 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 119.012 0.824 . . . . 0.0 112.655 172.621 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.84 133.05 1.57 Allowed Glycine 0 CA--C 1.53 1.014 0 C-N-CA 125.023 1.297 . . . . 0.0 110.661 -170.59 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -78.17 164.26 25.1 Favored 'General case' 0 CA--C 1.536 0.441 0 O-C-N 122.05 -0.676 . . . . 0.0 112.601 -177.697 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 53.4 t80 -155.75 134.63 11.99 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.398 1.079 . . . . 0.0 110.573 170.706 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 40.6 t80 -135.68 146.37 47.72 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 125.834 1.654 . . . . 0.0 111.849 -175.988 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 27' ' ' THR . . . . . 0.443 ' H ' HG22 ' A' ' 2' ' ' ILE . 27.1 p -141.32 139.68 19.43 Favored Pre-proline 0 CA--C 1.544 0.727 0 C-N-CA 126.108 1.763 . . . . 0.0 110.43 175.721 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -84.7 -177.43 2.87 Favored 'Trans proline' 0 CA--C 1.539 0.759 0 C-N-CA 124.01 3.14 . . . . 0.0 112.55 -174.744 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 33.0 ttpt . . . . . 0 CA--C 1.551 1.016 0 C-N-CA 126.437 1.895 . . . . 0.0 112.921 174.855 . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 9.0 tp . . . . . 0 N--CA 1.485 1.283 0 N-CA-C 114.971 1.471 . . . . 0.0 114.971 . . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 6.3 p -64.96 -24.72 36.1 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 O-C-N 121.342 -0.849 . . . . 0.0 112.985 178.855 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -75.93 0.28 18.92 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 124.067 0.947 . . . . 0.0 112.319 175.466 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 31.9 tt0 -124.46 -48.21 1.83 Allowed 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.221 1.408 . . . . 0.0 111.216 174.992 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 17.1 m -71.02 -27.39 63.64 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 114.736 1.384 . . . . 0.0 114.736 179.735 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 12.3 t -83.79 -42.07 16.88 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 119.492 1.042 . . . . 0.0 111.449 179.295 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 19.7 p -76.8 -33.94 57.97 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 126.955 2.102 . . . . 0.0 112.911 -177.159 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 73.8 m -134.27 170.8 15.16 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.468 1.507 . . . . 0.0 111.885 179.827 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 58.7 mt -68.47 136.12 27.08 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 O-C-N 120.8 -1.188 . . . . 0.0 110.13 170.833 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.0 p -133.07 162.98 30.28 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.462 1.105 . . . . 0.0 112.975 175.167 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 6.2 t -128.76 172.7 11.01 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 125.479 1.511 . . . . 0.0 112.566 -175.983 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.479 HD22 ' H ' ' A' ' 13' ' ' LEU . 1.9 mm? -59.03 -31.65 69.03 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.133 1.373 . . . . 0.0 113.1 -169.855 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 87.9 t80 -63.5 -33.5 75.71 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 123.608 0.763 . . . . 0.0 113.008 175.951 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 38.0 mt-30 -76.55 -33.7 58.54 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 124.295 1.038 . . . . 0.0 110.683 176.616 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 80.8 mt -68.31 -52.81 29.39 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.871 0.868 . . . . 0.0 111.387 174.038 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -63.95 -21.47 66.5 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 113.56 0.948 . . . . 0.0 113.56 -179.026 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.3 t30 -68.69 -33.32 73.76 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 123.877 0.871 . . . . 0.0 112.618 174.876 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 9.1 m-85 -88.52 -14.34 37.99 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 114.302 1.223 . . . . 0.0 114.302 -179.086 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 91.7 m -71.53 160.34 32.88 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.692 0.797 . . . . 0.0 112.936 170.988 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 7.1 p-10 . . . . . 0 C--O 1.254 1.299 0 C-N-CA 126.895 2.078 . . . . 0.0 113.356 179.675 . . . . . . . . 0 0 . 1 . 030 nuclear build core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 67.5 m-85 . . . . . 0 N--CA 1.484 1.261 0 CA-C-O 117.898 -1.048 . . . . 0.0 108.743 . . . . . . . . . 0 0 . 1 . 030 nuclear build core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 80.2 t -68.62 -36.37 74.25 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.38 0 CA-C-N 120.861 1.664 . . . . 0.0 109.475 168.625 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 51.7 p-10 -65.48 149.02 50.74 Favored 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 125.458 1.503 . . . . 0.0 112.291 168.515 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -162.14 165.3 27.24 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.13 0.972 . . . . 0.0 111.253 -171.441 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 34.0 m-70 -74.86 143.29 43.93 Favored 'General case' 0 CA--C 1.55 0.979 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 164.412 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 40.6 mt -142.97 137.73 29.58 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 125.773 1.629 . . . . 0.0 109.208 174.722 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 3.4 t -145.62 148.76 33.45 Favored 'General case' 0 N--CA 1.47 0.574 0 O-C-N 121.367 -0.833 . . . . 0.0 112.581 -176.2 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 52.89 -128.91 38.03 Favored Glycine 0 N--CA 1.473 1.133 0 C-N-CA 125.08 1.324 . . . . 0.0 114.018 172.141 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 26.7 m -56.87 -38.17 72.36 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.182 0.993 . . . . 0.0 113.03 -178.717 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 69.7 m-70 -73.13 -30.19 63.43 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 119.308 0.958 . . . . 0.0 112.839 177.529 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 51.1 tp -68.5 -45.77 71.42 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 118.881 0.764 . . . . 0.0 111.119 170.85 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 73.8 t -63.94 -42.3 95.33 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 CA-C-N 118.489 0.586 . . . . 0.0 111.351 176.435 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -56.3 -49.54 74.0 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.991 1.317 . . . . 0.0 111.502 171.018 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.38 -43.77 98.3 Favored 'General case' 0 CA--C 1.536 0.423 0 O-C-N 121.547 -0.721 . . . . 0.0 111.448 177.48 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 21.3 mt -58.24 -44.32 88.22 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 123.626 0.771 . . . . 0.0 111.535 176.516 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 14.8 m-85 -63.03 -45.36 92.65 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 119.107 0.867 . . . . 0.0 112.755 174.116 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 9.0 mp -72.75 -41.17 65.41 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 123.799 0.839 . . . . 0.0 113.063 -176.512 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 55.5 t -70.5 -43.48 77.9 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 C-N-CA 124.644 1.178 . . . . 0.0 110.934 -177.741 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 68.7 m -79.82 -15.95 56.42 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 113.412 0.893 . . . . 0.0 113.412 -178.565 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 59.12 -120.72 23.94 Favored Glycine 0 N--CA 1.469 0.884 0 C-N-CA 125.09 1.328 . . . . 0.0 113.427 168.842 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -59.93 -24.07 64.05 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.409 1.484 . . . . 0.0 113.418 -178.332 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 79.9 mtp180 -63.83 -30.36 71.46 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.084 0.954 . . . . 0.0 112.276 173.331 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.22 -155.19 51.38 Favored Glycine 0 CA--C 1.534 1.257 0 C-N-CA 124.461 1.029 . . . . 0.0 111.495 -168.904 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 58.3 t80 -149.36 148.01 29.0 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.431 1.492 . . . . 0.0 109.969 174.923 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 46.6 t80 -159.06 64.69 0.41 Allowed 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 124.234 1.014 . . . . 0.0 111.631 -169.28 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 67.7 t80 -156.97 155.92 32.12 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.713 1.605 . . . . 0.0 111.116 176.336 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 22.9 p -118.96 99.88 50.92 Favored Pre-proline 0 N--CA 1.475 0.785 0 C-N-CA 125.428 1.491 . . . . 0.0 110.557 -179.825 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -63.61 170.44 8.37 Favored 'Trans proline' 0 CA--C 1.539 0.768 0 C-N-CA 123.528 2.819 . . . . 0.0 113.441 173.842 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt . . . . . 0 N--CA 1.478 0.927 0 N-CA-C 114.172 1.175 . . . . 0.0 114.172 -178.384 . . . . . . . . 0 0 . 1 . 031 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 6.3 tp . . . . . 0 N--CA 1.487 1.379 0 N-CA-C 110.116 -0.327 . . . . 0.0 110.116 . . . . . . . . . 0 0 . 1 . 031 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 7.2 p -61.09 -32.41 52.64 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 O-C-N 121.408 -0.808 . . . . 0.0 112.335 179.46 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.7 pm0 -73.15 -18.98 61.22 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.371 1.068 . . . . 0.0 113.505 175.421 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 25.5 tp60 -88.74 -44.05 10.83 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.226 1.01 . . . . 0.0 110.3 172.445 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 21.4 m -78.82 -32.1 46.11 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 115.254 1.575 . . . . 0.0 115.254 -177.37 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 42.6 t -93.16 -59.24 2.08 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-N 119.825 1.193 . . . . 0.0 112.12 -175.487 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 19.2 m -67.84 -44.58 76.87 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.746 1.218 . . . . 0.0 110.62 -176.525 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.3 t -103.04 -163.16 0.97 Allowed 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.623 1.169 . . . . 0.0 110.832 169.119 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 82.0 mt -109.21 138.91 34.25 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 125.835 1.654 . . . . 0.0 109.471 -179.001 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 10.2 p -129.87 170.54 13.77 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.779 0.832 . . . . 0.0 113.149 173.565 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 81.9 p -120.22 167.13 12.58 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 125.962 1.705 . . . . 0.0 112.562 -175.43 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 51.0 mt -62.16 -30.94 71.4 Favored 'General case' 0 CA--C 1.539 0.554 0 O-C-N 121.751 -0.593 . . . . 0.0 111.954 173.989 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 89.7 t80 -64.81 -36.72 85.25 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 121.416 -0.802 . . . . 0.0 112.739 171.891 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -70.82 -26.16 63.18 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 118.632 -0.699 . . . . 0.0 111.815 173.011 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 74.4 mt -73.95 -43.62 57.62 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 119.423 1.01 . . . . 0.0 112.182 169.728 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -55.51 -34.87 65.02 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 123.575 0.75 . . . . 0.0 112.777 175.11 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 15.1 t30 -58.81 -27.77 65.38 Favored 'General case' 0 CA--C 1.55 0.969 0 N-CA-C 113.679 0.992 . . . . 0.0 113.679 176.551 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 49.9 m-85 -98.3 0.44 45.59 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 125.482 1.513 . . . . 0.0 113.751 179.339 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 37.9 t -75.37 167.74 21.32 Favored 'General case' 0 CA--C 1.544 0.745 0 O-C-N 120.846 -1.159 . . . . 0.0 112.116 169.917 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 25.9 m120 . . . . . 0 C--O 1.251 1.177 0 C-N-CA 126.356 1.862 . . . . 0.0 112.094 177.643 . . . . . . . . 0 0 . 1 . 031 nuclear build core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 33.9 t80 . . . . . 0 N--CA 1.487 1.399 0 CA-C-O 117.985 -1.007 . . . . 0.0 110.106 . . . . . . . . . 0 0 . 1 . 031 nuclear build core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 4.8 p -173.75 102.84 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 C-N-CA 126.601 1.96 . . . . 0.0 107.793 178.13 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 10.4 m120 -144.8 135.77 24.88 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.623 1.169 . . . . 0.0 111.292 -167.156 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 2.8 mm-40 -161.48 170.04 20.69 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.842 1.257 . . . . 0.0 112.542 -177.27 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 86.5 m-70 -86.04 135.02 33.8 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.327 1.051 . . . . 0.0 109.647 167.62 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 82.5 mt -139.85 119.38 13.1 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 125.892 1.677 . . . . 0.0 109.926 178.576 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 72.1 m -123.29 130.63 53.0 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 124.911 1.284 . . . . 0.0 112.243 -174.352 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 56.31 -120.65 20.74 Favored Glycine 0 N--CA 1.472 1.072 0 C-N-CA 124.729 1.156 . . . . 0.0 113.733 169.344 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 22.2 m -54.24 -33.24 57.98 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 124.562 1.145 . . . . 0.0 112.912 177.459 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 34.7 m80 -71.24 -41.11 70.54 Favored 'General case' 0 CA--C 1.539 0.551 0 O-C-N 120.895 -1.128 . . . . 0.0 111.34 178.07 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 60.4 tp -63.79 -45.27 90.44 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 123.637 0.775 . . . . 0.0 111.024 172.648 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 31.8 t -60.33 -46.12 95.43 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 C-N-CA 124.33 1.052 . . . . 0.0 110.77 177.808 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -63.87 -45.92 87.27 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 123.198 0.599 . . . . 0.0 111.767 176.409 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.27 -42.18 96.58 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 118.638 0.654 . . . . 0.0 111.897 179.235 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 27.1 tp -66.14 -37.75 86.46 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.075 0.95 . . . . 0.0 111.292 178.825 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 11.8 m-85 -64.67 -42.97 94.99 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 119.248 0.931 . . . . 0.0 112.448 169.109 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 70.2 mt -63.88 -39.09 93.38 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 119.08 0.855 . . . . 0.0 112.226 177.872 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 39.3 t -68.59 -45.55 81.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 124.052 0.941 . . . . 0.0 112.212 174.353 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 16.8 t -84.96 -23.21 28.85 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 114.238 1.199 . . . . 0.0 114.238 -171.915 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 77.38 -157.59 46.44 Favored Glycine 0 CA--C 1.533 1.165 0 C-N-CA 124.857 1.217 . . . . 0.0 112.372 -174.845 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -69.36 -10.86 59.83 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.034 1.334 . . . . 0.0 114.44 -175.083 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 71.1 mtm-85 -67.7 -25.56 65.74 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.698 1.199 . . . . 0.0 113.883 -175.975 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.17 155.18 12.36 Favored Glycine 0 CA--C 1.533 1.204 0 C-N-CA 124.856 1.217 . . . . 0.0 112.74 -175.02 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 22.2 p90 -115.15 170.89 8.03 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.64 1.576 . . . . 0.0 112.619 -177.591 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 45.2 p90 -108.74 152.06 25.36 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.705 1.202 . . . . 0.0 110.003 167.41 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 49.9 t80 -156.98 144.94 19.28 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 123.563 0.745 . . . . 0.0 112.742 -169.59 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 53.8 m -141.1 134.32 14.55 Favored Pre-proline 0 N--CA 1.473 0.707 0 C-N-CA 126.268 1.827 . . . . 0.0 108.361 173.755 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_endo -76.0 -170.48 0.86 Allowed 'Trans proline' 0 CA--C 1.542 0.91 0 C-N-CA 123.261 2.641 . . . . 0.0 111.896 178.339 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 28.4 ttpp . . . . . 0 CA--C 1.544 0.724 0 N-CA-C 114.489 1.292 . . . . 0.0 114.489 -175.336 . . . . . . . . 0 0 . 1 . 032 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 19.5 tt . . . . . 0 N--CA 1.481 1.092 0 N-CA-C 114.498 1.296 . . . . 0.0 114.498 . . . . . . . . . 0 0 . 1 . 032 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 58.0 t -67.68 -39.45 82.17 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.099 0 C-N-CA 123.712 0.805 . . . . 0.0 111.977 -168.16 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.7 pm0 -75.24 -35.49 61.42 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.436 1.094 . . . . 0.0 111.928 171.464 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 11.0 tp60 -74.26 -43.72 55.78 Favored 'General case' 0 CA--C 1.537 0.471 0 O-C-N 121.363 -0.835 . . . . 0.0 111.962 -172.396 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 33.3 m -65.58 -21.08 66.56 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 123.706 0.802 . . . . 0.0 113.072 172.947 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 48.7 t -91.49 -45.75 8.36 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 118.701 0.682 . . . . 0.0 112.09 -178.622 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 49.2 p -76.33 -20.59 57.11 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 125.234 1.413 . . . . 0.0 113.838 179.932 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 7.8 t -143.63 -167.82 2.68 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.733 1.213 . . . . 0.0 110.991 173.653 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 70.3 mt -93.55 132.23 38.29 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 C-N-CA 124.689 1.196 . . . . 0.0 109.052 172.953 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 27.0 p -114.46 164.74 13.55 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.364 1.066 . . . . 0.0 113.305 178.238 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 36.8 t -94.69 152.52 18.41 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 124.802 1.241 . . . . 0.0 112.813 -175.855 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 48.7 mt -60.82 -30.64 70.21 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 121.457 -0.777 . . . . 0.0 111.84 173.724 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 90.9 t80 -60.84 -36.81 80.08 Favored 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 171.788 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 64.6 mt-30 -70.32 -44.56 67.98 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.322 0.649 . . . . 0.0 110.061 176.886 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 98.6 mt -57.77 -42.98 85.2 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.7 0.8 . . . . 0.0 111.958 176.667 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -72.12 -35.09 69.04 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 113.981 1.104 . . . . 0.0 113.981 175.276 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -72.66 -34.77 67.45 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 119.104 0.865 . . . . 0.0 112.958 -177.628 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 27.5 m-85 -80.75 -5.83 57.66 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 113.741 1.015 . . . . 0.0 113.741 173.868 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 8.3 t -76.8 173.32 11.82 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 123.961 0.905 . . . . 0.0 112.785 172.401 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 . . . . . 0 C--O 1.253 1.268 0 C-N-CA 125.363 1.465 . . . . 0.0 114.022 -175.403 . . . . . . . . 0 0 . 1 . 032 nuclear build core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 54.9 p90 . . . . . 0 N--CA 1.483 1.193 0 N-CA-C 111.232 0.086 . . . . 0.0 111.232 . . . . . . . . . 0 0 . 1 . 032 nuclear build core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 17.5 m -71.28 145.97 12.12 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.33 0 C-N-CA 123.909 0.884 . . . . 0.0 112.334 -177.308 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 58.91 70.71 0.63 Allowed 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 125.546 1.538 . . . . 0.0 110.98 178.803 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -141.96 166.12 25.59 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 126.869 2.068 . . . . 0.0 110.228 -168.713 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 24.3 m-70 -68.08 131.87 46.21 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 165.008 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 74.9 mt -140.24 115.75 10.06 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 126.224 1.81 . . . . 0.0 109.072 -173.615 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 78.2 m -121.57 143.82 49.08 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.084 1.353 . . . . 0.0 111.544 -178.649 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 48.62 -124.12 11.46 Favored Glycine 0 N--CA 1.473 1.118 0 C-N-CA 125.298 1.428 . . . . 0.0 114.529 169.338 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 18.7 m -53.6 -39.89 65.26 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.444 1.098 . . . . 0.0 113.338 178.559 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 18.6 t60 -72.4 -31.23 65.35 Favored 'General case' 0 CA--C 1.543 0.677 0 O-C-N 120.971 -1.08 . . . . 0.0 112.058 179.655 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 50.3 tp -67.17 -42.87 83.53 Favored 'General case' 0 C--O 1.224 -0.253 0 O-C-N 121.503 -0.748 . . . . 0.0 110.924 168.885 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 77.2 t -60.81 -43.45 95.45 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 CA-C-N 119.029 0.831 . . . . 0.0 111.241 175.983 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 67.2 mt-10 -54.75 -50.91 67.24 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 118.927 0.785 . . . . 0.0 111.087 171.166 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.02 -44.4 92.68 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.681 0.792 . . . . 0.0 112.11 -177.821 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 33.1 mt -56.22 -48.01 77.32 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 124.169 0.988 . . . . 0.0 110.892 176.338 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 14.2 m-85 -65.41 -43.77 89.53 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 119.074 0.852 . . . . 0.0 112.851 177.201 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 76.9 mt -66.85 -42.93 84.87 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 123.608 0.763 . . . . 0.0 112.552 -179.87 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 71.0 t -77.14 -36.65 24.86 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 C-N-CA 124.557 1.143 . . . . 0.0 111.602 -176.741 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 49.8 t -77.57 -31.48 53.17 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 113.875 1.065 . . . . 0.0 113.875 178.017 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 76.95 -140.37 24.78 Favored Glycine 0 CA--C 1.531 1.054 0 C-N-CA 124.072 0.844 . . . . 0.0 112.886 178.041 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 3.6 pm0 -66.46 -16.67 64.29 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 115.416 1.635 . . . . 0.0 115.416 -169.499 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 49.2 mtm180 -62.74 -37.24 85.82 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 118.785 0.721 . . . . 0.0 112.106 174.957 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.62 139.15 1.51 Allowed Glycine 0 CA--C 1.531 1.07 0 C-N-CA 125.809 1.671 . . . . 0.0 113.147 179.139 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 50.1 t80 -71.48 156.86 38.96 Favored 'General case' 0 CA--C 1.545 0.762 0 O-C-N 122.066 -0.667 . . . . 0.0 112.494 177.701 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 89.7 t80 -156.42 -32.29 0.09 Allowed 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 114.723 1.379 . . . . 0.0 114.723 -168.882 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 79.1 t80 -60.78 131.53 50.99 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.281 1.033 . . . . 0.0 113.285 -176.102 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 39.7 p -74.74 145.92 82.38 Favored Pre-proline 0 N--CA 1.477 0.899 0 O-C-N 121.27 -0.894 . . . . 0.0 111.697 -176.807 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -73.32 137.84 26.47 Favored 'Trans proline' 0 N--CA 1.456 -0.706 0 C-N-CA 122.955 2.437 . . . . 0.0 111.332 -178.537 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 45.3 mmtm . . . . . 0 CA--C 1.546 0.809 0 N-CA-C 113.628 0.973 . . . . 0.0 113.628 -177.69 . . . . . . . . 0 0 . 1 . 033 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 7.1 tp . . . . . 0 N--CA 1.488 1.45 0 N-CA-C 110.399 -0.223 . . . . 0.0 110.399 . . . . . . . . . 0 0 . 1 . 033 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 48.4 t -59.21 -35.91 60.29 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 C-N-CA 124.188 0.995 . . . . 0.0 110.957 178.437 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 13.0 pm0 -69.67 -9.28 53.66 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.79 1.236 . . . . 0.0 114.047 177.207 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 25.7 tt0 -99.68 -66.41 0.91 Allowed 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.17 0.988 . . . . 0.0 109.152 169.505 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 50.8 m -71.99 -26.53 62.27 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 115.464 1.654 . . . . 0.0 115.464 -168.928 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 13.4 t -85.43 -44.54 12.66 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 119.304 0.956 . . . . 0.0 110.992 176.924 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 27.3 m -65.63 -40.13 92.21 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 126.086 1.754 . . . . 0.0 111.893 -179.743 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 67.3 m -138.25 172.25 13.19 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.232 1.413 . . . . 0.0 112.0 -174.866 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 43.4 mt -64.98 136.17 27.1 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 O-C-N 120.748 -1.22 . . . . 0.0 110.179 170.666 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 9.6 p -134.51 176.72 8.37 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.235 1.414 . . . . 0.0 111.673 170.793 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 22.9 t -138.03 161.78 35.83 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.556 1.143 . . . . 0.0 112.708 -179.936 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.499 HD22 ' H ' ' A' ' 13' ' ' LEU . 1.2 mm? -61.18 -28.88 69.45 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.927 1.291 . . . . 0.0 111.783 -179.932 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 79.9 t80 -63.27 -24.25 67.78 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.68 1.192 . . . . 0.0 113.439 172.954 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 62.8 mt-30 -85.1 -37.43 20.28 Favored 'General case' 0 N--CA 1.469 0.517 0 O-C-N 121.549 -0.719 . . . . 0.0 110.638 171.884 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 27.5 mt -60.97 -33.33 73.04 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 118.965 0.802 . . . . 0.0 113.001 175.532 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.7 mm-40 -50.93 -30.97 16.23 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 124.637 1.175 . . . . 0.0 113.714 169.175 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 -73.93 -19.86 60.55 Favored 'General case' 0 CA--C 1.546 0.82 0 O-C-N 121.09 -1.006 . . . . 0.0 113.101 177.037 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 79.9 m-85 -93.35 -7.19 45.45 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.593 1.557 . . . . 0.0 113.191 176.944 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 33.1 m -74.16 136.44 42.87 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.477 1.111 . . . . 0.0 109.236 167.598 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 9.3 p30 . . . . . 0 C--O 1.253 1.268 0 CA-C-O 118.026 -0.988 . . . . 0.0 113.364 179.293 . . . . . . . . 0 0 . 1 . 033 nuclear build core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 63.7 m-85 . . . . . 0 N--CA 1.488 1.464 0 CA-C-O 119.051 -0.5 . . . . 0.0 110.299 . . . . . . . . . 0 0 . 1 . 033 nuclear build core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 27.6 m -61.02 -34.71 61.07 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.367 0 CA-C-N 119.97 1.259 . . . . 0.0 112.616 179.227 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 24.6 m120 -83.87 120.42 26.05 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.429 1.091 . . . . 0.0 109.737 168.93 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 5.4 tt0 -166.76 163.47 16.52 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 124.172 0.989 . . . . 0.0 111.646 -177.014 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 26.4 m-70 -77.48 142.5 39.11 Favored 'General case' 0 CA--C 1.548 0.87 0 N-CA-C 107.631 -1.248 . . . . 0.0 107.631 163.932 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 58.5 mt -139.72 132.53 29.15 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 125.719 1.607 . . . . 0.0 108.557 175.251 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.6 t -144.04 149.33 36.5 Favored 'General case' 0 N--CA 1.47 0.569 0 O-C-N 121.439 -0.788 . . . . 0.0 112.391 -175.054 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.32 -128.01 43.19 Favored Glycine 0 N--CA 1.469 0.855 0 C-N-CA 124.702 1.144 . . . . 0.0 113.515 172.611 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 27.2 p -53.41 -44.99 69.17 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.437 1.095 . . . . 0.0 112.923 177.363 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 12.8 m-70 -67.38 -31.27 71.39 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 120.941 -1.099 . . . . 0.0 113.352 179.255 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 40.6 tp -70.53 -44.34 67.73 Favored 'General case' 0 N--CA 1.466 0.343 0 O-C-N 121.616 -0.677 . . . . 0.0 110.892 171.517 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 54.0 t -59.02 -43.04 88.03 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 C-N-CA 123.585 0.754 . . . . 0.0 111.168 173.692 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -59.43 -44.5 92.9 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 123.864 0.866 . . . . 0.0 111.819 172.229 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.53 -42.44 99.52 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-N 119.062 0.846 . . . . 0.0 111.982 176.467 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -58.48 -46.04 87.45 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 118.79 0.723 . . . . 0.0 111.599 173.162 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 9.5 m-85 -59.12 -46.09 89.23 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 119.024 0.829 . . . . 0.0 112.339 174.28 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 67.8 mt -68.13 -39.64 82.66 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.196 0.998 . . . . 0.0 112.495 -178.229 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 71.9 t -72.23 -53.49 19.54 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 C-N-CA 123.629 0.772 . . . . 0.0 111.213 177.249 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 65.5 m -79.64 -31.69 41.55 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 113.579 0.955 . . . . 0.0 113.579 -170.729 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.5 -133.97 41.76 Favored Glycine 0 CA--C 1.528 0.871 0 C-N-CA 124.094 0.854 . . . . 0.0 111.815 178.09 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -65.32 -14.57 61.09 Favored 'General case' 0 CA--C 1.543 0.673 0 N-CA-C 114.633 1.346 . . . . 0.0 114.633 -179.632 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 88.0 mtm180 -66.43 -40.03 89.25 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 118.775 0.716 . . . . 0.0 112.216 177.981 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.93 170.74 45.0 Favored Glycine 0 CA--C 1.536 1.377 0 C-N-CA 124.225 0.917 . . . . 0.0 112.67 -168.795 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 54.6 p90 -148.03 166.49 27.6 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 114.835 1.42 . . . . 0.0 114.835 -169.272 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -99.65 141.78 32.0 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.495 1.518 . . . . 0.0 110.418 168.49 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 34.7 t80 -158.24 129.54 6.55 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.049 1.34 . . . . 0.0 111.47 177.893 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 29.5 p -149.22 154.51 39.11 Favored Pre-proline 0 N--CA 1.476 0.863 0 C-N-CA 126.403 1.881 . . . . 0.0 110.613 170.556 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_endo -72.05 176.63 8.16 Favored 'Trans proline' 0 C--N 1.354 0.839 0 C-N-CA 124.272 3.315 . . . . 0.0 112.434 178.154 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 77.8 mttt . . . . . 0 CA--C 1.544 0.739 0 N-CA-C 114.43 1.27 . . . . 0.0 114.43 -169.6 . . . . . . . . 0 0 . 1 . 034 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 12.1 tt . . . . . 0 N--CA 1.481 1.088 0 N-CA-C 115.676 1.732 . . . . 0.0 115.676 . . . . . . . . . 0 0 . 1 . 034 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 2.7 p -64.46 -29.86 48.56 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.193 0 CA-C-N 120.187 1.358 . . . . 0.0 112.735 175.396 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -73.8 -36.4 64.99 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 118.501 0.591 . . . . 0.0 111.394 173.08 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 32.1 tt0 -76.94 -57.96 3.55 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 124.75 1.22 . . . . 0.0 111.952 -174.988 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 21.0 m -67.14 -21.5 65.82 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 113.892 1.071 . . . . 0.0 113.892 -177.27 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 8.1 t -87.82 -30.15 20.43 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.804 0.841 . . . . 0.0 112.702 179.949 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 28.9 m -88.47 -46.49 9.08 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 125.095 1.358 . . . . 0.0 110.949 177.359 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 49.1 m -113.39 167.66 10.38 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 125.714 1.606 . . . . 0.0 111.473 -176.482 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 62.9 mt -75.08 137.17 23.53 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 O-C-N 120.96 -1.088 . . . . 0.0 108.705 170.429 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.4 p -132.87 173.34 11.49 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.61 1.164 . . . . 0.0 112.816 178.01 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 23.2 t -131.88 166.29 21.94 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 125.313 1.445 . . . . 0.0 112.459 -175.67 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 60.0 mt -57.64 -29.16 64.34 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.781 1.233 . . . . 0.0 112.455 177.94 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 86.9 t80 -61.03 -31.31 70.95 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 124.387 1.075 . . . . 0.0 113.317 173.584 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 33.4 mt-30 -79.19 -33.3 44.02 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 123.731 0.812 . . . . 0.0 110.856 175.309 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 88.2 mt -63.61 -42.72 98.2 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 118.779 0.718 . . . . 0.0 111.553 171.728 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -56.38 -34.81 67.05 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.676 0.79 . . . . 0.0 113.027 174.698 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 17.3 t30 -64.14 -26.63 68.62 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 113.109 0.781 . . . . 0.0 113.109 179.76 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 54.7 m-85 -98.37 1.67 47.2 Favored 'General case' 0 CA--C 1.551 1.007 0 C-N-CA 125.363 1.465 . . . . 0.0 113.826 179.475 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 46.4 t -84.53 174.11 10.28 Favored 'General case' 0 CA--C 1.55 0.942 0 C-N-CA 124.886 1.274 . . . . 0.0 111.223 168.151 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 8.3 p30 . . . . . 0 C--O 1.253 1.251 0 C-N-CA 125.177 1.391 . . . . 0.0 112.042 170.535 . . . . . . . . 0 0 . 1 . 034 nuclear build core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 15.2 t80 . . . . . 0 N--CA 1.488 1.439 0 CA-C-O 118.912 -0.566 . . . . 0.0 110.03 . . . . . . . . . 0 0 . 1 . 034 nuclear build core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 30.2 m -65.06 -22.44 31.39 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.341 0 CA-C-N 120.621 1.555 . . . . 0.0 114.433 -174.431 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 23.0 m120 -78.75 118.76 21.13 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.589 1.155 . . . . 0.0 111.545 176.773 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 16.7 tt0 -162.81 164.68 26.05 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.804 1.242 . . . . 0.0 111.096 -179.808 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 97.5 m-70 -79.02 146.62 33.23 Favored 'General case' 0 CA--C 1.544 0.726 0 O-C-N 120.782 -1.199 . . . . 0.0 110.058 167.9 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 83.5 mt -141.24 133.43 27.96 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 125.039 1.335 . . . . 0.0 110.075 175.525 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 5.0 t -153.47 143.26 21.95 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 121.526 -0.734 . . . . 0.0 112.211 -177.319 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 60.36 -133.38 50.37 Favored Glycine 0 CA--C 1.531 1.069 0 C-N-CA 124.377 0.989 . . . . 0.0 112.981 177.375 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.0 m -54.84 -32.76 60.92 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 124.676 1.19 . . . . 0.0 113.16 178.473 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 20.1 m80 -67.71 -43.82 79.15 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.225 -0.922 . . . . 0.0 111.182 177.874 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 59.2 tp -65.1 -44.37 89.04 Favored 'General case' 0 C--N 1.342 0.262 0 C-N-CA 123.587 0.755 . . . . 0.0 111.244 174.072 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 41.0 t -60.45 -45.56 96.64 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 124.173 0.989 . . . . 0.0 110.925 178.431 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -62.98 -47.33 83.63 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 123.469 0.708 . . . . 0.0 111.597 175.65 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.8 -41.9 97.81 Favored 'General case' 0 CA--C 1.542 0.649 0 O-C-N 121.391 -0.818 . . . . 0.0 112.326 179.439 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 30.8 tp -66.76 -37.61 84.96 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.176 0.99 . . . . 0.0 111.086 178.776 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 11.6 m-85 -65.91 -40.93 91.94 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 119.395 0.998 . . . . 0.0 112.45 169.523 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 65.1 mt -64.13 -41.14 97.33 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 119.178 0.899 . . . . 0.0 112.155 176.891 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 41.2 t -70.34 -44.14 77.75 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.954 0 C-N-CA 123.4 0.68 . . . . 0.0 112.468 175.31 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 9.5 t -80.52 -18.29 48.96 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 113.757 1.021 . . . . 0.0 113.757 -175.81 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 71.8 -149.65 45.08 Favored Glycine 0 CA--C 1.527 0.838 0 C-N-CA 125.495 1.521 . . . . 0.0 112.897 174.506 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -62.96 -22.04 66.52 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.21 1.404 . . . . 0.0 113.182 -175.993 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 88.3 mtm-85 -64.46 -33.66 76.39 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.021 0.929 . . . . 0.0 113.126 -179.553 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.29 141.47 0.87 Allowed Glycine 0 CA--C 1.531 1.065 0 C-N-CA 125.323 1.44 . . . . 0.0 112.071 -172.524 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 32.8 p90 -76.06 153.0 36.71 Favored 'General case' 0 CA--C 1.542 0.67 0 O-C-N 121.636 -0.92 . . . . 0.0 113.199 -178.11 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 78.3 t80 -84.97 -24.7 28.19 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.073 1.349 . . . . 0.0 112.641 -179.012 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 52.0 t80 -63.22 158.33 20.35 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 126.42 1.888 . . . . 0.0 115.085 -177.128 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 17.7 p -137.88 132.52 17.25 Favored Pre-proline 0 N--CA 1.471 0.615 0 C-N-CA 126.274 1.83 . . . . 0.0 108.765 168.315 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -79.57 162.33 24.71 Favored 'Trans proline' 0 N--CA 1.46 -0.483 0 C-N-CA 122.936 2.424 . . . . 0.0 111.948 -177.057 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 59.5 mtpt . . . . . 0 CA--C 1.547 0.86 0 C-N-CA 124.872 1.269 . . . . 0.0 114.41 179.956 . . . . . . . . 0 0 . 1 . 035 nuclear build core ' A' A ' 2' ' ' ILE . . . . . 0.409 ' HB ' ' CD2' ' A' ' 19' ' ' TYR . 7.7 tp . . . . . 0 N--CA 1.476 0.842 0 N-CA-C 114.716 1.376 . . . . 0.0 114.716 . . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 11.0 p -58.81 -57.1 12.65 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 N-CA-C 112.878 0.696 . . . . 0.0 112.878 -168.44 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 67.0 mt-10 -73.33 -30.23 63.2 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 119.854 1.206 . . . . 0.0 112.205 177.013 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 26.5 tt0 -62.59 -32.62 73.65 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.957 0.903 . . . . 0.0 112.114 -178.934 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 62.0 m -94.61 -27.05 16.11 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 114.505 1.298 . . . . 0.0 114.505 170.701 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 60.8 m -72.37 -64.81 0.87 Allowed 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 120.229 1.377 . . . . 0.0 112.181 178.99 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 40.4 p -87.8 -15.29 37.31 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.131 0.972 . . . . 0.0 113.538 -171.523 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 68.6 m -122.03 167.78 12.71 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.967 1.307 . . . . 0.0 111.72 171.86 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 72.3 mt -79.61 135.35 25.75 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 124.275 1.03 . . . . 0.0 109.352 173.753 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 11.9 p -130.69 163.83 26.37 Favored 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 113.905 1.076 . . . . 0.0 113.905 178.15 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 35.1 t -111.23 159.3 18.03 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.99 1.716 . . . . 0.0 112.346 179.726 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 53.6 mt -60.47 -27.97 67.96 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.81 0.844 . . . . 0.0 111.555 174.108 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 85.9 t80 -62.24 -30.56 71.19 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.283 1.033 . . . . 0.0 113.088 172.456 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 68.3 mt-30 -81.55 -31.06 32.85 Favored 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 123.548 0.739 . . . . 0.0 110.969 174.877 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 66.3 mt -63.74 -43.15 97.35 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 118.968 0.804 . . . . 0.0 111.494 169.657 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -55.98 -35.26 66.55 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.665 1.186 . . . . 0.0 113.526 175.025 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -60.31 -31.08 69.93 Favored 'General case' 0 CA--C 1.547 0.836 0 O-C-N 121.505 -0.747 . . . . 0.0 112.38 178.112 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.409 ' CD2' ' HB ' ' A' ' 2' ' ' ILE . 92.0 m-85 -103.39 10.11 37.52 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.762 1.225 . . . . 0.0 114.163 -177.721 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 76.0 m -73.46 150.74 41.41 Favored 'General case' 0 N--CA 1.468 0.452 0 O-C-N 121.462 -0.774 . . . . 0.0 110.977 167.89 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 21.9 t-20 . . . . . 0 C--O 1.254 1.318 0 C-N-CA 124.385 1.074 . . . . 0.0 113.132 176.336 . . . . . . . . 0 0 . 1 . 035 nuclear build core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 83.1 m-85 . . . . . 0 N--CA 1.487 1.376 0 CA-C-O 117.993 -1.003 . . . . 0.0 110.916 . . . . . . . . . 0 0 . 1 . 035 nuclear build core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 8.7 p -66.39 145.97 13.53 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.276 0 CA-C-N 120.576 1.534 . . . . 0.0 112.051 179.67 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 2.2 t30 58.57 63.8 1.61 Allowed 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 126.177 1.791 . . . . 0.0 111.311 175.874 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 -151.87 160.87 43.39 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.943 0.897 . . . . 0.0 111.83 -169.528 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 68.5 m-70 -76.59 138.14 39.95 Favored 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 164.824 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 66.3 mt -142.37 123.26 14.39 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 126.018 1.727 . . . . 0.0 108.759 177.484 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 5.6 t -141.36 149.92 41.77 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 121.36 -0.837 . . . . 0.0 112.729 -175.082 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.69 -128.42 44.86 Favored Glycine 0 N--CA 1.47 0.916 0 C-N-CA 124.261 0.934 . . . . 0.0 112.718 174.964 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.5 m -53.63 -37.98 63.61 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.681 1.192 . . . . 0.0 112.986 176.782 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 42.4 m-70 -70.59 -35.59 73.11 Favored 'General case' 0 CA--C 1.539 0.521 0 O-C-N 120.977 -1.077 . . . . 0.0 112.242 179.421 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 44.2 tp -67.62 -40.98 84.66 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 123.297 0.639 . . . . 0.0 111.28 171.724 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 25.5 t -59.52 -46.79 92.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 124.338 1.055 . . . . 0.0 111.266 172.789 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -61.19 -46.19 91.48 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 123.773 0.829 . . . . 0.0 111.567 175.077 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.06 -41.06 99.37 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 121.61 -0.681 . . . . 0.0 112.017 179.021 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 43.6 mt -65.92 -40.3 91.34 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 118.487 -0.768 . . . . 0.0 111.81 175.1 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 16.6 m-85 -61.57 -38.78 88.75 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 120.381 1.446 . . . . 0.0 112.765 171.41 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 76.4 mt -68.09 -44.54 76.01 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.801 0.84 . . . . 0.0 112.297 176.422 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 55.2 t -74.07 -45.68 47.57 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 C-N-CA 123.479 0.712 . . . . 0.0 112.232 -179.027 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 49.6 m -84.58 -26.59 27.86 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 113.786 1.032 . . . . 0.0 113.786 -173.789 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 71.81 -149.21 44.4 Favored Glycine 0 CA--C 1.531 1.076 0 C-N-CA 124.576 1.084 . . . . 0.0 112.092 -174.435 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -62.28 -19.82 63.64 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.116 1.366 . . . . 0.0 113.419 -178.815 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 62.7 mtm180 -58.79 -35.55 73.0 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.536 1.134 . . . . 0.0 113.21 178.495 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.68 -173.09 55.32 Favored Glycine 0 CA--C 1.53 1.011 0 C-N-CA 124.282 0.944 . . . . 0.0 113.199 -172.333 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 37.6 p90 -146.69 162.79 37.76 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 126.078 1.751 . . . . 0.0 112.571 -169.114 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 61.6 m-85 -89.95 -27.67 19.66 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 114.193 1.182 . . . . 0.0 114.193 -177.042 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 4.1 t80 57.03 31.46 19.95 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 125.059 1.344 . . . . 0.0 113.183 -179.633 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 38.4 m -47.17 123.12 8.16 Favored Pre-proline 0 CA--C 1.543 0.682 0 C-N-CA 126.276 1.83 . . . . 0.0 112.324 -168.959 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_exo -61.35 178.05 0.69 Allowed 'Trans proline' 0 C--N 1.352 0.714 0 C-N-CA 124.754 3.636 . . . . 0.0 115.292 179.216 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 17.3 ptmt . . . . . 0 CA--C 1.547 0.842 0 N-CA-C 114.956 1.465 . . . . 0.0 114.956 174.801 . . . . . . . . 0 0 . 1 . 036 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 19.1 tt . . . . . 0 N--CA 1.478 0.946 0 CA-C-O 118.936 -0.554 . . . . 0.0 112.44 . . . . . . . . . 0 0 . 1 . 036 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 72.2 t -56.31 -58.73 4.24 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 123.743 0.817 . . . . 0.0 111.878 -169.289 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 4' ' ' GLU . . . . . 0.42 ' CD ' ' H ' ' A' ' 4' ' ' GLU . 0.8 OUTLIER -81.47 -20.47 40.18 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 -179.526 . . . . . . . . 3 3 . 1 . 036 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 11.9 tp60 -69.2 -43.95 73.11 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 119.413 1.006 . . . . 0.0 111.338 177.268 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 46.8 m -67.23 -26.7 66.72 Favored 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 172.732 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 77.5 m -71.83 -56.54 5.55 Favored 'General case' 0 CA--C 1.543 0.675 0 O-C-N 121.016 -1.052 . . . . 0.0 111.193 172.985 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 46.6 p -75.16 -22.79 57.85 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 125.264 1.426 . . . . 0.0 113.98 -170.715 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 6.2 t -144.13 178.99 7.49 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 122.641 1.21 . . . . 0.0 112.411 175.586 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 17.6 mm -70.19 129.49 34.38 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.676 0 C-N-CA 125.439 1.496 . . . . 0.0 109.188 174.353 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 10.2 p -128.54 155.87 44.19 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.157 0.983 . . . . 0.0 112.448 174.576 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 75.3 p -103.84 164.04 11.95 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 114.946 1.462 . . . . 0.0 114.946 -169.741 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 10.5 mp -65.39 -27.56 68.65 Favored 'General case' 0 CA--C 1.539 0.551 0 O-C-N 121.185 -0.947 . . . . 0.0 111.651 172.09 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 89.6 t80 -64.52 -34.05 77.32 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 121.653 -0.654 . . . . 0.0 112.568 170.788 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 67.2 mt-30 -72.6 -39.52 67.25 Favored 'General case' 0 N--CA 1.47 0.543 0 O-C-N 121.62 -0.675 . . . . 0.0 111.289 171.581 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 94.5 mt -61.22 -43.73 98.41 Favored 'General case' 0 CA--C 1.545 0.757 0 CA-C-N 119.322 0.965 . . . . 0.0 111.727 174.089 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 40.0 mm-40 -55.5 -40.82 72.22 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 125.538 1.535 . . . . 0.0 112.806 171.551 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 17.0 t-20 -63.46 -23.02 67.22 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 113.419 0.896 . . . . 0.0 113.419 -177.965 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 64.2 m-85 -102.22 3.26 38.11 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 125.455 1.502 . . . . 0.0 114.194 176.785 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 85.2 m -66.64 146.77 54.12 Favored 'General case' 0 CA--C 1.544 0.732 0 O-C-N 121.235 -0.916 . . . . 0.0 110.402 167.934 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 . . . . . 0 C--O 1.255 1.386 0 C-N-CA 124.758 1.223 . . . . 0.0 113.083 -174.511 . . . . . . . . 0 0 . 1 . 036 nuclear build core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 72.1 m-85 . . . . . 0 N--CA 1.484 1.238 0 CA-C-O 119.39 -0.338 . . . . 0.0 110.725 . . . . . . . . . 0 0 . 1 . 036 nuclear build core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 13.4 p -84.36 115.97 27.3 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.012 0 C-N-CA 123.834 0.854 . . . . 0.0 111.08 -178.134 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -174.0 143.68 0.95 Allowed 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.566 1.546 . . . . 0.0 111.978 -171.956 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 29.3 mm-40 -154.58 169.27 24.24 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 125.503 1.521 . . . . 0.0 111.017 -174.307 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 51.5 m-70 -77.91 135.13 37.82 Favored 'General case' 0 CA--C 1.548 0.868 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 166.273 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 86.1 mt -140.54 124.75 17.57 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 125.404 1.482 . . . . 0.0 109.273 -179.485 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 5.2 t -142.21 142.41 32.65 Favored 'General case' 0 N--CA 1.469 0.494 0 O-C-N 121.485 -0.76 . . . . 0.0 112.84 -174.908 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 56.94 -126.61 42.42 Favored Glycine 0 CA--C 1.53 1.005 0 C-N-CA 124.598 1.094 . . . . 0.0 113.148 175.527 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 22.1 p -54.68 -38.07 66.52 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.411 1.085 . . . . 0.0 112.934 176.46 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 20.3 t-160 -68.95 -36.39 77.88 Favored 'General case' 0 CA--C 1.543 0.701 0 O-C-N 120.832 -1.168 . . . . 0.0 111.55 179.235 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 58.9 tp -67.99 -43.18 79.48 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 123.524 0.73 . . . . 0.0 111.361 172.083 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 28.8 t -59.26 -45.82 92.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 C-N-CA 124.31 1.044 . . . . 0.0 110.769 175.517 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -63.57 -44.05 95.23 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 118.621 0.646 . . . . 0.0 112.106 174.385 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.36 -41.71 94.24 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 119.254 0.934 . . . . 0.0 112.096 176.619 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 58.1 mt -63.58 -41.61 98.35 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 123.419 0.687 . . . . 0.0 111.749 174.546 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 14.0 m-85 -59.04 -45.94 89.49 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 119.761 1.164 . . . . 0.0 112.445 171.247 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 9.0 mp -67.55 -43.78 79.86 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.785 0.834 . . . . 0.0 112.35 -179.626 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 52.7 t -70.93 -49.37 50.44 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 CA-C-N 118.549 0.613 . . . . 0.0 111.456 -179.959 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 63.3 m -77.35 -33.23 55.43 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 113.371 0.878 . . . . 0.0 113.371 -174.189 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 65.36 -135.4 36.51 Favored Glycine 0 CA--C 1.529 0.907 0 C-N-CA 124.211 0.91 . . . . 0.0 111.781 178.573 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -64.09 -15.33 59.39 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 114.287 1.218 . . . . 0.0 114.287 -179.398 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 89.3 mtm180 -67.17 -36.6 82.14 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.896 0.878 . . . . 0.0 112.596 177.622 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.99 -177.41 50.23 Favored Glycine 0 CA--C 1.533 1.172 0 C-N-CA 124.391 0.996 . . . . 0.0 112.406 -169.657 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 46.5 p90 -159.85 174.45 14.43 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 125.058 1.343 . . . . 0.0 113.556 -172.039 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 27.9 t80 -142.89 125.03 15.35 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.189 0.996 . . . . 0.0 110.206 168.761 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 48.7 p90 -90.31 132.22 35.67 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 124.989 1.315 . . . . 0.0 112.096 -179.121 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 64.1 m -122.85 122.82 27.0 Favored Pre-proline 0 N--CA 1.479 0.996 0 C-N-CA 123.887 0.875 . . . . 0.0 111.648 -172.585 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_endo -91.46 177.56 1.89 Allowed 'Trans proline' 0 CA--C 1.539 0.767 0 C-N-CA 125.126 3.884 . . . . 0.0 112.263 172.959 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 88.8 tttt . . . . . 0 N--CA 1.474 0.763 0 C-N-CA 126.08 1.752 . . . . 0.0 113.805 174.896 . . . . . . . . 0 0 . 1 . 037 nuclear build core ' A' A ' 2' ' ' ILE . . . . . 0.461 ' N ' ' HG1' ' B' ' 27' ' ' THR . 19.1 tt . . . . . 0 N--CA 1.481 1.082 0 N-CA-C 113.629 0.974 . . . . 0.0 113.629 . . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 55.9 t -57.54 -29.38 33.84 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 172.805 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -89.96 -35.48 15.54 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 118.978 0.808 . . . . 0.0 112.463 169.656 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -69.27 -41.21 77.18 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 121.84 -0.538 . . . . 0.0 112.299 -171.93 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.3 m -74.75 -21.98 59.04 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 113.118 0.784 . . . . 0.0 113.118 172.174 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 17.1 t -89.38 -46.81 8.45 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.427 0.691 . . . . 0.0 112.489 -171.585 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 85.7 m -82.72 -44.35 15.74 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 125.393 1.477 . . . . 0.0 111.326 178.039 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 68.8 m -106.09 172.95 6.53 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 124.4 1.08 . . . . 0.0 111.813 177.53 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 22.6 mm -73.91 144.55 12.41 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 O-C-N 120.89 -1.131 . . . . 0.0 110.108 171.285 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 11.8 p -134.9 -177.03 4.44 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 113.751 1.019 . . . . 0.0 113.751 170.601 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 79.3 p -147.76 164.58 33.17 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 125.382 1.473 . . . . 0.0 112.5 -169.172 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 10.9 mp -61.89 -29.33 70.13 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 121.416 -0.803 . . . . 0.0 112.423 -177.416 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 90.3 t80 -63.01 -37.0 85.45 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 123.44 0.696 . . . . 0.0 112.483 172.773 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 58.6 mt-30 -74.9 -36.56 62.23 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 123.786 0.835 . . . . 0.0 111.052 175.461 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 94.9 mt -61.83 -48.48 80.38 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 118.728 0.695 . . . . 0.0 111.279 172.97 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 19.6 mm-40 -60.97 -34.56 74.95 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.208 1.003 . . . . 0.0 113.268 176.691 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 17.0 t30 -57.76 -28.01 63.56 Favored 'General case' 0 CA--C 1.547 0.85 0 O-C-N 121.013 -1.054 . . . . 0.0 113.028 178.209 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 71.0 m-85 -103.08 6.89 38.88 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.183 1.393 . . . . 0.0 113.906 177.445 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 98.9 m -92.27 160.64 15.05 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.134 0.974 . . . . 0.0 112.994 171.12 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 . . . . . 0 C--O 1.253 1.267 0 N-CA-C 113.55 0.944 . . . . 0.0 113.55 -173.078 . . . . . . . . 0 0 . 1 . 037 nuclear build core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 62.5 t80 . . . . . 0 N--CA 1.488 1.456 0 N-CA-C 110.175 -0.305 . . . . 0.0 110.175 . . . . . . . . . 0 0 . 1 . 037 nuclear build core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 9.4 p -66.23 145.99 13.52 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.2 0 O-C-N 121.344 -0.847 . . . . 0.0 111.891 179.119 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 1.9 t30 61.33 58.63 2.11 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.186 1.394 . . . . 0.0 111.288 177.091 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -150.43 164.17 36.57 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.022 1.329 . . . . 0.0 110.473 -176.088 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 97.7 m-70 -80.08 145.54 32.38 Favored 'General case' 0 CA--C 1.549 0.908 0 O-C-N 121.224 -0.923 . . . . 0.0 111.044 170.658 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 80.8 mt -142.57 139.71 31.47 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.988 1.715 . . . . 0.0 110.069 173.78 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.0 t -151.65 145.77 25.32 Favored 'General case' 0 N--CA 1.471 0.604 0 O-C-N 121.316 -0.865 . . . . 0.0 112.056 -177.345 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 54.42 -124.22 30.5 Favored Glycine 0 CA--C 1.529 0.964 0 C-N-CA 124.549 1.071 . . . . 0.0 113.385 172.829 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 71.8 p -55.09 -35.61 64.77 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 124.892 1.277 . . . . 0.0 113.463 177.458 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 4.2 m80 -75.52 -37.18 60.25 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 121.503 -0.748 . . . . 0.0 111.112 -179.078 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 54.3 tp -64.98 -45.38 85.9 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 123.437 0.695 . . . . 0.0 111.308 171.573 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 22.2 t -59.37 -46.81 92.28 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.913 0 C-N-CA 124.747 1.219 . . . . 0.0 111.275 175.555 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -63.61 -43.52 96.63 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.315 0.646 . . . . 0.0 111.767 177.105 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.17 -44.35 96.81 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.35 0.66 . . . . 0.0 111.837 176.65 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 44.4 mt -58.76 -43.66 90.41 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 123.024 0.53 . . . . 0.0 111.635 175.808 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 20.4 m-85 -63.95 -43.68 95.1 Favored 'General case' 0 CA--C 1.544 0.717 0 O-C-N 121.343 -0.848 . . . . 0.0 112.629 174.2 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 76.5 mt -67.44 -41.28 85.0 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 123.674 0.79 . . . . 0.0 112.641 179.589 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 61.6 t -73.55 -46.96 46.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 124.359 1.064 . . . . 0.0 111.58 -178.159 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 58.8 m -98.9 -16.47 18.8 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 115.389 1.626 . . . . 0.0 115.389 -169.312 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 73.97 -148.5 39.73 Favored Glycine 0 CA--C 1.531 1.061 0 C-N-CA 124.309 0.957 . . . . 0.0 113.431 177.896 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 2.9 pm0 -67.02 -11.42 56.99 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.633 1.573 . . . . 0.0 114.541 -176.35 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 40.2 mtp180 -57.71 -36.03 71.45 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 125.02 1.328 . . . . 0.0 112.789 172.359 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.5 175.48 30.77 Favored Glycine 0 CA--C 1.529 0.928 0 C-N-CA 124.288 0.947 . . . . 0.0 113.663 -176.935 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 37.6 p90 -120.52 153.45 36.67 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.967 1.307 . . . . 0.0 113.064 -176.801 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 57.1 m-85 -127.59 38.55 4.03 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 127.74 2.416 . . . . 0.0 109.327 -179.119 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.84 151.1 43.27 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.899 1.68 . . . . 0.0 115.348 -170.405 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' B' B ' 27' ' ' THR . . . . . 0.461 ' HG1' ' N ' ' A' ' 2' ' ' ILE . 18.9 p -97.86 134.79 21.92 Favored Pre-proline 0 N--CA 1.473 0.7 0 C-N-CA 124.72 1.208 . . . . 0.0 111.76 -175.215 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -76.55 173.84 13.82 Favored 'Trans proline' 0 C--N 1.351 0.68 0 C-N-CA 124.442 3.428 . . . . 0.0 112.17 -175.093 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.546 0.794 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 173.619 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 10.8 tp . . . . . 0 N--CA 1.487 1.389 0 N-CA-C 113.951 1.093 . . . . 0.0 113.951 . . . . . . . . . 0 0 . 1 . 038 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 6.4 t -70.11 -21.11 23.49 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.276 0 C-N-CA 124.593 1.157 . . . . 0.0 112.682 -179.819 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -86.98 -48.03 8.46 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 123.784 0.834 . . . . 0.0 109.227 167.789 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 33.5 tt0 -65.33 -43.47 90.82 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 124.968 1.307 . . . . 0.0 113.87 -167.569 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 67.2 m -73.83 -12.7 60.76 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 113.545 0.942 . . . . 0.0 113.545 173.959 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 15.1 t -104.66 -43.55 5.1 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.955 1.302 . . . . 0.0 113.353 -168.863 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 81.5 p -85.84 -28.36 24.5 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 124.951 1.3 . . . . 0.0 112.279 175.328 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 5.5 t -126.39 -169.55 2.04 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.319 1.447 . . . . 0.0 111.035 170.107 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 6.5 tt -98.37 147.73 6.56 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.513 0 C-N-CA 125.08 1.352 . . . . 0.0 110.719 177.353 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 17.5 p -133.63 150.36 51.58 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 113.889 1.07 . . . . 0.0 113.889 -178.698 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 34.2 t -91.59 160.92 15.15 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 125.826 1.65 . . . . 0.0 112.276 178.195 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 10.0 mp -59.09 -29.18 67.16 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.357 1.063 . . . . 0.0 111.54 171.303 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 94.6 t80 -60.99 -37.72 83.47 Favored 'General case' 0 CA--C 1.54 0.56 0 O-C-N 121.55 -0.719 . . . . 0.0 112.786 171.546 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 37.0 mt-30 -74.73 -38.33 62.3 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 123.413 0.685 . . . . 0.0 110.45 177.618 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 95.5 mt -60.71 -43.77 97.4 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 123.467 0.707 . . . . 0.0 111.795 173.579 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -68.63 -35.28 77.09 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 113.518 0.932 . . . . 0.0 113.518 173.314 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -63.68 -32.18 73.58 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-N 119.535 1.061 . . . . 0.0 113.105 -177.627 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 41.4 m-85 -86.61 -1.97 58.11 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 124.786 1.234 . . . . 0.0 113.89 172.491 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 6.5 t -86.95 172.44 10.03 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 124.27 1.028 . . . . 0.0 112.542 171.47 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 19.8 m120 . . . . . 0 C--O 1.253 1.265 0 C-N-CA 125.68 1.592 . . . . 0.0 112.878 176.564 . . . . . . . . 0 0 . 1 . 038 nuclear build core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 65.2 m-85 . . . . . 0 N--CA 1.489 1.51 0 N-CA-C 111.343 0.127 . . . . 0.0 111.343 . . . . . . . . . 0 0 . 1 . 038 nuclear build core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 32.6 m -76.13 -6.11 8.32 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.388 0 C-N-CA 124.65 1.18 . . . . 0.0 114.08 -179.829 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 4.0 m120 -63.37 146.37 53.67 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.739 1.216 . . . . 0.0 113.036 -174.399 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 44.2 mt-30 -142.4 157.92 44.26 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.159 1.384 . . . . 0.0 111.868 -177.833 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 84.9 m-70 -95.03 126.47 40.39 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 108.166 -1.05 . . . . 0.0 108.166 167.197 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 54.5 mt -144.58 138.68 27.63 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 125.137 1.375 . . . . 0.0 109.862 -172.395 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 1.8 t -154.99 151.99 29.13 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 123.358 0.663 . . . . 0.0 111.664 -179.169 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 57.69 -133.11 52.8 Favored Glycine 0 CA--C 1.532 1.106 0 C-N-CA 124.336 0.969 . . . . 0.0 113.434 175.303 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 23.3 p -54.22 -43.22 70.62 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.734 1.214 . . . . 0.0 112.968 179.03 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 15.7 m-70 -67.15 -32.37 73.42 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 120.848 -1.157 . . . . 0.0 112.912 179.446 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 57.4 tp -68.91 -41.88 77.61 Favored 'General case' 0 N--CA 1.468 0.438 0 O-C-N 121.742 -0.599 . . . . 0.0 111.473 170.343 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 55.6 t -60.39 -44.59 96.4 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 CA-C-N 118.813 0.733 . . . . 0.0 110.864 175.457 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -58.4 -50.67 72.83 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 123.879 0.872 . . . . 0.0 111.354 172.049 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.91 -42.36 99.76 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.705 0.802 . . . . 0.0 112.432 -177.677 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 60.5 mt -57.73 -45.5 85.71 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 119.035 0.834 . . . . 0.0 111.087 175.399 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 25.8 m-85 -66.96 -41.0 87.65 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 118.868 0.758 . . . . 0.0 112.763 176.152 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 75.8 mt -67.42 -43.99 79.84 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 123.808 0.843 . . . . 0.0 112.417 178.793 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 67.7 t -76.68 -38.83 31.06 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 124.417 1.087 . . . . 0.0 111.749 -175.923 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 28.8 t -80.86 -26.22 37.1 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 113.266 0.839 . . . . 0.0 113.266 178.665 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 79.2 -153.85 38.12 Favored Glycine 0 CA--C 1.528 0.881 0 C-N-CA 124.731 1.158 . . . . 0.0 112.78 179.311 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -61.35 -14.29 26.23 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 115.196 1.554 . . . . 0.0 115.196 -174.228 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 49.8 mtp180 -54.22 -48.64 70.85 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 125.159 1.384 . . . . 0.0 112.24 171.192 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.74 145.85 0.9 Allowed Glycine 0 CA--C 1.533 1.21 0 C-N-CA 125.217 1.389 . . . . 0.0 112.604 -174.881 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 14.9 p90 -98.08 166.48 11.4 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 123.924 0.89 . . . . 0.0 112.2 175.797 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 69.9 t80 -151.87 119.36 6.03 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.356 1.462 . . . . 0.0 109.295 170.314 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 54.7 t80 -161.53 148.06 14.27 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 124.142 0.977 . . . . 0.0 112.39 -172.519 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 38.2 m -86.2 117.19 68.28 Favored Pre-proline 0 N--CA 1.474 0.733 0 C-N-CA 125.191 1.397 . . . . 0.0 109.639 178.103 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -74.63 165.58 31.26 Favored 'Trans proline' 0 CA--C 1.537 0.645 0 C-N-CA 123.375 2.717 . . . . 0.0 111.869 -176.84 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 64.4 pttt . . . . . 0 N--CA 1.477 0.894 0 N-CA-C 114.23 1.196 . . . . 0.0 114.23 -176.597 . . . . . . . . 0 0 . 1 . 039 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 8.5 tp . . . . . 0 N--CA 1.484 1.269 0 N-CA-C 116.257 1.947 . . . . 0.0 116.257 . . . . . . . . . 0 0 . 1 . 039 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 67.6 t -68.71 -43.49 82.99 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 CA-C-N 118.619 0.645 . . . . 0.0 112.253 -171.896 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -75.45 -38.22 59.82 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 118.109 0.413 . . . . 0.0 111.505 170.372 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 52.3 tt0 -67.24 -43.53 81.73 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 125.129 1.372 . . . . 0.0 113.587 -171.058 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 41.6 m -70.04 -20.4 63.25 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 173.166 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 23.1 t -99.36 -38.2 8.93 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 118.929 0.786 . . . . 0.0 112.592 -171.972 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 67.5 p -86.74 -20.46 27.64 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 125.496 1.518 . . . . 0.0 113.416 176.412 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.5 t -138.88 -170.68 2.91 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.238 1.415 . . . . 0.0 110.725 174.361 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 78.0 mt -91.58 135.31 27.38 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 C-N-CA 124.884 1.273 . . . . 0.0 108.987 176.229 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 15.2 p -121.97 -176.11 3.26 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.217 1.007 . . . . 0.0 112.016 172.189 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 95.7 p -143.48 165.39 27.68 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 125.046 1.339 . . . . 0.0 112.294 -172.671 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 43.0 mt -58.17 -33.23 69.01 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.238 0.615 . . . . 0.0 112.106 177.731 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 71.9 t80 -65.75 -28.94 69.4 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.139 0.976 . . . . 0.0 113.23 174.25 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 54.2 mt-30 -80.1 -32.7 39.15 Favored 'General case' 0 CA--C 1.538 0.483 0 O-C-N 121.509 -0.744 . . . . 0.0 111.321 173.175 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 91.0 mt -65.94 -44.32 85.43 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 118.888 0.767 . . . . 0.0 111.495 171.763 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.0 mm-40 -52.14 -38.04 56.31 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 125.661 1.584 . . . . 0.0 112.959 172.648 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.9 t30 -62.05 -24.38 67.05 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 113.373 0.879 . . . . 0.0 113.373 -178.64 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 79.0 m-85 -105.6 12.63 30.99 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.441 1.496 . . . . 0.0 113.929 179.456 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 78.3 m -82.14 164.58 21.2 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 123.855 0.862 . . . . 0.0 110.722 167.201 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 13.8 m120 . . . . . 0 C--O 1.254 1.295 0 CA-C-O 118.243 -0.884 . . . . 0.0 112.432 170.917 . . . . . . . . 0 0 . 1 . 039 nuclear build core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 47.9 t80 . . . . . 0 N--CA 1.486 1.351 0 CA-C-O 119.705 -0.188 . . . . 0.0 110.612 . . . . . . . . . 0 0 . 1 . 039 nuclear build core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 27.6 m -64.35 -24.4 35.58 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 N-CA-C 114.513 1.301 . . . . 0.0 114.513 -173.147 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 16.8 m120 -128.19 127.74 43.49 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 126.167 1.787 . . . . 0.0 109.095 169.825 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 3.3 tt0 -169.92 166.35 9.43 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 119.139 0.881 . . . . 0.0 112.948 -170.283 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 99.4 m-70 -85.97 142.74 28.58 Favored 'General case' 0 CA--C 1.549 0.931 0 N-CA-C 108.412 -0.959 . . . . 0.0 108.412 164.198 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 75.9 mt -145.73 126.75 14.6 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 126.092 1.757 . . . . 0.0 109.477 176.098 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 92.4 m -124.92 146.04 49.54 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 125.135 1.374 . . . . 0.0 111.253 179.474 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 45.95 -122.11 5.71 Favored Glycine 0 N--CA 1.473 1.127 0 C-N-CA 125.314 1.435 . . . . 0.0 115.021 168.568 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 67.8 p -52.42 -40.11 61.78 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 125.034 1.334 . . . . 0.0 113.301 -179.931 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 2.2 m80 -70.84 -37.92 73.18 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.217 -0.927 . . . . 0.0 111.019 -177.933 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 60.6 tp -66.11 -45.0 82.66 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.346 0.658 . . . . 0.0 111.49 171.915 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 53.2 t -61.54 -43.42 96.89 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 C-N-CA 123.802 0.841 . . . . 0.0 110.99 178.766 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -65.58 -41.66 92.64 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 118.767 0.712 . . . . 0.0 112.332 173.016 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.76 -41.79 96.14 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 119.667 1.122 . . . . 0.0 112.111 174.938 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 54.8 mt -61.21 -44.24 97.6 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 123.524 0.729 . . . . 0.0 111.317 173.627 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 13.9 m-30 -58.86 -43.41 90.84 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 119.495 1.043 . . . . 0.0 112.025 175.138 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 8.3 mp -67.46 -45.45 75.94 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 124.083 0.953 . . . . 0.0 112.427 177.28 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 45.5 t -69.4 -48.71 65.62 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 C-N-CA 123.351 0.661 . . . . 0.0 111.637 -178.506 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 62.6 m -70.6 -39.0 74.06 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 118.53 0.605 . . . . 0.0 112.281 -176.936 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.58 -137.76 42.38 Favored Glycine 0 CA--C 1.527 0.815 0 C-N-CA 124.281 0.944 . . . . 0.0 112.347 176.863 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -63.94 -15.84 60.09 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 114.549 1.314 . . . . 0.0 114.549 -177.861 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 91.6 mtm180 -67.1 -35.13 79.13 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 123.818 0.847 . . . . 0.0 112.727 175.994 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 94.44 154.2 30.8 Favored Glycine 0 CA--C 1.533 1.212 0 C-N-CA 125.34 1.448 . . . . 0.0 113.322 -172.401 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 53.7 p90 -93.41 153.84 18.28 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 125.946 1.698 . . . . 0.0 111.326 176.962 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 20.4 t80 -144.06 21.12 1.76 Allowed 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 124.302 1.041 . . . . 0.0 112.953 -173.483 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 17.3 p90 -65.89 147.25 53.66 Favored 'General case' 0 CA--C 1.55 0.951 0 O-C-N 120.715 -1.241 . . . . 0.0 113.181 178.067 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' B' B ' 27' ' ' THR . . . . . 0.583 ' H ' ' CD ' ' B' ' 28' ' ' PRO . 74.3 p -139.81 -26.98 0.01 OUTLIER Pre-proline 0 N--CA 1.479 1.009 0 CA-C-O 115.532 -2.175 . . . . 0.0 116.105 178.436 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' B' B ' 28' ' ' PRO . . . . . 0.583 ' CD ' ' H ' ' B' ' 27' ' ' THR . 94.5 Cg_exo -54.72 144.61 64.41 Favored 'Trans proline' 0 C--N 1.361 1.201 0 C-N-CA 122.969 2.446 . . . . 0.0 114.277 -177.207 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 58.0 tttt . . . . . 0 CA--C 1.557 1.235 0 C-N-CA 127.818 2.447 . . . . 0.0 116.509 178.992 . . . . . . . . 0 0 . 1 . 040 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 10.3 tp . . . . . 0 N--CA 1.481 1.109 0 N-CA-C 113.997 1.11 . . . . 0.0 113.997 . . . . . . . . . 0 0 . 1 . 040 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 9.9 p -64.82 -34.49 70.59 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.295 0 CA-C-N 119.54 1.064 . . . . 0.0 112.587 -176.338 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 26.6 pt-20 -71.57 -3.69 22.82 Favored 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 113.95 1.092 . . . . 0.0 113.95 174.472 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 53.6 tp60 -104.05 -58.62 1.85 Allowed 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.165 0.986 . . . . 0.0 109.042 167.906 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 58.9 m -68.99 -25.99 64.79 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 114.701 1.371 . . . . 0.0 114.701 -169.524 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 11.7 t -80.85 -39.89 25.76 Favored 'General case' 0 N--CA 1.472 0.631 0 O-C-N 121.57 -0.706 . . . . 0.0 112.22 -175.744 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 24.5 p -95.1 -31.09 13.72 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 126.238 1.815 . . . . 0.0 112.686 -177.498 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 10.7 t -129.35 -169.75 2.16 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.975 1.71 . . . . 0.0 110.761 178.27 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 33.2 mm -87.92 146.71 5.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 C-N-CA 125.049 1.34 . . . . 0.0 111.273 -174.381 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 4.1 m -124.27 159.23 30.69 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 122.637 1.208 . . . . 0.0 114.006 170.742 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 17.7 t -130.78 157.23 43.4 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 127.598 2.359 . . . . 0.0 110.533 173.884 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 17.5 mt -59.7 -26.05 65.28 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 114.284 1.216 . . . . 0.0 114.284 -169.552 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 92.7 t80 -59.8 -33.69 72.06 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 121.548 -0.72 . . . . 0.0 112.572 173.227 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 68.3 mt-30 -78.88 -32.48 45.91 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.768 1.227 . . . . 0.0 111.122 179.376 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -63.02 -50.48 70.51 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.755 0.822 . . . . 0.0 109.681 170.489 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -60.33 -33.54 72.54 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 113.499 0.925 . . . . 0.0 113.499 178.308 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 19.1 t-20 -61.16 -24.0 65.97 Favored 'General case' 0 CA--C 1.548 0.889 0 N-CA-C 114.146 1.165 . . . . 0.0 114.146 -177.577 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 58.7 m-85 -106.73 3.84 27.06 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.612 1.565 . . . . 0.0 114.132 179.081 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 89.4 m -84.34 165.75 17.99 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.112 0.965 . . . . 0.0 113.422 173.652 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.252 1.228 0 C-N-CA 125.28 1.432 . . . . 0.0 110.731 -176.342 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 78.4 t80 . . . . . 0 N--CA 1.489 1.495 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 . . . . . . . . . 0 0 . 1 . 040 nuclear build core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 14.3 p -67.93 131.04 33.48 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.246 0 CA-C-N 119.085 0.857 . . . . 0.0 111.796 -176.294 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 19.1 t30 -166.83 102.15 0.56 Allowed 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.142 1.777 . . . . 0.0 108.143 -169.843 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -163.78 167.05 21.39 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 123.483 0.713 . . . . 0.0 111.664 -166.545 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 96.2 m-70 -70.79 146.18 49.91 Favored 'General case' 0 CA--C 1.549 0.916 0 O-C-N 121.06 -1.025 . . . . 0.0 111.489 168.918 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 74.5 mt -145.2 134.27 22.67 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 125.768 1.627 . . . . 0.0 109.848 174.113 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 5.5 t -148.08 153.11 38.47 Favored 'General case' 0 N--CA 1.47 0.553 0 O-C-N 121.198 -0.938 . . . . 0.0 112.76 179.366 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 54.18 -128.18 40.54 Favored Glycine 0 N--CA 1.471 0.99 0 C-N-CA 124.635 1.112 . . . . 0.0 113.54 172.68 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 76.4 p -53.13 -37.08 61.49 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 125.036 1.335 . . . . 0.0 113.065 177.436 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 5.3 m80 -74.88 -36.41 62.27 Favored 'General case' 0 CA--C 1.54 0.581 0 O-C-N 121.486 -0.759 . . . . 0.0 111.24 -178.851 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 56.1 tp -67.61 -43.99 79.11 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 123.304 0.642 . . . . 0.0 111.48 172.646 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 46.8 t -59.85 -46.65 93.54 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 C-N-CA 124.351 1.06 . . . . 0.0 110.659 175.437 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -63.3 -42.97 99.08 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.154 0.582 . . . . 0.0 111.462 175.561 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.15 -42.13 98.0 Favored 'General case' 0 CA--C 1.536 0.415 0 O-C-N 121.255 -0.903 . . . . 0.0 112.166 176.999 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 43.5 mt -59.08 -42.67 90.97 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 118.796 0.725 . . . . 0.0 111.219 175.736 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 36.9 m-85 -68.64 -37.4 79.66 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 113.554 0.946 . . . . 0.0 113.554 173.796 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 65.2 mt -67.77 -42.75 81.24 Favored 'General case' 0 N--CA 1.473 0.715 0 O-C-N 121.066 -1.021 . . . . 0.0 112.178 176.663 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 74.6 t -72.26 -48.92 46.3 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 124.484 1.114 . . . . 0.0 111.27 -179.271 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 61.9 m -97.82 -7.99 29.33 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 114.702 1.371 . . . . 0.0 114.702 -169.777 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 83.37 -161.32 38.99 Favored Glycine 0 N--CA 1.469 0.864 0 C-N-CA 125.451 1.501 . . . . 0.0 113.179 179.627 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 2.9 pm0 -63.92 -12.39 36.67 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.445 1.498 . . . . 0.0 114.167 -178.879 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 57.8 mtm180 -57.4 -38.16 73.84 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 124.923 1.289 . . . . 0.0 112.675 171.607 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 69.83 -150.47 49.27 Favored Glycine 0 CA--C 1.532 1.095 0 C-N-CA 124.171 0.891 . . . . 0.0 112.326 -172.302 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 53.5 p90 -141.42 155.81 45.84 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.988 1.315 . . . . 0.0 113.226 -170.206 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 74.2 t80 -90.03 -25.71 20.68 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.649 1.18 . . . . 0.0 113.12 -175.989 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 63.2 t80 -65.71 148.77 51.22 Favored 'General case' 0 CA--C 1.543 0.676 0 N-CA-C 114.765 1.395 . . . . 0.0 114.765 -173.034 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 20.8 p -115.66 114.92 42.0 Favored Pre-proline 0 N--CA 1.476 0.85 0 C-N-CA 126.042 1.737 . . . . 0.0 109.511 171.962 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -57.25 136.25 75.18 Favored 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 123.632 2.888 . . . . 0.0 112.719 178.279 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 19.9 ptmt . . . . . 0 CA--C 1.545 0.757 0 N-CA-C 114.004 1.112 . . . . 0.0 114.004 -178.478 . . . . . . . . 0 0 . 1 . 041 nuclear build core ' A' A ' 2' ' ' ILE . . . . . 0.534 ' N ' ' HG1' ' B' ' 27' ' ' THR . 18.1 tt . . . . . 0 N--CA 1.48 1.074 0 N-CA-C 114.675 1.361 . . . . 0.0 114.675 . . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 4.9 p -61.68 -26.91 41.02 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 C-N-CA 123.747 0.819 . . . . 0.0 112.411 178.827 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -73.0 -5.08 36.43 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.17 0.988 . . . . 0.0 112.649 177.099 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 24.2 tt0 -113.78 -56.64 2.38 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.265 1.026 . . . . 0.0 110.06 170.441 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 12.4 m -67.36 -24.1 65.67 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 115.393 1.627 . . . . 0.0 115.393 -173.361 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 34.5 t -91.73 -47.95 7.08 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 119.608 1.095 . . . . 0.0 112.214 -178.977 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 5.3 t -71.19 -29.95 65.8 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.429 1.092 . . . . 0.0 113.131 -178.946 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.2 t -131.76 -173.36 3.11 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.855 1.262 . . . . 0.0 111.231 175.758 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 61.8 mt -84.03 140.56 15.98 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 C-N-CA 124.639 1.176 . . . . 0.0 109.885 177.209 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 12.9 p -136.38 154.89 50.68 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 122.207 1.003 . . . . 0.0 113.165 170.136 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 8.4 t -119.04 173.09 7.11 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 126.047 1.739 . . . . 0.0 111.776 178.823 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 62.9 mt -56.46 -33.81 66.28 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.255 1.422 . . . . 0.0 112.946 -171.13 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 90.5 t80 -60.89 -34.61 74.9 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 123.817 0.847 . . . . 0.0 112.784 175.121 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -79.09 -28.84 43.08 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 124.527 1.131 . . . . 0.0 111.036 177.927 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 58.8 mt -67.29 -50.16 61.43 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 123.356 0.662 . . . . 0.0 110.404 170.466 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -63.9 -27.04 68.88 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.067 0.947 . . . . 0.0 113.147 178.129 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 17.6 t30 -61.35 -35.23 76.87 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 124.319 1.048 . . . . 0.0 113.292 -179.376 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 26.0 m-85 -81.21 -24.64 37.31 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 113.652 0.982 . . . . 0.0 113.652 177.479 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 69.2 m -71.83 149.34 45.33 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.051 1.34 . . . . 0.0 112.502 -178.689 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.251 1.165 0 C-N-CA 128.112 2.565 . . . . 0.0 112.439 -172.309 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 80.2 m-85 . . . . . 0 N--CA 1.487 1.4 0 CA-C-O 119.599 -0.238 . . . . 0.0 111.142 . . . . . . . . . 0 0 . 1 . 041 nuclear build core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 22.7 t 86.82 -58.6 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.287 0 C-N-CA 129.077 2.951 . . . . 0.0 110.264 177.064 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 16.1 p-10 -86.03 104.06 15.29 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 123.317 0.647 . . . . 0.0 109.402 168.828 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -146.06 171.08 15.42 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.136 1.374 . . . . 0.0 111.412 -169.099 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 48.2 m-70 -80.82 138.64 36.23 Favored 'General case' 0 CA--C 1.549 0.912 0 O-C-N 121.044 -1.035 . . . . 0.0 108.923 167.113 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 30.8 mt -138.9 135.61 34.63 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 125.778 1.631 . . . . 0.0 109.335 175.305 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 1.8 t -141.63 148.82 39.8 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 -174.65 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 53.95 -135.37 43.2 Favored Glycine 0 N--CA 1.47 0.94 0 C-N-CA 124.765 1.174 . . . . 0.0 114.127 169.94 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 5.6 m -59.12 -26.3 64.58 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 177.008 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -70.24 -36.89 74.79 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 120.239 1.381 . . . . 0.0 111.77 174.123 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 53.1 tp -70.33 -42.11 72.34 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.058 0.943 . . . . 0.0 111.675 172.763 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 78.2 t -60.65 -42.52 92.13 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.888 0 C-N-CA 123.096 0.558 . . . . 0.0 110.628 174.381 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -67.77 -39.17 84.16 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.855 0.862 . . . . 0.0 112.301 175.239 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -57.96 -42.27 84.66 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 121.359 -0.838 . . . . 0.0 111.234 171.633 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 6.7 mp -65.36 -39.07 91.87 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 118.815 0.734 . . . . 0.0 112.137 173.787 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 22.0 m-30 -59.66 -39.91 86.02 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-N 119.71 1.141 . . . . 0.0 112.08 174.372 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 88.4 mt -74.34 -51.27 15.63 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.58 1.152 . . . . 0.0 111.961 178.145 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 76.2 t -75.79 -37.07 34.71 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 C-N-CA 124.221 1.008 . . . . 0.0 112.133 -171.43 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 72.2 m -105.89 19.41 20.58 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.496 1.119 . . . . 0.0 113.695 -176.2 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -58.06 -29.05 61.88 Favored Glycine 0 CA--C 1.535 1.296 0 CA-C-N 119.149 0.886 . . . . 0.0 113.97 -179.268 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -94.38 -33.36 13.19 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.93 1.292 . . . . 0.0 112.979 172.475 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 35.6 mmt180 -68.93 -28.62 66.82 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 124.156 0.982 . . . . 0.0 113.284 178.948 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 86.08 107.25 0.75 Allowed Glycine 0 CA--C 1.529 0.957 0 N-CA-C 108.81 -1.716 . . . . 0.0 108.81 -167.293 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 13.4 p90 -74.23 152.92 39.64 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 -177.466 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 86.6 t80 -151.34 80.12 1.3 Allowed 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 125.142 1.377 . . . . 0.0 108.702 177.452 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 43.4 p90 -79.89 141.69 35.88 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.285 1.434 . . . . 0.0 112.859 -176.443 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' B' B ' 27' ' ' THR . . . . . 0.534 ' HG1' ' N ' ' A' ' 2' ' ' ILE . 27.9 p -134.61 66.87 70.69 Favored Pre-proline 0 N--CA 1.477 0.9 0 C-N-CA 125.179 1.391 . . . . 0.0 113.142 -176.406 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -73.34 139.08 28.46 Favored 'Trans proline' 0 C--N 1.351 0.701 0 C-N-CA 123.06 2.507 . . . . 0.0 109.461 168.487 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 78.2 tttt . . . . . 0 CA--C 1.541 0.621 0 N-CA-C 113.26 0.837 . . . . 0.0 113.26 -170.24 . . . . . . . . 0 0 . 1 . 042 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 3.8 tt . . . . . 0 N--CA 1.48 1.069 0 N-CA-C 115.051 1.5 . . . . 0.0 115.051 . . . . . . . . . 0 0 . 1 . 042 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 3.9 p -62.03 -29.05 45.61 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.349 0 CA-C-N 121.325 1.875 . . . . 0.0 110.968 179.249 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -65.6 -10.37 34.97 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 126.254 1.822 . . . . 0.0 113.519 174.592 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 36.9 tt0 -111.29 -53.01 2.75 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.334 1.454 . . . . 0.0 109.9 169.152 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 85.2 m -60.73 -31.52 70.82 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 114.265 1.209 . . . . 0.0 114.265 -173.267 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 8.7 t -91.24 -20.82 21.51 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 113.253 0.835 . . . . 0.0 113.253 -173.894 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 30.0 p -104.14 -27.44 12.07 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 126.368 1.867 . . . . 0.0 112.715 179.988 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 10.3 t -144.01 -165.94 2.24 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.895 2.078 . . . . 0.0 110.163 -177.943 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 29.2 mm -87.65 144.23 9.66 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 C-N-CA 124.963 1.305 . . . . 0.0 110.804 178.082 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.8 p -138.44 179.07 6.68 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.518 1.527 . . . . 0.0 110.65 168.966 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 7.4 t -152.49 166.96 30.35 Favored 'General case' 0 N--CA 1.474 0.755 0 O-C-N 120.733 -1.23 . . . . 0.0 113.925 -174.045 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 26.9 mt -61.11 -34.48 75.02 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.647 1.579 . . . . 0.0 112.286 -170.625 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 87.1 t80 -60.74 -28.08 68.42 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.454 1.102 . . . . 0.0 112.993 175.553 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 41.8 mt-30 -82.96 -38.35 22.84 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 123.748 0.819 . . . . 0.0 111.23 173.276 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 84.9 mt -61.31 -34.5 75.34 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.908 0.883 . . . . 0.0 112.608 177.017 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -54.72 -32.21 59.33 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 113.423 0.898 . . . . 0.0 113.423 171.857 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 16.5 t-20 -68.18 -19.1 64.75 Favored 'General case' 0 CA--C 1.547 0.834 0 CA-C-N 118.92 0.782 . . . . 0.0 113.073 179.469 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 97.4 m-85 -98.1 4.55 49.13 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.568 1.547 . . . . 0.0 113.659 178.347 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 17.5 t -77.41 173.9 11.43 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 124.903 1.281 . . . . 0.0 111.312 168.481 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.049 0 C-N-CA 125.105 1.362 . . . . 0.0 111.531 169.634 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 75.8 m-85 . . . . . 0 N--CA 1.487 1.392 0 N-CA-C 107.757 -1.201 . . . . 0.0 107.757 . . . . . . . . . 0 0 . 1 . 042 nuclear build core ' B' B ' 2' ' ' VAL . . . . . 0.47 HG12 ' H ' ' B' ' 3' ' ' ASN . 4.2 t 69.28 176.9 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.706 0 C-N-CA 125.42 1.488 . . . . 0.0 108.934 -168.167 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' B' B ' 3' ' ' ASN . . . . . 0.47 ' H ' HG12 ' B' ' 2' ' ' VAL . 7.2 p30 -62.24 131.9 50.94 Favored 'General case' 0 CA--C 1.546 0.811 0 O-C-N 120.357 -1.464 . . . . 0.0 111.533 174.523 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 70.4 mt-30 -160.75 173.42 15.44 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.968 1.307 . . . . 0.0 111.032 -169.345 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 99.3 m-70 -87.49 139.24 30.75 Favored 'General case' 0 CA--C 1.549 0.915 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 165.093 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 5.0 mp -143.03 145.48 32.95 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 124.969 1.308 . . . . 0.0 111.116 177.717 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 1.8 t -156.35 151.3 26.2 Favored 'General case' 0 N--CA 1.468 0.445 0 O-C-N 121.212 -0.93 . . . . 0.0 112.022 178.935 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 53.52 -129.49 40.9 Favored Glycine 0 N--CA 1.472 1.053 0 C-N-CA 124.326 0.965 . . . . 0.0 114.044 172.625 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.5 m -57.16 -31.99 65.95 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 124.481 1.113 . . . . 0.0 113.79 178.854 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -71.42 -38.08 71.42 Favored 'General case' 0 CA--C 1.544 0.737 0 O-C-N 120.983 -1.073 . . . . 0.0 111.492 176.164 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 42.4 tp -67.85 -41.29 83.14 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 123.485 0.714 . . . . 0.0 110.844 174.183 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 40.4 t -59.31 -45.86 92.88 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.975 0 C-N-CA 124.542 1.137 . . . . 0.0 111.306 172.599 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -63.09 -43.51 98.31 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.456 0.702 . . . . 0.0 111.447 177.033 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -65.13 -39.85 93.62 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 121.35 -0.844 . . . . 0.0 112.406 177.075 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 48.7 mt -61.18 -42.54 98.75 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 118.521 0.6 . . . . 0.0 111.351 174.098 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 17.0 m-85 -62.26 -41.54 98.54 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 119.079 0.854 . . . . 0.0 112.613 172.291 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 73.3 mt -67.25 -43.12 82.7 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 123.668 0.787 . . . . 0.0 112.193 178.498 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 55.1 t -72.53 -44.55 61.17 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 C-N-CA 123.896 0.878 . . . . 0.0 112.384 -179.149 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 35.5 t -82.86 -24.98 32.99 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 113.397 0.888 . . . . 0.0 113.397 -177.914 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 74.35 -155.23 48.59 Favored Glycine 0 CA--C 1.529 0.962 0 C-N-CA 124.65 1.119 . . . . 0.0 112.422 -178.334 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -62.69 -12.16 21.87 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 114.455 1.279 . . . . 0.0 114.455 179.471 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 56.1 mtp85 -61.3 -31.04 70.87 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.939 1.296 . . . . 0.0 112.683 175.007 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.39 139.48 1.5 Allowed Glycine 0 CA--C 1.533 1.218 0 C-N-CA 125.56 1.552 . . . . 0.0 112.945 -178.706 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 7.1 p90 -74.7 160.61 30.55 Favored 'General case' 0 CA--C 1.541 0.626 0 O-C-N 121.933 -0.745 . . . . 0.0 112.97 177.48 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 76.8 t80 -91.24 -27.67 18.3 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 125.21 1.404 . . . . 0.0 112.79 175.352 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 18.3 t80 -117.44 139.8 50.42 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 126.196 1.799 . . . . 0.0 113.069 -170.99 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 26.2 p -110.57 155.28 42.39 Favored Pre-proline 0 N--CA 1.478 0.926 0 C-N-CA 125.149 1.38 . . . . 0.0 108.54 167.509 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_exo -50.82 129.16 26.64 Favored 'Trans proline' 0 C--N 1.351 0.696 0 C-N-CA 123.558 2.839 . . . . 0.0 112.636 -177.06 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 7.0 mtmp? . . . . . 0 N--CA 1.482 1.159 0 C-N-CA 128.272 2.629 . . . . 0.0 113.452 179.946 . . . . . . . . 0 0 . 1 . 043 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 11.7 pt . . . . . 0 N--CA 1.487 1.392 0 N-CA-C 114.347 1.24 . . . . 0.0 114.347 . . . . . . . . . 0 0 . 1 . 043 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 7.1 p -57.84 -34.14 47.45 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 C-N-CA 124.973 1.309 . . . . 0.0 112.695 -174.977 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -70.38 -47.82 59.1 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 118.252 0.478 . . . . 0.0 110.863 172.172 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -71.2 -43.9 66.47 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.674 0.789 . . . . 0.0 111.837 -171.414 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 67.8 m -58.92 -28.34 66.12 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 123.991 0.916 . . . . 0.0 112.415 172.932 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 8.7 t -83.09 -54.33 5.12 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.706 0.803 . . . . 0.0 111.466 -178.86 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 81.3 p -77.66 -21.66 51.82 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 124.517 1.127 . . . . 0.0 113.739 -177.03 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.7 t -143.49 -165.39 2.08 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.386 1.474 . . . . 0.0 111.126 -178.508 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 37.6 mt -99.39 132.82 44.09 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 C-N-CA 125.295 1.438 . . . . 0.0 109.887 -174.531 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 7.8 p -132.8 159.19 40.48 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.247 1.019 . . . . 0.0 112.858 178.962 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 77.3 p -108.94 163.39 13.34 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 114.661 1.356 . . . . 0.0 114.661 -169.687 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 75.2 mt -59.55 -30.26 68.5 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 121.398 -0.814 . . . . 0.0 112.567 174.781 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 94.0 t80 -63.79 -33.43 75.64 Favored 'General case' 0 N--CA 1.473 0.688 0 O-C-N 121.383 -0.823 . . . . 0.0 112.603 173.802 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 58.3 mt-30 -74.1 -37.5 64.12 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 123.414 0.685 . . . . 0.0 110.868 173.617 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 41.2 mt -60.8 -43.74 97.76 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 118.336 0.516 . . . . 0.0 112.156 171.465 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -59.07 -38.91 80.55 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.033 0.933 . . . . 0.0 112.538 172.465 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 -65.1 -22.68 66.98 Favored 'General case' 0 CA--C 1.552 1.048 0 O-C-N 121.436 -0.79 . . . . 0.0 112.981 174.368 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -90.58 -1.81 57.88 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 125.953 1.701 . . . . 0.0 114.271 173.482 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 78.2 m -71.95 158.84 35.27 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 119.973 1.26 . . . . 0.0 112.112 171.418 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 . . . . . 0 C--O 1.255 1.35 0 C-N-CA 125.155 1.382 . . . . 0.0 113.497 179.669 . . . . . . . . 0 0 . 1 . 043 nuclear build core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . 0.25 48.7 p90 . . . . . 0 N--CA 1.481 1.12 0 CA-C-O 117.107 -1.425 . . . . 0.0 113.267 . . . . . . . . . 1 1 . 1 . 043 nuclear build core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 3.5 p -176.29 -51.47 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 CA-C-N 121.228 1.831 . . . . 0.0 113.512 178.066 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 63.7 t30 -120.48 99.76 6.75 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 123.945 0.898 . . . . 0.0 110.158 -169.84 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 8.5 mt-30 -143.45 168.38 19.98 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 124.795 1.238 . . . . 0.0 113.056 -166.255 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 26.2 m-70 -77.54 135.34 38.19 Favored 'General case' 0 CA--C 1.549 0.926 0 N-CA-C 108.339 -0.985 . . . . 0.0 108.339 166.159 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 87.8 mt -144.1 128.51 17.93 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 125.961 1.704 . . . . 0.0 109.343 177.874 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 5.6 t -145.8 145.29 30.74 Favored 'General case' 0 N--CA 1.469 0.504 0 O-C-N 121.335 -0.853 . . . . 0.0 112.174 -179.495 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.08 -125.85 36.99 Favored Glycine 0 N--CA 1.469 0.842 0 C-N-CA 124.395 0.998 . . . . 0.0 113.354 175.926 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 28.9 p -56.4 -35.79 68.16 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.763 1.225 . . . . 0.0 113.448 178.487 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 94.8 m-70 -68.26 -39.71 82.11 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 120.78 -1.2 . . . . 0.0 111.945 176.872 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 38.4 tp -68.13 -42.7 79.8 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 123.734 0.813 . . . . 0.0 111.308 174.41 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 40.9 t -61.37 -42.21 92.82 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.973 0 C-N-CA 124.095 0.958 . . . . 0.0 111.315 174.878 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -63.93 -44.9 91.47 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 123.829 0.852 . . . . 0.0 111.528 174.537 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.79 -39.33 91.31 Favored 'General case' 0 CA--C 1.541 0.599 0 O-C-N 121.466 -0.771 . . . . 0.0 112.117 175.988 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 70.1 mt -66.08 -40.05 90.54 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 118.526 -0.749 . . . . 0.0 112.194 174.039 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 19.4 m-85 -60.18 -40.42 89.94 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 120.363 1.438 . . . . 0.0 112.236 170.943 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 81.0 mt -68.07 -44.69 75.73 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.632 0.773 . . . . 0.0 112.47 177.336 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 53.0 t -73.46 -47.82 44.03 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 123.725 0.81 . . . . 0.0 112.181 -179.258 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 56.7 m -80.84 -32.07 35.26 Favored 'General case' 0 N--CA 1.47 0.544 0 N-CA-C 113.227 0.825 . . . . 0.0 113.227 -174.205 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 66.75 -138.34 35.33 Favored Glycine 0 CA--C 1.53 1.0 0 C-N-CA 124.137 0.875 . . . . 0.0 111.999 -177.934 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -62.26 -21.39 65.15 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 124.775 1.23 . . . . 0.0 113.258 -178.684 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 89.4 mtm180 -61.79 -35.75 79.08 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.151 0.981 . . . . 0.0 112.939 178.326 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.68 -175.73 49.39 Favored Glycine 0 CA--C 1.533 1.21 0 C-N-CA 124.131 0.872 . . . . 0.0 113.033 -171.232 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 2.0 p90 -130.03 167.68 17.91 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.146 1.378 . . . . 0.0 114.48 -170.442 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 58.1 t80 -93.38 1.53 56.87 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 127.303 2.241 . . . . 0.0 113.125 176.837 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 76.7 t80 -52.05 141.46 18.2 Favored 'General case' 0 CA--C 1.546 0.798 0 N-CA-C 115.753 1.761 . . . . 0.0 115.753 -171.902 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -162.97 127.37 1.96 Allowed Pre-proline 0 N--CA 1.47 0.573 0 C-N-CA 127.347 2.259 . . . . 0.0 108.0 170.463 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -70.5 145.66 53.47 Favored 'Trans proline' 0 C--N 1.35 0.641 0 C-N-CA 123.2 2.6 . . . . 0.0 113.434 -169.033 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 35.9 mmtm . . . . . 0 CA--C 1.55 0.952 0 C-N-CA 125.579 1.552 . . . . 0.0 113.056 173.481 . . . . . . . . 0 0 . 1 . 044 nuclear build core ' A' A ' 2' ' ' ILE . . . . . 0.576 ' N ' ' HG1' ' B' ' 27' ' ' THR . 9.6 tp . . . . . 0 N--CA 1.475 0.795 0 N-CA-C 113.647 0.981 . . . . 0.0 113.647 . . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 41.5 t -68.49 -35.33 70.03 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.107 0 CA-C-N 120.02 1.282 . . . . 0.0 111.092 -172.625 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.3 pm0 -69.97 -9.9 56.74 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 113.64 0.978 . . . . 0.0 113.64 174.884 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 60.5 mt-30 -93.96 -58.48 2.23 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 118.706 0.684 . . . . 0.0 109.199 169.716 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 86.7 m -76.42 -27.93 56.44 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 115.689 1.736 . . . . 0.0 115.689 -169.395 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 16.3 t -85.41 -49.51 8.05 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 118.404 0.547 . . . . 0.0 110.726 179.65 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 15.3 m -64.75 -38.23 90.29 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 126.248 1.819 . . . . 0.0 111.924 -178.197 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 65.8 m -142.92 -176.0 4.73 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 125.592 1.557 . . . . 0.0 111.405 -173.898 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 95.6 mt -79.38 122.77 35.27 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 O-C-N 120.252 -1.53 . . . . 0.0 108.174 168.057 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 20.8 p -100.77 157.08 16.97 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.934 0.893 . . . . 0.0 111.407 170.627 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 37.5 t -79.97 152.9 29.25 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 120.948 -1.095 . . . . 0.0 112.067 175.51 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.432 HD22 ' H ' ' A' ' 13' ' ' LEU . 2.6 mm? -62.11 -28.43 69.62 Favored 'General case' 0 CA--C 1.543 0.709 0 O-C-N 121.038 -1.039 . . . . 0.0 110.721 170.77 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.7 t80 -66.8 -30.96 71.28 Favored 'General case' 0 CA--C 1.542 0.654 0 O-C-N 121.324 -0.86 . . . . 0.0 112.996 170.435 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 94.7 mt-30 -76.16 -33.96 59.37 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 121.453 -0.779 . . . . 0.0 110.879 175.361 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 93.9 mt -59.2 -49.87 76.19 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 119.192 0.906 . . . . 0.0 110.19 168.479 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -62.79 -29.5 70.75 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 114.249 1.203 . . . . 0.0 114.249 176.48 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -63.01 -24.83 68.1 Favored 'General case' 0 CA--C 1.548 0.868 0 CA-C-N 119.527 1.058 . . . . 0.0 113.012 -179.306 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 52.9 m-85 -95.15 2.95 55.16 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.427 1.491 . . . . 0.0 113.624 173.732 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 95.4 m -103.76 124.72 49.41 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 121.218 -0.926 . . . . 0.0 112.966 179.753 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.252 1.225 0 C-N-CA 127.254 2.221 . . . . 0.0 112.843 -169.262 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 45.6 p90 . . . . . 0 N--CA 1.485 1.294 0 CA-C-O 119.745 -0.169 . . . . 0.0 110.887 . . . . . . . . . 0 0 . 1 . 044 nuclear build core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 22.4 m -138.03 151.14 25.08 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 C-N-CA 124.983 1.313 . . . . 0.0 111.093 171.638 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 60.8 t30 -77.92 179.69 6.58 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 124.233 1.013 . . . . 0.0 111.61 170.447 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 15.8 mp0 -107.68 169.89 8.32 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.828 1.651 . . . . 0.0 110.914 177.838 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 15.1 m-70 -71.28 139.62 50.05 Favored 'General case' 0 CA--C 1.545 0.763 0 O-C-N 121.376 -0.827 . . . . 0.0 109.013 167.481 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 73.7 mt -135.03 126.23 28.09 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 125.478 1.511 . . . . 0.0 108.875 179.699 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.6 t -144.36 150.02 37.1 Favored 'General case' 0 N--CA 1.47 0.538 0 O-C-N 121.691 -0.63 . . . . 0.0 112.02 -176.903 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 56.83 -128.79 47.94 Favored Glycine 0 CA--C 1.529 0.908 0 C-N-CA 124.344 0.973 . . . . 0.0 113.588 174.244 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 26.5 p -56.43 -37.48 70.27 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.853 1.261 . . . . 0.0 113.044 177.516 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 68.4 m-70 -73.51 -29.26 62.37 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 119.615 1.098 . . . . 0.0 112.689 177.452 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 39.5 tp -71.93 -42.42 66.7 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 121.144 -0.973 . . . . 0.0 111.402 170.654 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 21.7 t -57.64 -47.91 84.48 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 C-N-CA 124.285 1.034 . . . . 0.0 110.896 171.286 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -58.37 -47.56 83.42 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.542 1.537 . . . . 0.0 111.677 174.589 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.86 -43.68 98.14 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 118.671 0.669 . . . . 0.0 112.21 177.778 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 44.8 mt -61.04 -42.75 99.06 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 118.619 0.645 . . . . 0.0 111.454 176.384 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 16.8 m-85 -61.22 -45.28 95.22 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.046 0.839 . . . . 0.0 112.491 172.776 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 78.2 mt -68.06 -42.6 80.21 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.788 0.835 . . . . 0.0 112.966 -179.5 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 54.6 t -73.99 -44.69 50.44 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 124.524 1.13 . . . . 0.0 111.606 -178.079 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 65.9 m -99.71 -18.93 17.01 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 114.984 1.475 . . . . 0.0 114.984 -169.896 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 61.72 -133.07 47.11 Favored Glycine 0 CA--C 1.533 1.158 0 CA-C-N 118.973 0.806 . . . . 0.0 112.633 177.571 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 5.3 pm0 -66.93 -11.97 58.05 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.7 1.6 . . . . 0.0 115.223 -176.799 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 69.8 mtp180 -60.22 -38.01 82.05 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.859 0.863 . . . . 0.0 112.478 176.134 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.62 166.62 9.6 Favored Glycine 0 CA--C 1.536 1.362 0 C-N-CA 124.087 0.851 . . . . 0.0 112.364 -170.393 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 47.6 p90 -130.83 147.79 52.53 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.019 1.328 . . . . 0.0 112.98 -174.479 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 39.4 t80 -94.37 91.43 6.68 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 125.789 1.636 . . . . 0.0 109.457 172.424 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 15.9 t80 -71.36 127.81 33.82 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 121.718 -0.614 . . . . 0.0 111.597 -177.156 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' B' B ' 27' ' ' THR . . . . . 0.576 ' HG1' ' N ' ' A' ' 2' ' ' ILE . 3.9 p -136.83 108.02 9.06 Favored Pre-proline 0 N--CA 1.477 0.908 0 C-N-CA 124.974 1.31 . . . . 0.0 110.394 -172.934 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -81.87 170.96 13.51 Favored 'Trans proline' 0 C--N 1.355 0.881 0 C-N-CA 124.481 3.454 . . . . 0.0 113.654 -170.355 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 27.4 mtpp . . . . . 0 N--CA 1.478 0.937 0 C-N-CA 124.529 1.132 . . . . 0.0 113.917 176.064 . . . . . . . . 0 0 . 1 . 045 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 20.1 tt . . . . . 0 N--CA 1.483 1.219 0 N-CA-C 112.474 0.546 . . . . 0.0 112.474 . . . . . . . . . 0 0 . 1 . 045 nuclear build core ' A' A ' 3' ' ' VAL . . . . . 0.562 HG21 ' HA ' ' B' ' 28' ' ' PRO . 58.0 t -58.74 -44.92 91.18 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.058 0 C-N-CA 124.367 1.067 . . . . 0.0 110.408 -177.003 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.0 pm0 -66.63 -11.31 53.08 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.633 1.573 . . . . 0.0 113.819 177.671 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 26.3 mm100 -95.27 -53.11 3.9 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.457 1.103 . . . . 0.0 109.561 168.833 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 84.8 m -61.06 -34.91 75.64 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.939 1.296 . . . . 0.0 114.153 -174.749 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 72.7 m -72.79 -46.08 55.17 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 121.244 -0.91 . . . . 0.0 111.147 174.995 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 21.7 m -77.15 -32.33 56.23 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 126.723 2.009 . . . . 0.0 112.849 -170.442 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.4 t -150.91 -168.96 3.25 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 126.069 1.748 . . . . 0.0 110.865 -176.167 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 62.5 mt -79.45 136.08 24.35 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 O-C-N 120.681 -1.262 . . . . 0.0 110.322 175.658 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.6 p -127.28 160.69 30.56 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.311 1.044 . . . . 0.0 112.402 173.731 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 33.5 t -101.26 154.02 19.12 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 114.194 1.183 . . . . 0.0 114.194 -168.848 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 32.2 mt -62.21 -30.64 71.23 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.139 0.976 . . . . 0.0 111.702 174.121 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 87.5 t80 -61.6 -34.72 76.12 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 123.695 0.798 . . . . 0.0 112.716 171.985 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 58.8 mt-30 -72.1 -43.74 64.31 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.423 0.689 . . . . 0.0 109.797 176.363 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 95.3 mt -57.23 -49.45 76.0 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 122.979 0.512 . . . . 0.0 111.734 174.411 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -62.77 -28.35 69.92 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 113.243 0.831 . . . . 0.0 113.243 178.166 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -81.19 -38.94 26.24 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 124.221 1.008 . . . . 0.0 112.942 179.039 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 20.7 m-85 -84.58 -6.46 59.37 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 114.55 1.315 . . . . 0.0 114.55 179.64 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 39.4 t -70.72 174.38 6.05 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 124.45 1.1 . . . . 0.0 112.07 168.076 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 14.6 t-20 . . . . . 0 C--O 1.251 1.178 0 C-N-CA 125.304 1.442 . . . . 0.0 113.313 -176.645 . . . . . . . . 0 0 . 1 . 045 nuclear build core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 34.1 t80 . . . . . 0 N--CA 1.487 1.381 0 CA-C-O 119.884 -0.103 . . . . 0.0 111.017 . . . . . . . . . 0 0 . 1 . 045 nuclear build core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 19.1 t -79.37 -19.92 12.6 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.362 0 O-C-N 120.784 -1.198 . . . . 0.0 113.049 -169.75 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 24.2 t30 -60.92 94.85 0.03 OUTLIER 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 125.586 1.554 . . . . 0.0 111.424 174.955 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -153.03 -170.69 3.7 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 126.415 1.886 . . . . 0.0 110.516 -168.804 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 19.9 m-70 -75.3 146.26 41.14 Favored 'General case' 0 CA--C 1.546 0.814 0 O-C-N 120.846 -1.159 . . . . 0.0 109.54 167.442 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 61.2 mt -146.5 133.02 19.73 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 126.535 1.934 . . . . 0.0 109.201 174.874 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.1 t -145.46 150.47 36.56 Favored 'General case' 0 N--CA 1.468 0.438 0 O-C-N 121.189 -0.944 . . . . 0.0 113.013 179.928 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 57.04 -129.99 50.29 Favored Glycine 0 N--CA 1.469 0.884 0 C-N-CA 124.929 1.252 . . . . 0.0 113.864 172.4 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 17.4 p -54.72 -43.28 72.46 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 124.348 1.059 . . . . 0.0 112.409 175.566 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -65.48 -34.83 79.19 Favored 'General case' 0 CA--C 1.542 0.666 0 O-C-N 121.117 -0.989 . . . . 0.0 112.256 178.919 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 62.2 tp -67.34 -44.87 78.03 Favored 'General case' 0 C--O 1.222 -0.371 0 CA-C-O 118.033 -0.984 . . . . 0.0 111.259 171.203 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 54.3 t -62.24 -43.41 97.93 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.078 0 CA-C-N 119.643 1.111 . . . . 0.0 111.25 178.975 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.1 mm-40 -60.79 -51.28 70.01 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 123.689 0.795 . . . . 0.0 111.224 173.8 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.89 -43.44 92.9 Favored 'General case' 0 CA--C 1.534 0.339 0 O-C-N 121.551 -0.718 . . . . 0.0 111.934 -177.5 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 62.0 tp -55.25 -47.14 75.85 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 125.339 1.456 . . . . 0.0 111.184 177.697 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -72.69 -39.34 67.12 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 119.134 0.879 . . . . 0.0 112.365 177.996 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 74.9 mt -66.92 -41.21 87.44 Favored 'General case' 0 N--CA 1.474 0.754 0 CA-C-N 118.95 0.796 . . . . 0.0 112.816 179.845 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 54.7 t -68.39 -34.86 68.17 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 C-N-CA 124.992 1.317 . . . . 0.0 111.566 176.33 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 42.7 t -80.97 -34.07 33.38 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 114.261 1.208 . . . . 0.0 114.261 -179.15 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 86.03 -145.34 20.64 Favored Glycine 0 CA--C 1.533 1.182 0 C-N-CA 125.197 1.38 . . . . 0.0 113.42 179.786 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -59.27 -22.75 61.63 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 126.232 1.813 . . . . 0.0 114.593 -169.593 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 71.3 mtp180 -52.33 -38.33 58.36 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 125.419 1.487 . . . . 0.0 113.176 175.496 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.04 148.84 3.02 Favored Glycine 0 CA--C 1.533 1.186 0 C-N-CA 125.101 1.334 . . . . 0.0 112.263 -174.085 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 27.2 p90 -71.56 168.29 17.92 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 113.993 1.108 . . . . 0.0 113.993 -175.079 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 73.5 t80 -136.96 -60.34 0.69 Allowed 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.854 1.262 . . . . 0.0 111.96 -177.486 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 15.6 t80 -74.16 114.15 12.17 Favored 'General case' 0 CA--C 1.546 0.814 0 O-C-N 121.75 -0.594 . . . . 0.0 112.373 -172.672 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 23.3 p -78.29 155.43 79.37 Favored Pre-proline 0 N--CA 1.48 1.029 0 C-N-CA 125.85 1.66 . . . . 0.0 112.167 -178.686 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' B' B ' 28' ' ' PRO . . . . . 0.562 ' HA ' HG21 ' A' ' 3' ' ' VAL . 60.1 Cg_endo -73.27 108.04 2.52 Favored 'Trans proline' 0 C--N 1.352 0.723 0 C-N-CA 123.537 2.825 . . . . 0.0 111.47 -176.88 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt . . . . . 0 CA--C 1.541 0.629 0 N-CA-C 114.223 1.194 . . . . 0.0 114.223 -169.69 . . . . . . . . 0 0 . 1 . 046 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 11.3 tt . . . . . 0 N--CA 1.479 0.988 0 N-CA-C 113.042 0.756 . . . . 0.0 113.042 . . . . . . . . . 0 0 . 1 . 046 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 9.8 p -68.78 -28.12 38.58 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 O-C-N 121.64 -0.662 . . . . 0.0 111.827 -176.596 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 37.2 mp0 -68.75 -12.9 61.99 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 123.853 0.861 . . . . 0.0 113.045 173.018 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 5.5 tp60 -97.99 -58.35 2.0 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.022 0.929 . . . . 0.0 110.347 169.199 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 34.7 m -70.77 -27.13 63.69 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 114.675 1.361 . . . . 0.0 114.675 -170.095 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 10.6 t -81.28 -38.8 26.24 Favored 'General case' 0 N--CA 1.472 0.646 0 O-C-N 120.868 -1.145 . . . . 0.0 111.105 175.288 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 28.7 m -69.61 -38.99 77.49 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 126.881 2.072 . . . . 0.0 112.586 -177.614 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 21.5 m -143.52 166.41 24.88 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 124.711 1.205 . . . . 0.0 111.304 -178.035 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 70.0 mt -58.93 128.78 20.2 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 O-C-N 121.129 -0.982 . . . . 0.0 109.326 169.447 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 15.1 p -120.37 154.6 34.86 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 122.066 0.936 . . . . 0.0 112.29 175.926 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 47.4 t -98.01 153.85 18.1 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 124.497 1.119 . . . . 0.0 112.621 -174.103 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 10.7 mp -61.61 -26.94 68.3 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.861 0.864 . . . . 0.0 111.503 174.21 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 93.5 t80 -59.31 -37.92 78.95 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 123.574 0.75 . . . . 0.0 112.669 169.582 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 68.9 mt-30 -75.62 -39.81 57.3 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 124.155 0.982 . . . . 0.0 110.567 178.418 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 78.6 mt -58.68 -53.76 54.71 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.128 0.971 . . . . 0.0 111.201 172.702 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -66.13 -30.34 70.82 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 -179.98 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 20.1 t30 -66.15 -33.03 74.84 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 118.927 0.785 . . . . 0.0 112.326 172.678 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -73.96 -33.23 63.8 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.03 0.932 . . . . 0.0 112.652 172.856 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 87.5 m -71.17 177.15 3.97 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 125.451 1.5 . . . . 0.0 114.655 176.866 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 31.2 m120 . . . . . 0 C--O 1.256 1.431 0 C-N-CA 125.549 1.54 . . . . 0.0 112.021 170.44 . . . . . . . . 0 0 . 1 . 046 nuclear build core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 41.2 t80 . . . . . 0 N--CA 1.487 1.41 0 CA-C-O 119.549 -0.262 . . . . 0.0 111.044 . . . . . . . . . 0 0 . 1 . 046 nuclear build core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 27.4 m -75.32 -36.37 36.08 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.42 0 O-C-N 121.209 -0.932 . . . . 0.0 113.366 -174.785 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -84.02 104.63 14.24 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.673 1.189 . . . . 0.0 108.022 169.268 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -169.73 -177.11 2.58 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.712 1.205 . . . . 0.0 110.336 -167.905 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 26.2 m-70 -71.83 136.74 47.14 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 164.472 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 84.4 mt -138.84 128.83 25.21 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 126.142 1.777 . . . . 0.0 109.176 -179.831 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.3 t -141.48 133.67 27.89 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 112.77 0.656 . . . . 0.0 112.77 -171.407 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 60.05 -126.88 42.81 Favored Glycine 0 CA--C 1.528 0.845 0 C-N-CA 124.361 0.982 . . . . 0.0 113.241 175.059 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 18.8 m -55.21 -32.81 62.53 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.281 1.032 . . . . 0.0 113.069 177.769 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 32.4 m80 -68.46 -39.0 81.58 Favored 'General case' 0 CA--C 1.542 0.662 0 O-C-N 121.043 -1.036 . . . . 0.0 111.732 177.465 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 32.1 tp -71.38 -41.26 69.87 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 124.255 1.022 . . . . 0.0 111.086 175.618 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 64.5 t -60.74 -43.29 94.86 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 123.597 0.759 . . . . 0.0 110.953 173.004 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -64.66 -41.77 95.86 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 123.643 0.777 . . . . 0.0 111.922 174.305 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.37 -45.26 94.14 Favored 'General case' 0 CA--C 1.535 0.399 0 O-C-N 121.568 -0.708 . . . . 0.0 111.483 174.396 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 51.6 mt -58.69 -44.1 90.19 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 123.627 0.771 . . . . 0.0 111.838 174.893 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 4.6 m-85 -56.01 -50.77 69.96 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.514 0.726 . . . . 0.0 112.126 172.593 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 8.4 mp -71.03 -42.23 69.79 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 123.522 0.729 . . . . 0.0 112.649 -176.573 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 69.2 t -76.02 -40.19 37.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 C-N-CA 124.624 1.17 . . . . 0.0 111.886 -174.224 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 58.5 m -95.61 -18.21 20.74 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 113.697 0.999 . . . . 0.0 113.697 -174.828 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 62.45 -140.32 46.19 Favored Glycine 0 CA--C 1.532 1.136 0 C-N-CA 124.761 1.172 . . . . 0.0 114.073 168.928 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -68.22 -13.95 62.62 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 124.951 1.3 . . . . 0.0 114.153 -174.111 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 57.0 mtm-85 -67.68 -26.08 66.01 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 123.867 0.867 . . . . 0.0 112.663 176.662 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.2 168.38 44.21 Favored Glycine 0 CA--C 1.531 1.051 0 C-N-CA 125.059 1.314 . . . . 0.0 112.908 -171.458 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 39.9 p90 -135.02 170.6 15.66 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.267 1.427 . . . . 0.0 112.437 -179.199 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 65.6 t80 -129.52 148.87 51.46 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.344 1.458 . . . . 0.0 110.169 172.021 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 63.2 t80 -156.8 125.21 5.7 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.743 1.217 . . . . 0.0 110.956 -174.437 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 50.3 m -152.17 124.41 3.92 Favored Pre-proline 0 N--CA 1.474 0.753 0 C-N-CA 124.869 1.268 . . . . 0.0 109.782 177.534 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -84.39 161.44 12.97 Favored 'Trans proline' 0 CA--C 1.536 0.618 0 C-N-CA 123.937 3.091 . . . . 0.0 111.056 169.401 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 58.2 tptt . . . . . 0 CA--C 1.546 0.794 0 C-N-CA 124.308 1.043 . . . . 0.0 113.245 177.522 . . . . . . . . 0 0 . 1 . 047 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 19.4 tt . . . . . 0 N--CA 1.479 0.995 0 N-CA-C 112.756 0.651 . . . . 0.0 112.756 . . . . . . . . . 0 0 . 1 . 047 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 13.4 p -63.07 -31.91 54.31 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.129 0 CA-C-N 119.156 0.889 . . . . 0.0 112.523 -176.177 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 6.0 pm0 -72.46 -5.09 34.29 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.854 1.261 . . . . 0.0 113.618 175.768 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 47.2 tp60 -107.82 -52.83 2.71 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.257 1.423 . . . . 0.0 109.211 168.183 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 95.3 m -59.59 -35.1 73.63 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 114.238 1.199 . . . . 0.0 114.238 -175.423 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 19.0 t -82.74 -33.11 27.56 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 113.14 0.793 . . . . 0.0 113.14 -172.689 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 27.5 p -100.48 -26.85 13.71 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 126.388 1.875 . . . . 0.0 112.875 -175.701 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.7 t -138.98 -160.74 1.1 Allowed 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 126.114 1.766 . . . . 0.0 110.137 179.632 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 72.1 mt -97.81 140.03 18.8 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.71 0 O-C-N 120.546 -1.347 . . . . 0.0 110.109 -177.535 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 15.1 p -134.51 161.85 33.91 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 124.595 1.158 . . . . 0.0 112.66 173.983 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 60.1 p -109.16 165.64 11.45 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 115.174 1.546 . . . . 0.0 115.174 -170.647 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 11.0 mp -65.3 -30.25 71.09 Favored 'General case' 0 N--CA 1.47 0.549 0 O-C-N 121.454 -0.779 . . . . 0.0 111.726 171.831 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 80.1 t80 -63.63 -31.73 72.99 Favored 'General case' 0 CA--C 1.543 0.698 0 O-C-N 121.462 -0.774 . . . . 0.0 112.717 172.54 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 84.9 mt-30 -75.4 -36.34 60.86 Favored 'General case' 0 CA--C 1.537 0.46 0 O-C-N 121.483 -0.761 . . . . 0.0 111.495 172.593 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 86.7 mt -62.11 -42.11 98.9 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 119.374 0.988 . . . . 0.0 111.866 171.778 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -58.61 -27.11 64.37 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.748 1.219 . . . . 0.0 113.807 176.856 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.8 t30 -59.24 -28.01 66.3 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-N 119.125 0.875 . . . . 0.0 113.27 179.155 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 82.2 m-85 -100.55 6.98 44.33 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.508 1.523 . . . . 0.0 113.959 -178.522 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 54.2 m -89.39 153.42 20.86 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.194 0.998 . . . . 0.0 112.573 172.814 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.254 1.313 0 C-N-CA 126.589 1.956 . . . . 0.0 112.349 178.679 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . 0.263 12.0 p90 . . . . . 0 N--CA 1.486 1.352 0 CA-C-O 118.45 -0.786 . . . . 0.0 110.591 . . . . . . . . . 1 1 . 1 . 047 nuclear build core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 73.1 t -82.36 142.58 13.45 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.287 0 CA-C-N 120.203 1.365 . . . . 0.0 110.079 171.541 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -158.14 147.5 19.57 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 126.039 1.736 . . . . 0.0 112.551 177.57 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -162.54 170.62 18.32 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.825 1.25 . . . . 0.0 111.644 -170.304 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 96.6 m-70 -80.01 139.3 37.04 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 108.334 -0.988 . . . . 0.0 108.334 165.389 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 83.1 mt -148.76 133.81 18.19 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 125.24 1.416 . . . . 0.0 110.367 -179.581 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.6 t -152.36 147.64 26.54 Favored 'General case' 0 N--CA 1.473 0.693 0 O-C-N 121.112 -0.993 . . . . 0.0 113.078 178.183 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 57.88 -129.97 50.32 Favored Glycine 0 CA--C 1.528 0.861 0 C-N-CA 124.517 1.056 . . . . 0.0 112.79 176.174 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.4 m -54.29 -32.36 56.18 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 124.784 1.233 . . . . 0.0 113.335 177.46 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 24.0 m80 -70.81 -41.06 72.09 Favored 'General case' 0 CA--C 1.539 0.52 0 O-C-N 121.33 -0.857 . . . . 0.0 111.628 178.24 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 52.2 tp -67.84 -44.84 76.25 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 123.796 0.839 . . . . 0.0 110.52 174.395 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 25.6 t -56.37 -44.94 81.29 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.99 0 C-N-CA 124.499 1.12 . . . . 0.0 111.22 173.804 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -63.99 -41.77 97.41 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.174 0.59 . . . . 0.0 111.903 174.376 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.34 -41.0 98.21 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 118.881 0.764 . . . . 0.0 112.495 176.05 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -60.6 -46.26 90.93 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 119.234 0.925 . . . . 0.0 111.047 171.084 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 21.5 m-85 -61.81 -34.86 76.68 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 119.978 1.263 . . . . 0.0 113.137 176.117 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 71.9 mt -70.71 -43.99 67.84 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 123.783 0.833 . . . . 0.0 112.195 175.359 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 72.0 t -75.86 -40.9 39.31 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 CA-C-N 118.634 0.652 . . . . 0.0 112.021 -178.057 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 50.8 m -85.2 -23.31 28.35 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 114.011 1.115 . . . . 0.0 114.011 -179.104 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 79.53 -162.47 47.47 Favored Glycine 0 CA--C 1.53 0.999 0 C-N-CA 124.85 1.214 . . . . 0.0 112.673 -173.801 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -61.98 -11.84 15.44 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 125.053 1.341 . . . . 0.0 114.513 -178.58 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 87.9 mtm180 -60.02 -27.54 66.99 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 125.04 1.336 . . . . 0.0 113.537 173.786 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.05 -167.01 54.2 Favored Glycine 0 CA--C 1.533 1.182 0 C-N-CA 124.224 0.916 . . . . 0.0 112.05 -169.727 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 22.9 p90 -138.94 157.65 45.64 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.713 1.205 . . . . 0.0 113.969 -169.871 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 59.4 t80 -87.66 -14.46 39.91 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 126.265 1.826 . . . . 0.0 113.098 174.029 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 18.4 t80 -54.2 143.97 21.31 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 125.285 1.434 . . . . 0.0 113.562 178.27 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 15.3 t -153.89 141.21 13.46 Favored Pre-proline 0 CA--C 1.541 0.632 0 C-N-CA 127.382 2.273 . . . . 0.0 108.335 172.717 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -68.65 152.95 74.27 Favored 'Trans proline' 0 C--N 1.35 0.631 0 C-N-CA 122.637 2.225 . . . . 0.0 112.708 -171.923 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.549 0.942 0 N-CA-C 114.691 1.367 . . . . 0.0 114.691 -174.432 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 11.0 tp . . . . . 0 N--CA 1.485 1.297 0 N-CA-C 114.031 1.123 . . . . 0.0 114.031 . . . . . . . . . 0 0 . 1 . 048 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 70.3 t -57.53 -52.87 51.73 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.331 0 C-N-CA 124.622 1.169 . . . . 0.0 110.096 -177.876 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 25.6 pt-20 -66.55 0.76 2.05 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 125.468 1.507 . . . . 0.0 114.968 -179.098 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 17.9 tt0 -115.9 -50.81 2.67 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 119.097 0.862 . . . . 0.0 111.365 168.725 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 58.8 m -60.97 -28.41 68.98 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 114.283 1.216 . . . . 0.0 114.283 -177.565 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 87.8 m -73.1 -31.02 64.08 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 179.331 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 29.4 p -112.05 -44.83 3.37 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 125.579 1.552 . . . . 0.0 112.527 -169.055 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 63.2 m -101.99 168.15 9.59 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 125.908 1.683 . . . . 0.0 111.054 172.854 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 7.0 tt -81.57 132.31 31.82 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 O-C-N 120.822 -1.174 . . . . 0.0 109.151 170.865 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 17.0 p -121.61 158.65 28.14 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.447 1.099 . . . . 0.0 112.441 -176.133 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 34.1 t -98.08 151.93 19.85 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 124.322 1.049 . . . . 0.0 112.763 -173.923 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 39.8 mt -59.68 -29.7 68.26 Favored 'General case' 0 N--CA 1.471 0.585 0 O-C-N 121.632 -0.668 . . . . 0.0 111.46 171.597 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.6 t80 -62.23 -32.36 73.02 Favored 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 113.147 0.795 . . . . 0.0 113.147 172.231 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 64.9 mt-30 -78.08 -34.0 50.48 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 123.617 0.767 . . . . 0.0 111.084 175.558 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 81.5 mt -60.38 -47.88 84.17 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 118.639 0.654 . . . . 0.0 110.753 169.876 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -62.0 -32.32 72.78 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 175.191 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 15.5 t30 -59.23 -33.01 70.49 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 119.464 1.029 . . . . 0.0 113.03 179.446 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 67.6 m-85 -92.99 -0.63 57.16 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.708 1.203 . . . . 0.0 113.925 177.283 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 92.9 m -82.9 154.25 24.69 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 121.249 -0.907 . . . . 0.0 112.907 173.131 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.25 1.082 0 C-N-CA 125.819 1.648 . . . . 0.0 112.908 -176.646 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 65.8 m-85 . . . . . 0 N--CA 1.488 1.447 0 CA-C-O 118.617 -0.706 . . . . 0.0 109.403 . . . . . . . . . 0 0 . 1 . 048 nuclear build core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 5.9 m -82.58 83.81 1.69 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 CA-C-N 120.149 1.34 . . . . 0.0 110.079 175.127 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 27.9 m120 -124.88 140.71 52.68 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.092 1.357 . . . . 0.0 112.462 -170.869 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -148.06 160.78 42.51 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.45 1.5 . . . . 0.0 111.99 -178.804 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 90.7 m-70 -99.49 130.05 45.71 Favored 'General case' 0 CA--C 1.543 0.673 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 166.506 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 54.3 mt -148.16 136.54 21.41 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 124.89 1.276 . . . . 0.0 110.077 -171.682 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.3 t -147.34 150.8 35.45 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 113.035 0.754 . . . . 0.0 113.035 -178.376 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 53.55 -130.4 42.14 Favored Glycine 0 N--CA 1.469 0.853 0 C-N-CA 124.523 1.059 . . . . 0.0 113.181 173.167 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 39.0 m -59.11 -34.14 71.68 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 123.556 0.742 . . . . 0.0 112.931 -179.365 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 18.1 m-70 -70.41 -32.17 69.69 Favored 'General case' 0 CA--C 1.538 0.483 0 O-C-N 120.621 -1.299 . . . . 0.0 113.172 175.446 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 42.9 tp -69.6 -40.07 76.88 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 118.688 0.676 . . . . 0.0 111.24 171.16 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 78.5 t -60.83 -45.8 97.38 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.078 0 C-N-CA 123.947 0.899 . . . . 0.0 110.911 172.739 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -58.42 -48.17 81.55 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 123.558 0.743 . . . . 0.0 111.4 172.757 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.7 -41.81 99.32 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 123.631 0.772 . . . . 0.0 112.229 -178.655 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 31.0 mt -58.45 -43.97 89.02 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 118.558 0.617 . . . . 0.0 111.412 174.929 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 9.4 m-85 -70.88 -31.9 68.71 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 113.764 1.024 . . . . 0.0 113.764 174.898 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 64.4 mt -71.62 -41.41 68.89 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 119.382 0.992 . . . . 0.0 112.017 175.478 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 54.5 t -73.15 -47.8 45.9 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 C-N-CA 124.527 1.131 . . . . 0.0 111.501 179.97 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 66.8 m -94.73 -10.58 31.19 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 114.815 1.413 . . . . 0.0 114.815 -172.996 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 82.03 -164.53 44.48 Favored Glycine 0 CA--C 1.53 1.001 0 C-N-CA 124.867 1.222 . . . . 0.0 112.836 -177.372 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -61.68 -11.32 11.31 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 114.801 1.408 . . . . 0.0 114.801 -178.601 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 53.6 mtm180 -56.34 -33.49 65.69 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 125.056 1.342 . . . . 0.0 112.878 171.811 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 66.04 -154.51 51.3 Favored Glycine 0 CA--C 1.535 1.299 0 C-N-CA 123.692 0.663 . . . . 0.0 112.07 -172.422 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 54.5 p90 -141.69 155.41 45.67 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.802 1.241 . . . . 0.0 113.276 -172.159 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 75.1 t80 -87.47 -28.53 22.01 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.831 1.252 . . . . 0.0 113.185 -172.939 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 50.7 t80 -62.36 149.45 42.31 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.808 1.243 . . . . 0.0 113.14 179.841 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 13.5 t -111.61 126.12 29.14 Favored Pre-proline 0 N--CA 1.474 0.727 0 C-N-CA 124.216 1.007 . . . . 0.0 109.363 171.359 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -75.47 138.52 22.03 Favored 'Trans proline' 0 N--CA 1.455 -0.753 0 C-N-CA 122.674 2.249 . . . . 0.0 111.31 -171.118 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 18.9 ptmt . . . . . 0 CA--C 1.547 0.856 0 N-CA-C 113.362 0.875 . . . . 0.0 113.362 176.009 . . . . . . . . 0 0 . 1 . 049 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 20.7 tt . . . . . 0 N--CA 1.482 1.13 0 N-CA-C 114.783 1.401 . . . . 0.0 114.783 . . . . . . . . . 0 0 . 1 . 049 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 74.1 t -59.94 -40.86 84.15 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.028 0 C-N-CA 123.253 0.621 . . . . 0.0 111.166 -175.638 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -81.86 -2.75 52.16 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 113.149 0.796 . . . . 0.0 113.149 -179.509 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 20.8 tt0 -94.55 -58.72 2.11 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 123.56 0.744 . . . . 0.0 109.706 169.351 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 85.8 m -72.19 -30.37 64.9 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 113.962 1.097 . . . . 0.0 113.962 -170.054 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 71.2 m -69.93 -46.45 65.31 Favored 'General case' 0 N--CA 1.473 0.701 0 O-C-N 120.752 -1.218 . . . . 0.0 110.706 173.371 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 21.0 m -76.86 -37.95 54.62 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 126.756 2.023 . . . . 0.0 112.871 -170.084 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.7 t -144.19 -169.19 3.06 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.963 1.305 . . . . 0.0 111.77 -174.897 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 61.2 mt -79.91 127.27 39.37 Favored 'Isoleucine or valine' 0 C--O 1.238 0.448 0 O-C-N 120.818 -1.176 . . . . 0.0 111.707 -172.719 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 4.2 m -112.5 171.33 7.58 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 127.013 2.125 . . . . 0.0 110.832 168.166 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 35.4 t -163.34 163.26 25.22 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 126.422 1.889 . . . . 0.0 108.21 -170.715 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 9.8 mp -56.98 -33.71 67.35 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 119.231 0.923 . . . . 0.0 111.976 -176.092 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 73.2 t80 -61.11 -33.09 72.82 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 124.294 1.038 . . . . 0.0 113.572 173.4 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 36.9 mt-30 -86.8 -32.25 20.44 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 125.196 1.398 . . . . 0.0 111.333 177.682 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 96.1 mt -65.46 -50.56 64.88 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.624 1.17 . . . . 0.0 110.679 173.567 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -66.48 -23.23 66.23 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 113.35 0.87 . . . . 0.0 113.35 179.416 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 19.4 t30 -59.93 -29.74 68.59 Favored 'General case' 0 CA--C 1.545 0.788 0 O-C-N 121.118 -0.989 . . . . 0.0 113.031 177.427 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 51.9 m-85 -94.47 5.5 51.62 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.565 1.546 . . . . 0.0 113.717 176.946 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 75.0 m -101.09 129.1 46.92 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.016 0.927 . . . . 0.0 112.7 -179.646 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.252 1.211 0 C-N-CA 128.086 2.554 . . . . 0.0 112.393 -169.495 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 . . . . . 0 N--CA 1.486 1.338 0 CA-C-O 119.75 -0.167 . . . . 0.0 111.109 . . . . . . . . . 0 0 . 1 . 049 nuclear build core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 88.1 t -78.01 141.12 15.94 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.207 0 C-N-CA 124.721 1.208 . . . . 0.0 109.583 172.437 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 5.8 p-10 -134.0 158.36 43.71 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 124.919 1.288 . . . . 0.0 113.614 -174.427 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 2.6 mm-40 -176.2 -172.7 0.5 Allowed 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 127.417 2.287 . . . . 0.0 108.779 -173.052 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 5.9 m-70 -83.44 -105.37 0.04 OUTLIER 'General case' 0 CA--C 1.549 0.923 0 O-C-N 120.457 -1.402 . . . . 0.0 107.912 166.497 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 57.2 mt 113.17 124.48 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.946 1 C-N-CA 131.879 4.072 . . . . 0.0 109.425 171.478 . . . . . . . . 2 2 . 1 . 049 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 5.8 t -146.31 154.12 41.32 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.194 0.598 . . . . 0.0 112.431 -175.285 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 59.58 -136.29 50.58 Favored Glycine 0 N--CA 1.471 0.99 0 C-N-CA 123.801 0.715 . . . . 0.0 113.278 172.557 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 14.4 p -54.08 -36.99 63.75 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 124.541 1.136 . . . . 0.0 112.988 173.49 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 -69.67 -33.28 72.34 Favored 'General case' 0 CA--C 1.544 0.731 0 O-C-N 121.139 -0.975 . . . . 0.0 112.384 -179.751 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 53.7 tp -68.88 -42.48 76.92 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 118.562 0.619 . . . . 0.0 110.945 171.197 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 60.3 t -59.15 -46.77 91.79 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 C-N-CA 124.053 0.941 . . . . 0.0 111.064 174.488 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -65.69 -41.54 92.29 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 123.703 0.801 . . . . 0.0 112.137 176.679 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.75 -43.74 97.59 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 119.279 0.945 . . . . 0.0 111.529 174.823 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 62.5 mt -64.25 -40.22 95.55 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 118.299 0.499 . . . . 0.0 112.155 177.035 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 7.2 m-85 -58.14 -47.88 81.98 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.107 0.867 . . . . 0.0 111.86 170.744 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 78.5 mt -69.8 -41.63 74.78 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 124.146 0.979 . . . . 0.0 112.661 -177.156 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 60.6 t -76.82 -44.1 32.92 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 C-N-CA 123.754 0.822 . . . . 0.0 111.892 -177.268 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 73.7 m -95.9 -27.56 15.11 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 114.73 1.381 . . . . 0.0 114.73 -172.654 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 66.16 -134.76 34.14 Favored Glycine 0 N--CA 1.469 0.866 0 C-N-CA 124.216 0.913 . . . . 0.0 112.676 176.318 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -63.96 -17.92 63.76 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.248 1.419 . . . . 0.0 113.636 -177.847 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 84.9 mtm180 -61.66 -29.25 69.95 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 179.286 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.59 157.98 9.66 Favored Glycine 0 CA--C 1.534 1.234 0 C-N-CA 124.662 1.125 . . . . 0.0 113.144 -177.862 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 51.6 p90 -137.37 152.55 49.8 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.246 1.418 . . . . 0.0 113.334 -172.078 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 24.7 t80 -105.69 68.94 0.81 Allowed 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.748 1.619 . . . . 0.0 111.282 -179.749 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 50.5 t80 -67.34 117.71 9.7 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.469 1.108 . . . . 0.0 110.975 173.331 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 6.9 t -173.96 151.07 1.72 Allowed Pre-proline 0 N--CA 1.48 1.049 0 C-N-CA 125.637 1.575 . . . . 0.0 112.75 -175.656 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -89.5 -174.39 0.9 Allowed 'Trans proline' 0 CA--C 1.547 1.173 0 C-N-CA 124.493 3.462 . . . . 0.0 109.565 166.661 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 32.1 mtmm . . . . . 0 N--CA 1.481 1.075 0 O-C-N 120.282 -1.511 . . . . 0.0 112.43 170.007 . . . . . . . . 0 0 . 1 . 050 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 8.1 tp . . . . . 0 N--CA 1.477 0.917 0 N-CA-C 114.243 1.201 . . . . 0.0 114.243 . . . . . . . . . 0 0 . 1 . 050 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 40.1 t -65.22 -47.35 87.77 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 CA-C-N 118.452 0.569 . . . . 0.0 110.845 -179.14 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -64.34 -41.0 97.0 Favored 'General case' 0 CA--C 1.539 0.542 0 O-C-N 121.449 -0.782 . . . . 0.0 111.591 174.098 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 34.6 mt-30 -66.09 -35.74 81.31 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 118.374 -0.822 . . . . 0.0 112.955 -177.472 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 99.7 m -93.4 -31.18 14.73 Favored 'General case' 0 N--CA 1.47 0.525 0 N-CA-C 114.63 1.344 . . . . 0.0 114.63 179.281 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 78.2 m -86.76 -52.75 5.32 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 119.457 1.026 . . . . 0.0 111.602 -177.004 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 27.3 m -83.07 -40.8 19.4 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.731 1.212 . . . . 0.0 110.578 -174.067 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 7.9 t -112.5 -171.85 1.94 Allowed 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.398 1.079 . . . . 0.0 112.039 170.827 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 90.4 mt -96.24 128.68 47.22 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 C-N-CA 126.029 1.732 . . . . 0.0 108.522 175.596 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 21.1 p -107.9 -157.96 0.63 Allowed 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.987 0.915 . . . . 0.0 112.1 178.025 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 92.8 p -155.1 164.53 38.73 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 125.776 1.63 . . . . 0.0 111.387 -179.153 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 44.9 mt -62.01 -33.32 74.13 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 122.957 0.503 . . . . 0.0 111.601 174.381 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 93.2 t80 -63.29 -36.93 85.3 Favored 'General case' 0 CA--C 1.539 0.551 0 O-C-N 121.532 -0.73 . . . . 0.0 112.727 171.409 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -71.86 -34.58 69.34 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 118.757 -0.64 . . . . 0.0 111.739 174.687 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 95.5 mt -59.29 -49.57 77.32 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 119.503 1.047 . . . . 0.0 110.703 169.829 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -61.88 -34.37 75.91 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 113.562 0.949 . . . . 0.0 113.562 176.316 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 15.3 t30 -61.78 -27.78 68.99 Favored 'General case' 0 CA--C 1.546 0.821 0 O-C-N 121.129 -0.982 . . . . 0.0 112.79 177.92 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 66.3 m-85 -104.7 29.34 6.27 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.78 1.632 . . . . 0.0 112.814 176.008 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 93.7 m -125.59 172.97 9.3 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 126.681 1.992 . . . . 0.0 112.635 168.869 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 . . . . . 0 C--O 1.251 1.137 0 C-N-CA 124.551 1.141 . . . . 0.0 112.407 175.97 . . . . . . . . 0 0 . 1 . 050 nuclear build core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 66.3 m-85 . . . . . 0 N--CA 1.488 1.46 0 CA-C-O 118.896 -0.573 . . . . 0.0 109.999 . . . . . . . . . 0 0 . 1 . 050 nuclear build core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 9.1 p -62.28 -28.89 45.45 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.345 0 CA-C-N 120.145 1.338 . . . . 0.0 112.435 174.439 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 28.9 m120 -92.46 144.67 25.13 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.068 1.347 . . . . 0.0 111.94 171.54 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -175.22 167.77 3.4 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 125.699 1.599 . . . . 0.0 111.723 178.326 . . . . . . . . 2 2 . 1 . 050 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 83.8 m-70 -87.51 143.15 27.36 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 124.628 1.171 . . . . 0.0 108.967 166.049 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 73.9 mt -146.63 138.07 24.4 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 125.636 1.574 . . . . 0.0 109.346 174.825 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 1.8 t -150.09 157.6 43.3 Favored 'General case' 0 N--CA 1.469 0.491 0 O-C-N 121.291 -0.881 . . . . 0.0 113.214 176.337 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.99 -136.44 48.07 Favored Glycine 0 CA--C 1.531 1.037 0 C-N-CA 124.741 1.163 . . . . 0.0 113.388 175.038 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 21.0 m -53.58 -37.4 62.92 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.99 0.916 . . . . 0.0 112.69 177.049 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -69.7 -36.13 75.68 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 120.793 -1.192 . . . . 0.0 112.104 179.401 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 65.6 tp -64.59 -47.16 79.71 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 118.684 0.675 . . . . 0.0 110.721 170.579 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 59.0 t -61.78 -44.3 98.57 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 C-N-CA 123.91 0.884 . . . . 0.0 110.942 -179.221 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -64.12 -45.67 87.54 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 118.589 0.631 . . . . 0.0 112.18 174.408 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.94 -44.87 94.89 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 119.39 0.995 . . . . 0.0 111.747 178.388 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 28.0 tp -58.07 -47.01 84.46 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.009 1.324 . . . . 0.0 110.885 177.089 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 8.2 m-30 -63.54 -43.43 97.1 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 123.6 0.76 . . . . 0.0 112.312 176.721 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 73.9 mt -67.95 -39.37 83.41 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 123.719 0.807 . . . . 0.0 112.446 179.029 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 40.8 t -70.15 -45.94 74.13 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 123.972 0.909 . . . . 0.0 111.868 177.897 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 68.8 m -88.93 -21.64 23.48 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 114.831 1.419 . . . . 0.0 114.831 -172.343 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.24 -141.2 45.89 Favored Glycine 0 CA--C 1.53 0.97 0 C-N-CA 124.504 1.05 . . . . 0.0 113.646 170.981 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -66.11 -19.93 66.0 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.083 1.353 . . . . 0.0 113.588 -175.462 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 78.0 mtp85 -62.24 -33.71 75.11 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.827 0.851 . . . . 0.0 112.897 178.068 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.46 161.54 37.31 Favored Glycine 0 CA--C 1.534 1.259 0 C-N-CA 124.685 1.136 . . . . 0.0 113.734 -178.227 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 55.0 p90 -97.52 165.79 11.82 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.881 1.673 . . . . 0.0 112.899 -176.558 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 46.3 t80 -115.94 -36.94 3.99 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 124.82 1.248 . . . . 0.0 111.314 168.74 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 81.0 t80 52.74 98.27 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 127.45 2.3 . . . . 0.0 115.163 169.587 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 92.3 m -111.65 111.17 54.63 Favored Pre-proline 0 N--CA 1.477 0.88 0 C-N-CA 123.953 0.901 . . . . 0.0 110.836 -176.871 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -82.14 -153.21 0.04 OUTLIER 'Trans proline' 0 CA--C 1.539 0.743 0 C-N-CA 124.729 3.619 . . . . 0.0 110.391 169.89 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt . . . . . 0 CA--C 1.549 0.941 0 C-N-CA 124.537 1.135 . . . . 0.0 113.583 170.904 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.592 0 N-CA-C 112.154 -0.378 . . . . 0.0 112.154 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 13.8 tt -59.87 -20.3 19.15 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.188 0 N-CA-C 115.476 1.658 . . . . 0.0 115.476 -169.693 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 18.2 t -52.14 -41.76 33.88 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 C-N-CA 124.224 1.009 . . . . 0.0 110.647 169.036 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 -70.74 -5.24 28.45 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 179.617 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 52.6 tt0 -104.3 -63.08 1.24 Allowed 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.007 0.923 . . . . 0.0 108.938 168.014 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 68.7 m -59.1 -33.51 70.92 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 113.674 0.99 . . . . 0.0 113.674 -170.15 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 13.6 t -77.75 -26.92 50.23 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 113.371 0.878 . . . . 0.0 113.371 -172.358 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 28.5 p -116.2 -35.05 4.47 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 125.718 1.607 . . . . 0.0 112.962 -175.611 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 9.0 t -113.95 -169.04 1.44 Allowed 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 126.449 1.9 . . . . 0.0 110.601 174.932 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 33.8 mm -92.39 145.55 7.45 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 C-N-CA 125.021 1.328 . . . . 0.0 110.456 179.543 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 15.6 p -141.64 176.84 8.58 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.776 1.23 . . . . 0.0 111.234 169.241 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 91.2 p -153.1 164.0 38.82 Favored 'General case' 0 N--CA 1.47 0.549 0 O-C-N 121.075 -1.016 . . . . 0.0 112.918 -169.661 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 21.5 mt -57.18 -37.13 71.68 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 123.945 0.898 . . . . 0.0 112.599 -173.661 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 87.2 t80 -62.05 -28.37 69.55 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.144 0.978 . . . . 0.0 113.475 175.381 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 46.8 mt-30 -87.5 -29.8 21.09 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.398 1.079 . . . . 0.0 111.04 176.141 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 72.5 mt -67.1 -38.17 85.2 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.969 0.908 . . . . 0.0 112.325 170.536 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -52.82 -31.59 39.71 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.743 1.217 . . . . 0.0 113.392 174.297 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -62.97 -19.32 64.19 Favored 'General case' 0 CA--C 1.548 0.886 0 N-CA-C 113.653 0.983 . . . . 0.0 113.653 178.894 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 95.4 m-85 -107.57 2.94 24.39 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.747 1.619 . . . . 0.0 113.937 -178.184 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 98.7 m -72.0 141.66 49.35 Favored 'General case' 0 CA--C 1.537 0.461 0 O-C-N 121.148 -0.97 . . . . 0.0 113.005 177.029 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 34.5 t30 . . . . . 0 C--O 1.252 1.208 0 C-N-CA 125.458 1.503 . . . . 0.0 111.327 171.566 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 37.9 t80 . . . . . 0 N--CA 1.49 1.573 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 24.3 t 79.27 -51.33 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 C-N-CA 128.404 2.682 . . . . 0.0 112.645 175.0 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -141.3 111.21 6.61 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 126.738 2.015 . . . . 0.0 107.896 175.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -170.86 174.73 4.73 Favored 'General case' 0 CA--C 1.543 0.695 0 O-C-N 121.496 -0.753 . . . . 0.0 111.949 -166.043 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 94.4 m-70 -81.41 142.2 33.2 Favored 'General case' 0 CA--C 1.55 0.968 0 N-CA-C 107.283 -1.377 . . . . 0.0 107.283 163.767 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 87.4 mt -145.09 135.98 24.66 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 125.819 1.648 . . . . 0.0 110.495 178.327 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.5 t -149.66 145.48 26.75 Favored 'General case' 0 N--CA 1.471 0.608 0 O-C-N 120.865 -1.147 . . . . 0.0 113.235 178.422 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 59.95 -126.68 42.38 Favored Glycine 0 CA--C 1.528 0.862 0 C-N-CA 124.49 1.043 . . . . 0.0 112.77 176.492 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 20.3 p -52.34 -40.79 62.38 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 124.884 1.274 . . . . 0.0 113.021 176.193 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 27.6 m80 -62.93 -42.27 99.75 Favored 'General case' 0 CA--C 1.543 0.687 0 O-C-N 121.206 -0.934 . . . . 0.0 111.66 178.855 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 48.6 tp -69.03 -41.36 77.81 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 124.085 0.954 . . . . 0.0 111.376 176.654 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 37.8 t -62.15 -44.71 99.38 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 C-N-CA 124.513 1.125 . . . . 0.0 111.267 175.407 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -66.59 -40.07 88.73 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 118.426 0.557 . . . . 0.0 111.977 175.262 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.48 -41.82 99.06 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 119.55 1.068 . . . . 0.0 111.938 174.958 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 43.2 mt -59.05 -47.17 86.22 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-O 118.818 -0.611 . . . . 0.0 111.046 171.754 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 24.2 m-85 -62.93 -33.89 76.29 Favored 'General case' 0 CA--C 1.545 0.762 0 CA-C-N 120.01 1.277 . . . . 0.0 113.711 175.359 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 70.2 mt -67.24 -42.44 83.96 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 119.395 0.998 . . . . 0.0 112.054 173.051 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 55.5 t -73.52 -46.67 47.95 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 C-N-CA 123.793 0.837 . . . . 0.0 112.097 -179.462 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 33.6 m -85.37 -18.56 33.39 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 113.758 1.022 . . . . 0.0 113.758 -174.064 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 70.55 -155.22 52.88 Favored Glycine 0 CA--C 1.531 1.067 0 C-N-CA 124.709 1.147 . . . . 0.0 112.434 -174.521 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -61.72 -21.12 64.23 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.072 1.349 . . . . 0.0 113.275 -178.733 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 76.9 mtp85 -62.7 -28.18 69.77 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.22 1.008 . . . . 0.0 113.297 175.051 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.86 -166.48 53.27 Favored Glycine 0 CA--C 1.533 1.193 0 C-N-CA 124.942 1.258 . . . . 0.0 113.801 -178.975 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 44.1 p90 -121.63 148.42 44.58 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 126.025 1.73 . . . . 0.0 111.411 -179.058 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 27.4 p90 -85.83 -13.75 47.11 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 113.299 0.851 . . . . 0.0 113.299 175.862 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 71.8 t80 -63.98 154.41 34.2 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 126.081 1.752 . . . . 0.0 114.39 -177.622 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 26.3 p -132.63 134.69 25.02 Favored Pre-proline 0 N--CA 1.477 0.914 0 C-N-CA 126.382 1.873 . . . . 0.0 108.31 170.874 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -63.12 101.42 0.28 Allowed 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 124.371 3.381 . . . . 0.0 112.891 -168.598 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . 0.311 61.5 pttt 40.83 29.84 0.08 Allowed 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 127.849 2.46 . . . . 0.0 116.83 -174.145 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 96.9 m -100.13 95.92 7.15 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 126.208 1.803 . . . . 0.0 107.747 173.185 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 15.5 tppt? 70.6 -43.79 0.56 Allowed 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 128.491 2.716 . . . . 0.0 113.565 -179.593 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.251 1.163 0 C-N-CA 126.731 2.012 . . . . 0.0 110.96 169.59 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.688 0 N-CA-C 110.918 -0.873 . . . . 0.0 110.918 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 20.3 tt -54.2 -33.29 24.91 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.453 0 N-CA-C 115.656 1.725 . . . . 0.0 115.656 -169.313 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' VAL . . . . . 0.465 HG12 ' H ' ' B' ' 29' ' ' LYS . 6.4 p -62.32 -23.46 32.15 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.141 0 C-N-CA 124.124 0.969 . . . . 0.0 112.754 177.226 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -76.04 0.72 17.67 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.224 1.409 . . . . 0.0 112.508 175.336 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 63.4 tp60 -117.93 -54.71 2.31 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 125.042 1.337 . . . . 0.0 109.025 166.868 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 22.8 m -67.72 -26.1 65.99 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 115.419 1.637 . . . . 0.0 115.419 -170.713 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 37.7 t -103.0 -41.95 5.96 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 119.112 0.869 . . . . 0.0 113.085 -176.547 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 24.1 p -71.42 -33.2 69.22 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 125.986 1.715 . . . . 0.0 112.169 176.359 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.8 t -134.42 -157.81 0.83 Allowed 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.957 1.703 . . . . 0.0 109.606 173.509 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 86.4 mt -100.14 150.11 5.62 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 C-N-CA 125.887 1.675 . . . . 0.0 110.847 -176.003 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.1 p -143.42 -164.02 1.77 Allowed 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 124.148 0.979 . . . . 0.0 112.233 169.387 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 26.5 t -154.84 151.76 28.99 Favored 'General case' 0 N--CA 1.469 0.494 0 O-C-N 120.727 -1.233 . . . . 0.0 111.59 -171.98 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 62.6 mt -60.77 -28.52 68.8 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.888 0.875 . . . . 0.0 112.22 178.641 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 68.6 t80 -62.15 -31.05 71.49 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.529 1.132 . . . . 0.0 113.049 172.363 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 65.6 mt-30 -81.54 -35.26 30.52 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 123.736 0.814 . . . . 0.0 110.842 175.328 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 17.8 mt -58.71 -41.18 85.71 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 118.924 0.784 . . . . 0.0 111.464 172.787 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -56.3 -28.46 58.85 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.865 1.666 . . . . 0.0 114.167 176.776 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 15.2 t-20 -66.11 -22.26 66.39 Favored 'General case' 0 CA--C 1.547 0.829 0 O-C-N 121.264 -0.898 . . . . 0.0 112.917 176.658 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 56.7 m-85 -100.88 4.91 43.12 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.404 1.482 . . . . 0.0 113.655 -178.971 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 77.9 m -73.76 168.35 19.56 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.172 0.989 . . . . 0.0 112.897 171.818 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.248 0.989 0 C-N-CA 125.86 1.664 . . . . 0.0 111.966 -178.863 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 . . . . . 0 N--CA 1.483 1.194 0 CA-C-O 118.313 -0.851 . . . . 0.0 111.078 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 92.5 t -78.72 -39.39 22.61 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.252 0 CA-C-N 120.525 1.511 . . . . 0.0 111.488 -177.897 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 2.3 t30 59.23 75.05 0.42 Allowed 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 125.564 1.546 . . . . 0.0 112.525 169.145 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -149.51 160.79 43.18 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 124.428 1.091 . . . . 0.0 111.93 -178.146 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 98.0 m-70 -85.02 140.9 30.68 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.494 1.117 . . . . 0.0 111.214 170.833 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 62.0 mt -141.57 137.1 31.71 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 125.941 1.696 . . . . 0.0 110.112 174.918 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 1.8 t -140.16 143.67 36.27 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 113.132 0.79 . . . . 0.0 113.132 -175.056 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 49.91 -123.03 12.67 Favored Glycine 0 N--CA 1.469 0.896 0 C-N-CA 125.232 1.396 . . . . 0.0 114.175 169.432 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.1 p -56.28 -36.46 68.63 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 124.908 1.283 . . . . 0.0 113.048 177.242 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -73.14 -32.51 64.95 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 120.736 -1.227 . . . . 0.0 112.035 178.235 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 41.9 tp -70.74 -43.3 69.13 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.918 0.887 . . . . 0.0 111.475 172.733 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 39.1 t -59.89 -43.78 92.85 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 C-N-CA 124.497 1.119 . . . . 0.0 110.911 172.524 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -64.08 -43.66 94.76 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.598 0.759 . . . . 0.0 111.088 175.477 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.93 -41.68 99.56 Favored 'General case' 0 CA--C 1.54 0.589 0 O-C-N 121.329 -0.857 . . . . 0.0 112.249 177.009 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 21.6 mt -60.06 -46.38 89.74 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 118.547 0.612 . . . . 0.0 110.662 173.126 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 19.3 m-85 -62.05 -35.72 79.45 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 120.936 -1.102 . . . . 0.0 113.69 173.525 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 62.5 mt -70.24 -41.57 73.37 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 119.49 1.041 . . . . 0.0 111.999 176.091 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 63.0 t -71.7 -42.36 70.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 C-N-CA 123.578 0.751 . . . . 0.0 111.702 179.407 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 36.7 m -86.41 -15.21 41.01 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 114.328 1.233 . . . . 0.0 114.328 -178.144 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 72.9 -162.01 54.61 Favored Glycine 0 CA--C 1.534 1.262 0 C-N-CA 124.963 1.268 . . . . 0.0 112.781 -174.076 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -58.61 -20.72 49.83 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 125.033 1.333 . . . . 0.0 113.354 179.04 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 73.6 mtp85 -61.66 -24.16 66.55 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 125.483 1.513 . . . . 0.0 113.302 175.335 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.42 -178.45 44.76 Favored Glycine 0 CA--C 1.529 0.951 0 C-N-CA 124.74 1.162 . . . . 0.0 113.81 -179.164 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 55.3 p90 -119.01 156.54 29.44 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 125.399 1.48 . . . . 0.0 111.932 -178.671 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 84.6 t80 -91.38 -40.12 11.63 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.328 1.051 . . . . 0.0 113.042 -177.739 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 8.2 t80 -87.85 112.74 22.81 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 114.162 1.171 . . . . 0.0 114.162 -169.028 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 6.6 t -72.4 144.05 86.21 Favored Pre-proline 0 N--CA 1.476 0.84 0 C-N-CA 124.891 1.276 . . . . 0.0 111.275 179.183 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -73.99 167.03 28.21 Favored 'Trans proline' 0 CA--C 1.537 0.667 0 C-N-CA 123.086 2.524 . . . . 0.0 111.101 169.84 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 29' ' ' LYS . . . . . 0.465 ' H ' HG12 ' A' ' 3' ' ' VAL . 16.1 tptm -67.06 -23.74 65.9 Favored 'General case' 0 CA--C 1.547 0.865 0 O-C-N 121.217 -0.927 . . . . 0.0 113.093 178.225 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 25.2 p -72.4 -20.56 61.41 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 126.85 2.06 . . . . 0.0 112.947 170.163 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 11.3 tmtt? 80.87 119.46 0.05 Allowed 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 129.275 3.03 . . . . 0.0 112.476 170.617 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 44.4 tpt85 . . . . . 0 N--CA 1.48 1.055 0 C-N-CA 125.732 1.613 . . . . 0.0 113.216 178.371 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.572 0 N-CA-C 111.79 -0.524 . . . . 0.0 111.79 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -60.39 -39.06 79.86 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.228 0 C-N-CA 123.8 0.84 . . . . 0.0 112.159 -173.994 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 9.5 p -66.0 -36.69 78.08 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 N-CA-C 112.976 0.732 . . . . 0.0 112.976 -179.253 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 46.8 mp0 -68.6 -45.78 71.07 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 119.158 0.89 . . . . 0.0 110.759 169.836 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 22.5 tt0 -61.18 -49.99 74.96 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.397 1.079 . . . . 0.0 112.165 -172.87 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 1.5 m -68.99 -17.98 64.0 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 113.726 1.01 . . . . 0.0 113.726 176.503 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 48.7 t -98.83 -42.27 7.25 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 119.245 0.929 . . . . 0.0 113.214 -174.667 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 1.9 t -73.6 -26.56 60.86 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 125.352 1.461 . . . . 0.0 112.712 -179.5 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.5 t -137.34 -173.05 3.36 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 125.475 1.51 . . . . 0.0 110.821 174.525 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 63.0 mt -82.44 139.49 17.77 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 C-N-CA 124.748 1.219 . . . . 0.0 110.462 176.831 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 16.5 p -129.99 158.07 40.58 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.332 1.053 . . . . 0.0 111.558 168.831 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 22.6 t -108.63 154.96 21.24 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 124.424 1.09 . . . . 0.0 113.904 -169.714 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.529 HD22 ' H ' ' A' ' 13' ' ' LEU . 2.1 mm? -58.52 -31.15 67.64 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.32 1.048 . . . . 0.0 111.462 174.052 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 90.1 t80 -62.1 -33.07 73.74 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.081 0.952 . . . . 0.0 112.98 173.384 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 57.4 mt-30 -76.23 -42.14 46.93 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 123.433 0.693 . . . . 0.0 109.886 174.613 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 81.3 mt -59.14 -41.96 89.52 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 118.455 0.571 . . . . 0.0 111.876 174.668 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 23.5 mt-10 -63.51 -32.53 74.01 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 171.864 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.4 t-20 -69.95 -23.51 63.2 Favored 'General case' 0 CA--C 1.546 0.819 0 CA-C-N 119.038 0.836 . . . . 0.0 112.772 173.067 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 13.2 m-85 -86.94 -11.04 51.79 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 124.897 1.279 . . . . 0.0 113.614 174.869 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 61.3 m -63.1 151.35 40.3 Favored 'General case' 0 N--CA 1.47 0.549 0 O-C-N 120.988 -1.07 . . . . 0.0 111.68 169.996 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 . . . . . 0 C--O 1.252 1.215 0 C-N-CA 125.072 1.349 . . . . 0.0 112.618 179.383 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 77.7 m-85 . . . . . 0 N--CA 1.486 1.349 0 CA-C-O 118.94 -0.553 . . . . 0.0 112.43 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 27.4 m -129.39 -167.48 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.126 0 C-N-CA 125.816 1.646 . . . . 0.0 110.092 -179.024 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 17.8 p-10 -60.82 117.58 5.59 Favored 'General case' 0 CA--C 1.545 0.773 0 O-C-N 121.183 -0.948 . . . . 0.0 110.484 169.755 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 36.9 mt-30 -146.6 174.95 10.96 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.422 1.489 . . . . 0.0 111.333 -167.875 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 38.4 m-70 -79.51 135.01 36.52 Favored 'General case' 0 CA--C 1.545 0.776 0 O-C-N 121.366 -0.834 . . . . 0.0 109.249 167.373 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 82.7 mt -136.9 121.16 17.98 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 125.931 1.692 . . . . 0.0 109.688 178.215 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 80.9 m -121.19 132.87 55.09 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.772 1.229 . . . . 0.0 111.957 -174.932 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 50.28 -117.99 5.55 Favored Glycine 0 N--CA 1.476 1.307 0 C-N-CA 125.349 1.452 . . . . 0.0 114.838 168.827 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.1 p -53.85 -39.58 65.75 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 125.221 1.408 . . . . 0.0 112.91 176.678 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -69.67 -34.29 73.76 Favored 'General case' 0 CA--C 1.54 0.586 0 O-C-N 121.098 -1.001 . . . . 0.0 111.826 178.599 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 59.9 tp -68.89 -44.17 73.76 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 123.574 0.75 . . . . 0.0 111.69 172.19 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 47.6 t -60.87 -43.53 95.84 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 C-N-CA 123.948 0.899 . . . . 0.0 110.741 175.895 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 29.1 mm-40 -64.79 -41.54 95.75 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.434 0.694 . . . . 0.0 112.062 174.083 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.45 -40.75 97.63 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 119.293 0.952 . . . . 0.0 112.047 175.298 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 43.0 mt -61.22 -43.31 99.08 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.568 0.747 . . . . 0.0 111.608 173.84 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 20.1 m-85 -61.49 -42.65 99.11 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 119.635 1.107 . . . . 0.0 112.327 172.44 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 70.4 mt -67.51 -41.57 84.21 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.933 0.893 . . . . 0.0 112.466 179.489 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 51.5 t -73.1 -47.3 48.18 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 C-N-CA 123.962 0.905 . . . . 0.0 111.478 179.441 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 65.7 m -81.67 -30.11 32.83 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 113.621 0.971 . . . . 0.0 113.621 -174.383 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 66.66 -134.43 32.69 Favored Glycine 0 CA--C 1.527 0.814 0 C-N-CA 124.056 0.836 . . . . 0.0 111.127 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 2.5 pm0 -68.24 -13.94 62.62 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 114.229 1.196 . . . . 0.0 114.229 178.08 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 84.3 mtm180 -65.25 -36.2 83.4 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.943 0.897 . . . . 0.0 112.77 179.045 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.83 177.92 40.06 Favored Glycine 0 CA--C 1.535 1.282 0 C-N-CA 124.154 0.883 . . . . 0.0 112.609 -170.573 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 51.6 p90 -153.37 161.93 41.81 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 114.419 1.266 . . . . 0.0 114.419 -171.462 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -96.39 144.04 26.89 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.634 1.574 . . . . 0.0 110.11 168.815 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 69.6 t80 -161.28 142.67 11.58 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.882 1.273 . . . . 0.0 111.365 -174.526 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 40.4 p -126.59 108.57 23.13 Favored Pre-proline 0 C--O 1.239 0.512 0 C-N-CA 125.118 1.367 . . . . 0.0 110.903 179.79 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -67.89 106.2 1.27 Allowed 'Trans proline' 0 N--CA 1.457 -0.665 0 C-N-CA 121.82 1.68 . . . . 0.0 108.117 168.161 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 21.6 ttmm 71.11 -50.72 0.69 Allowed 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 129.076 2.95 . . . . 0.0 114.281 -176.531 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 9.8 t -175.37 -39.42 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 126.481 1.912 . . . . 0.0 112.175 -175.088 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 65.9 pttt -70.17 171.2 10.11 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 124.308 1.043 . . . . 0.0 112.517 173.291 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.153 0 C-N-CA 127.905 2.482 . . . . 0.0 111.132 175.998 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.659 0 N-CA-C 111.463 -0.655 . . . . 0.0 111.463 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.457 HG22 ' H ' ' B' ' 27' ' ' THR . 10.4 tp -63.75 -32.98 59.07 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.044 0 CA-C-N 118.523 1.162 . . . . 0.0 112.485 179.146 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 96.0 t -63.11 -51.88 66.02 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 CA-C-N 118.519 0.6 . . . . 0.0 110.541 174.865 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -53.21 -48.15 68.37 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 123.571 0.748 . . . . 0.0 111.067 173.036 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 42.1 tp60 -65.64 -55.18 18.91 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.886 0.875 . . . . 0.0 111.354 -172.358 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 72.0 m -69.47 -26.45 64.58 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 -178.014 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 84.9 m -71.88 -50.44 29.3 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 119.453 1.024 . . . . 0.0 111.17 171.802 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -79.93 -19.34 48.29 Favored 'General case' 0 N--CA 1.478 0.965 0 N-CA-C 114.065 1.135 . . . . 0.0 114.065 -172.291 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 95.8 p -149.82 168.93 22.31 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.254 1.022 . . . . 0.0 113.09 -173.406 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 53.2 mt -69.63 125.27 27.34 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 O-C-N 121.244 -0.91 . . . . 0.0 109.504 170.848 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 15.3 p -117.13 -159.9 0.75 Allowed 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.693 1.197 . . . . 0.0 110.411 170.427 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 6.7 t -157.19 168.76 26.46 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 120.209 -1.557 . . . . 0.0 111.481 175.161 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 52.0 mt -63.28 -27.46 69.35 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.685 1.194 . . . . 0.0 112.839 -174.929 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.2 t80 -63.73 -32.43 73.93 Favored 'General case' 0 CA--C 1.546 0.79 0 O-C-N 121.282 -0.886 . . . . 0.0 113.081 169.874 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 44.6 mm-40 -75.07 -23.57 58.07 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 123.569 0.748 . . . . 0.0 111.245 175.701 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 30.5 mt -77.06 -48.29 18.26 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 123.892 0.877 . . . . 0.0 110.817 172.679 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 -63.11 -22.72 67.05 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 113.639 0.977 . . . . 0.0 113.639 178.026 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 16.8 t30 -54.48 -29.4 49.84 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 123.929 0.892 . . . . 0.0 112.856 169.964 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 97.3 m-85 -100.8 7.45 43.75 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.316 1.446 . . . . 0.0 113.429 176.807 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 22.8 t -89.76 167.78 12.61 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.885 1.274 . . . . 0.0 111.782 170.029 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 21.7 m-80 . . . . . 0 C--O 1.252 1.192 0 C-N-CA 125.136 1.374 . . . . 0.0 112.561 173.253 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 65.6 m-85 . . . . . 0 N--CA 1.487 1.413 0 N-CA-C 110.779 -0.082 . . . . 0.0 110.779 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 76.2 t -68.62 142.31 16.41 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.239 0 C-N-CA 124.438 1.095 . . . . 0.0 110.606 -179.627 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 6.4 t-20 65.08 64.55 0.62 Allowed 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 126.114 1.766 . . . . 0.0 112.679 173.425 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 47.4 mt-30 -143.33 -170.68 3.33 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 126.037 1.735 . . . . 0.0 110.308 -179.139 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 23.6 m-70 -73.7 146.24 44.59 Favored 'General case' 0 CA--C 1.545 0.761 0 O-C-N 120.897 -1.127 . . . . 0.0 109.815 167.025 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 62.9 mt -143.82 125.56 15.1 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 126.001 1.72 . . . . 0.0 109.072 174.713 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 5.6 t -137.99 149.91 46.53 Favored 'General case' 0 CA--C 1.537 0.475 0 O-C-N 121.275 -0.89 . . . . 0.0 112.993 -176.719 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 54.29 -130.46 44.7 Favored Glycine 0 N--CA 1.468 0.827 0 C-N-CA 125.028 1.299 . . . . 0.0 113.572 174.132 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.9 m -56.54 -32.02 64.71 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.306 1.043 . . . . 0.0 113.128 179.141 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -73.07 -35.91 66.76 Favored 'General case' 0 CA--C 1.543 0.696 0 O-C-N 120.862 -1.149 . . . . 0.0 112.024 177.576 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 58.9 tp -67.25 -44.89 78.29 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 123.66 0.784 . . . . 0.0 110.943 172.106 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 58.3 t -61.45 -42.46 93.94 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 123.907 0.883 . . . . 0.0 110.902 176.006 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -62.67 -44.55 95.96 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 123.329 0.652 . . . . 0.0 112.052 173.687 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.33 -40.47 96.47 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 118.784 0.72 . . . . 0.0 112.22 175.757 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 16.0 mt -59.71 -44.5 93.69 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.025 0.93 . . . . 0.0 111.774 172.68 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 20.7 m-85 -62.93 -40.66 98.32 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 119.499 1.045 . . . . 0.0 112.993 173.322 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 78.7 mt -66.92 -41.97 86.18 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.676 0.79 . . . . 0.0 112.556 177.128 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 38.9 t -71.73 -48.44 51.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 C-N-CA 124.482 1.113 . . . . 0.0 111.949 178.779 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 28.0 t -86.84 -37.24 17.93 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 113.31 0.856 . . . . 0.0 113.31 -170.124 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 69.63 -146.0 42.96 Favored Glycine 0 CA--C 1.533 1.187 0 C-N-CA 124.201 0.905 . . . . 0.0 112.097 -177.264 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -65.44 -15.63 62.82 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 125.136 1.375 . . . . 0.0 113.44 -178.805 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 80.1 mtm180 -60.83 -29.95 69.8 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.886 1.274 . . . . 0.0 113.734 -178.591 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 80.52 138.91 2.19 Favored Glycine 0 N--CA 1.472 1.077 0 C-N-CA 125.249 1.405 . . . . 0.0 113.336 178.875 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 44.2 p90 -118.75 153.24 34.74 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 125.284 1.434 . . . . 0.0 113.232 -178.057 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 26.3 p90 -120.31 37.96 4.11 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 127.844 2.458 . . . . 0.0 111.227 -177.016 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -49.34 142.16 7.88 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 125.87 1.668 . . . . 0.0 114.231 -178.892 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 27' ' ' THR . . . . . 0.457 ' H ' HG22 ' A' ' 2' ' ' ILE . 11.2 p -93.13 111.09 50.15 Favored Pre-proline 0 N--CA 1.474 0.766 0 C-N-CA 125.233 1.413 . . . . 0.0 112.806 -175.442 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_endo -79.62 161.08 25.01 Favored 'Trans proline' 0 C--N 1.353 0.807 0 C-N-CA 123.758 2.972 . . . . 0.0 110.597 169.35 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 43.5 tptt -70.37 -14.43 62.56 Favored 'General case' 0 CA--C 1.549 0.908 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 -178.539 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 31.1 p -66.48 -24.74 66.46 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 125.094 1.358 . . . . 0.0 112.233 169.614 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 63.3 mttp -101.75 -49.38 4.0 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.627 1.171 . . . . 0.0 113.191 176.038 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 13.9 mmm180 . . . . . 0 N--CA 1.481 1.117 0 C-N-CA 125.081 1.352 . . . . 0.0 112.654 -173.956 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.212 0 N-CA-C 110.672 -0.971 . . . . 0.0 110.672 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 15.1 tt 156.36 -41.43 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.366 1 C-N-CA 133.089 4.555 . . . . 0.0 109.616 175.443 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 7.1 p -65.56 -23.43 32.69 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.76 0 C-N-CA 124.511 1.124 . . . . 0.0 112.95 -177.661 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 26.0 pm0 -68.96 -11.53 60.8 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.338 1.455 . . . . 0.0 113.951 169.807 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 71.6 tp60 -105.92 -45.96 4.23 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 124.056 0.943 . . . . 0.0 110.542 169.454 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 54.4 m -79.33 -29.25 42.2 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 115.907 1.817 . . . . 0.0 115.907 -171.586 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 42.0 t -98.46 -56.92 2.32 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 119.86 1.209 . . . . 0.0 113.113 -173.436 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 17.0 p -66.47 -46.81 75.12 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.103 1.361 . . . . 0.0 111.074 178.892 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.9 t -102.15 -161.24 0.84 Allowed 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 124.771 1.228 . . . . 0.0 110.59 168.548 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 49.4 mt -110.01 150.16 12.71 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 C-N-CA 126.59 1.956 . . . . 0.0 110.28 -179.541 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 12.2 p -141.34 158.77 43.43 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 114.571 1.322 . . . . 0.0 114.571 174.153 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 78.6 p -98.3 167.59 10.76 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 126.195 1.798 . . . . 0.0 113.478 175.696 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 31.4 mt -65.0 -27.63 68.96 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 121.356 -0.84 . . . . 0.0 112.053 173.644 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.5 t80 -67.02 -34.74 78.38 Favored 'General case' 0 CA--C 1.542 0.643 0 O-C-N 121.449 -0.782 . . . . 0.0 112.253 171.456 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 81.7 mt-30 -73.39 -26.5 61.01 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 118.746 -0.645 . . . . 0.0 112.073 172.873 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 68.7 mt -68.61 -49.45 59.18 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 119.47 1.032 . . . . 0.0 110.523 168.404 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 18.1 mm-40 -56.35 -30.56 62.78 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.71 1.204 . . . . 0.0 113.256 175.729 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -59.45 -24.19 63.34 Favored 'General case' 0 CA--C 1.55 0.945 0 N-CA-C 113.68 0.993 . . . . 0.0 113.68 178.549 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 78.8 m-85 -100.48 -2.46 33.09 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.224 1.41 . . . . 0.0 114.037 175.462 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 75.1 m -86.99 153.62 21.42 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 121.03 -1.044 . . . . 0.0 113.506 179.395 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 31.6 m120 . . . . . 0 C--O 1.253 1.244 0 C-N-CA 125.277 1.431 . . . . 0.0 113.241 179.46 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 22.8 p90 . . . . . 0 N--CA 1.486 1.339 0 CA-C-O 119.471 -0.3 . . . . 0.0 110.78 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 34.8 m -66.29 -21.36 28.61 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.325 0 N-CA-C 114.757 1.391 . . . . 0.0 114.757 -171.103 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 22.0 t-20 -73.96 111.63 9.31 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 169.358 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -162.97 -179.07 6.48 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 113.158 0.799 . . . . 0.0 113.158 -167.915 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 89.0 m-70 -81.95 136.76 35.26 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 123.502 0.721 . . . . 0.0 110.719 168.588 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 65.7 mt -142.04 135.02 28.79 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 126.411 1.884 . . . . 0.0 108.872 173.697 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 1.3 t -139.32 145.27 38.87 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 112.878 0.696 . . . . 0.0 112.878 -174.767 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 48.57 -123.34 10.1 Favored Glycine 0 N--CA 1.47 0.948 0 C-N-CA 125.197 1.38 . . . . 0.0 114.146 170.071 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 18.3 m -54.9 -36.74 65.49 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 124.606 1.162 . . . . 0.0 113.393 178.409 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 73.4 m-70 -76.62 -29.41 56.47 Favored 'General case' 0 CA--C 1.538 0.486 0 O-C-N 120.777 -1.202 . . . . 0.0 112.693 177.875 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 39.4 tp -69.81 -44.59 69.7 Favored 'General case' 0 N--CA 1.468 0.431 0 O-C-N 121.658 -0.651 . . . . 0.0 111.304 170.483 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 42.7 t -60.15 -44.26 94.85 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 125.15 1.38 . . . . 0.0 111.141 173.036 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -59.98 -46.78 88.32 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.993 1.317 . . . . 0.0 111.866 173.305 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.47 -43.03 99.8 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 118.942 0.792 . . . . 0.0 112.093 177.082 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 29.0 mt -58.35 -45.01 89.01 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 123.617 0.767 . . . . 0.0 111.366 174.73 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 11.5 m-85 -61.8 -44.67 96.4 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 123.243 0.617 . . . . 0.0 112.436 173.686 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 73.3 mt -68.14 -41.56 81.46 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 123.852 0.861 . . . . 0.0 112.52 -178.515 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 65.6 t -72.14 -48.79 47.59 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 C-N-CA 123.658 0.783 . . . . 0.0 111.527 -179.461 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 71.3 m -96.97 -17.24 20.2 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 115.013 1.486 . . . . 0.0 115.013 -169.487 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 67.76 -145.48 45.29 Favored Glycine 0 CA--C 1.53 1.017 0 C-N-CA 124.533 1.064 . . . . 0.0 113.834 172.585 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -61.06 -20.4 62.52 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.363 1.465 . . . . 0.0 113.906 -176.114 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 40.4 mtp180 -56.23 -38.53 71.2 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.032 1.333 . . . . 0.0 112.973 177.262 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.38 175.48 45.42 Favored Glycine 0 CA--C 1.535 1.337 0 C-N-CA 124.729 1.156 . . . . 0.0 113.618 -176.002 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 51.9 p90 -153.1 160.87 42.97 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.315 1.446 . . . . 0.0 113.865 -172.794 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 70.7 t80 -89.06 146.24 24.96 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.607 1.563 . . . . 0.0 110.937 170.038 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 56.4 t80 -155.26 129.36 8.81 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.846 0.858 . . . . 0.0 112.412 -178.482 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 21.3 p -146.49 159.16 45.54 Favored Pre-proline 0 N--CA 1.477 0.899 0 C-N-CA 126.739 2.015 . . . . 0.0 110.343 176.374 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -74.56 -179.83 5.22 Favored 'Trans proline' 0 C--N 1.351 0.699 0 C-N-CA 123.767 2.978 . . . . 0.0 112.202 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 48.5 mtmt -56.1 -32.68 64.39 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 124.811 1.244 . . . . 0.0 113.544 -179.367 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 24.9 p -88.44 -9.25 53.18 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 127.604 2.361 . . . . 0.0 113.934 179.71 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 58.9 tttm 72.47 -31.05 0.22 Allowed 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 128.444 2.698 . . . . 0.0 114.081 -177.929 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 17.3 ptm180 . . . . . 0 C--O 1.251 1.138 0 C-N-CA 126.859 2.063 . . . . 0.0 112.999 -176.087 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.446 ' HA3' HG23 ' B' ' 27' ' ' THR . . . . . . . . 0 N--CA 1.476 1.32 0 CA-C-O 119.455 -0.636 . . . . 0.0 112.398 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 14.1 tt -94.39 -32.04 4.55 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.114 0 CA-C-N 118.563 1.181 . . . . 0.0 114.072 -172.497 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 50.5 t -62.93 -38.19 81.27 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.32 0 CA-C-N 119.488 1.04 . . . . 0.0 111.184 -175.181 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.1 pm0 -67.22 -7.61 25.28 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 114.105 1.15 . . . . 0.0 114.105 176.641 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 13.2 tp60 -105.6 -56.76 2.13 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.295 1.038 . . . . 0.0 110.224 168.921 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 19.2 m -77.29 -25.37 51.29 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 115.025 1.491 . . . . 0.0 115.025 -170.559 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 34.2 t -96.31 -42.37 8.18 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 119.569 1.077 . . . . 0.0 111.807 178.043 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 33.7 m -62.74 -37.89 88.36 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 125.263 1.425 . . . . 0.0 112.153 176.924 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.9 t -138.22 -170.49 2.82 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.587 1.155 . . . . 0.0 110.952 178.54 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 55.2 mt -79.0 139.87 17.73 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 C-N-CA 124.713 1.205 . . . . 0.0 110.089 175.801 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 8.7 p -136.05 157.4 46.93 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 121.907 0.86 . . . . 0.0 113.056 169.986 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.4 m -104.55 164.3 11.85 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 125.168 1.387 . . . . 0.0 111.749 -173.062 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 45.3 mt -56.27 -32.03 64.16 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 121.458 -0.776 . . . . 0.0 112.235 172.177 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.7 t80 -61.58 -29.78 70.24 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 124.113 0.965 . . . . 0.0 113.4 174.221 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 61.6 mm-40 -78.87 -36.43 42.23 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.317 0.647 . . . . 0.0 110.484 175.652 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 87.2 mt -64.13 -43.52 95.03 Favored 'General case' 0 CA--C 1.539 0.546 0 O-C-N 121.813 -0.554 . . . . 0.0 111.467 171.716 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -59.39 -24.19 63.24 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.601 1.56 . . . . 0.0 114.172 173.765 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.4 t30 -77.3 -29.49 53.7 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 123.951 0.901 . . . . 0.0 112.702 176.247 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 27.0 m-85 -86.23 -1.3 57.34 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 124.625 1.17 . . . . 0.0 113.884 175.16 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 57.2 m -73.5 132.2 42.62 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 123.405 0.682 . . . . 0.0 110.36 168.593 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.251 1.161 0 C-N-CA 127.168 2.187 . . . . 0.0 112.765 -172.31 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 12.5 t80 . . . . . 0 N--CA 1.489 1.478 0 CA-C-O 118.757 -0.639 . . . . 0.0 110.301 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 92.1 t -61.67 122.48 12.39 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 CA-C-N 120.224 1.375 . . . . 0.0 111.457 -174.212 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 47.4 t30 -168.27 103.0 0.44 Allowed 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 126.351 1.861 . . . . 0.0 109.312 -174.063 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 3.0 mm-40 -164.21 179.51 6.82 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.802 1.241 . . . . 0.0 111.563 -168.817 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 40.9 m-70 -72.73 138.54 46.61 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 123.775 0.83 . . . . 0.0 110.37 168.173 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 72.6 mt -140.39 126.79 20.03 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 126.925 2.09 . . . . 0.0 109.045 175.613 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 87.4 m -128.0 141.92 51.38 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.61 1.164 . . . . 0.0 112.614 -172.382 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 47.94 -121.04 6.66 Favored Glycine 0 C--N 1.343 0.941 0 C-N-CA 125.273 1.416 . . . . 0.0 114.552 169.11 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 18.1 m -54.65 -37.69 65.99 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.835 1.254 . . . . 0.0 113.105 178.382 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 77.2 m-70 -75.07 -28.52 60.39 Favored 'General case' 0 CA--C 1.543 0.68 0 O-C-N 120.958 -1.089 . . . . 0.0 112.759 176.882 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 28.5 tp -70.08 -43.54 70.94 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 121.353 -0.842 . . . . 0.0 111.371 170.051 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 60.8 t -61.75 -41.8 91.94 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.094 0 C-N-CA 124.348 1.059 . . . . 0.0 110.891 173.009 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -58.35 -49.87 75.69 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.894 1.277 . . . . 0.0 111.49 173.666 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.41 -42.4 96.08 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.532 0.733 . . . . 0.0 111.645 179.454 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 47.0 mt -56.69 -51.11 70.04 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-O 118.661 -0.685 . . . . 0.0 111.349 173.685 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -66.47 -35.18 79.65 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 119.897 1.226 . . . . 0.0 112.271 -178.193 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 83.8 mt -68.95 -41.14 78.44 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 123.611 0.765 . . . . 0.0 112.525 176.422 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 41.9 t -71.5 -46.58 62.82 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.984 0 C-N-CA 123.66 0.784 . . . . 0.0 112.002 177.389 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 72.0 m -78.13 -38.34 44.1 Favored 'General case' 0 N--CA 1.466 0.334 0 N-CA-C 113.306 0.854 . . . . 0.0 113.306 -173.072 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 56.36 -123.71 32.34 Favored Glycine 0 CA--C 1.53 1.013 0 C-N-CA 123.659 0.647 . . . . 0.0 111.912 -179.602 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 3.2 pm0 -67.01 -15.45 63.74 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.671 1.588 . . . . 0.0 114.705 178.374 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 81.8 mtp180 -67.99 -26.22 65.81 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 119.106 0.866 . . . . 0.0 112.732 178.607 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.42 168.69 20.11 Favored Glycine 0 CA--C 1.534 1.229 0 C-N-CA 124.616 1.103 . . . . 0.0 112.245 -169.859 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 34.3 p90 -152.96 165.68 34.78 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 125.026 1.33 . . . . 0.0 112.821 -178.423 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -132.11 104.81 7.0 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 123.933 0.893 . . . . 0.0 110.49 171.141 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 83.7 t80 -73.4 148.98 42.83 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 123.97 0.908 . . . . 0.0 111.394 171.139 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 27' ' ' THR . . . . . 0.446 HG23 ' HA3' ' A' ' 1' ' ' GLY . 0.1 OUTLIER -158.02 115.51 1.81 Allowed Pre-proline 0 N--CA 1.472 0.657 0 C-N-CA 124.997 1.319 . . . . 0.0 109.659 178.694 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_endo -79.71 177.38 8.49 Favored 'Trans proline' 0 CA--C 1.534 0.508 0 C-N-CA 123.982 3.121 . . . . 0.0 112.686 -172.607 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -63.05 -24.64 68.01 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 125.036 1.334 . . . . 0.0 112.605 176.034 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 22.4 p -82.05 -9.07 59.67 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 126.746 2.018 . . . . 0.0 113.793 172.178 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 18.1 ttmm 84.73 143.29 0.06 Allowed 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 129.008 2.923 . . . . 0.0 113.662 170.188 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 13.4 ttp180 . . . . . 0 C--O 1.251 1.16 0 C-N-CA 126.466 1.906 . . . . 0.0 110.869 170.105 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.372 0 N-CA-C 109.79 -1.324 . . . . 0.0 109.79 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 14.2 tt -179.74 -51.79 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.252 0 C-N-CA 128.197 2.599 . . . . 0.0 110.96 170.31 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 2.7 t -65.73 -33.11 61.41 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.127 0 C-N-CA 123.556 0.743 . . . . 0.0 111.184 -171.655 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.5 pm0 -68.67 -8.96 47.2 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.961 1.305 . . . . 0.0 113.879 175.318 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 72.0 tp60 -103.72 -58.42 1.88 Allowed 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.108 0.963 . . . . 0.0 108.951 168.208 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 41.8 m -65.86 -31.17 71.97 Favored 'General case' 0 N--CA 1.469 0.486 0 N-CA-C 115.159 1.54 . . . . 0.0 115.159 -170.729 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 48.5 t -96.97 -47.34 5.85 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 119.09 0.859 . . . . 0.0 112.167 -178.398 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 32.1 m -69.95 -31.52 69.29 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 125.496 1.518 . . . . 0.0 111.887 -179.504 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.4 t -133.36 -152.87 0.51 Allowed 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.34 1.456 . . . . 0.0 109.974 172.503 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 78.5 mt -101.34 147.55 8.17 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 C-N-CA 126.522 1.929 . . . . 0.0 109.76 179.283 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.0 p -138.5 160.97 38.21 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 113.103 0.779 . . . . 0.0 113.103 169.252 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 76.6 p -105.74 163.01 13.04 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 125.46 1.504 . . . . 0.0 113.626 -174.811 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 81.6 mt -60.51 -33.24 72.34 Favored 'General case' 0 N--CA 1.471 0.581 0 O-C-N 121.47 -0.769 . . . . 0.0 111.984 170.18 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 91.6 t80 -65.25 -36.17 83.29 Favored 'General case' 0 N--CA 1.47 0.544 0 O-C-N 121.604 -0.685 . . . . 0.0 112.327 174.271 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 87.8 mt-30 -70.18 -40.15 74.81 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 118.563 -0.732 . . . . 0.0 111.054 172.177 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 73.0 mt -58.77 -41.52 86.78 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 119.549 1.068 . . . . 0.0 111.979 172.07 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.4 ' HA ' ' SG ' ' A' ' 20' ' ' CYS . 18.3 mt-10 -63.21 -35.68 81.13 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 113.527 0.936 . . . . 0.0 113.527 171.81 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 26.9 t30 -65.37 -24.07 67.14 Favored 'General case' 0 CA--C 1.547 0.837 0 O-C-N 120.94 -1.1 . . . . 0.0 112.429 174.355 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 47.6 m-85 -90.99 0.71 57.47 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 125.163 1.385 . . . . 0.0 114.056 173.935 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.4 ' SG ' ' HA ' ' A' ' 17' ' ' GLU . 67.2 m -71.74 149.59 45.25 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 120.93 -1.106 . . . . 0.0 111.307 169.172 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 . . . . . 0 C--O 1.251 1.184 0 C-N-CA 125.342 1.457 . . . . 0.0 112.999 -179.569 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 82.0 m-85 . . . . . 0 N--CA 1.486 1.326 0 CA-C-O 119.34 -0.362 . . . . 0.0 111.359 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 22.8 t 73.83 -50.28 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 C-N-CA 128.252 2.621 . . . . 0.0 113.21 172.633 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 3.6 m120 -99.79 134.03 43.28 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.236 1.415 . . . . 0.0 111.362 -178.671 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 2.4 mm-40 -159.75 169.94 22.57 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.977 1.311 . . . . 0.0 112.508 -178.065 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 97.0 m-70 -88.98 135.29 33.63 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.784 1.233 . . . . 0.0 109.372 167.191 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 77.5 mt -143.81 119.46 10.44 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 125.592 1.557 . . . . 0.0 109.521 -177.555 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 86.4 m -123.78 130.79 53.17 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.818 1.247 . . . . 0.0 112.543 -176.468 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 58.83 -121.12 25.54 Favored Glycine 0 N--CA 1.472 1.063 0 C-N-CA 124.815 1.198 . . . . 0.0 113.998 169.243 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 24.1 p -53.47 -43.15 67.92 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 124.437 1.095 . . . . 0.0 112.501 177.182 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 27.4 m80 -61.08 -40.74 94.84 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.313 1.045 . . . . 0.0 112.031 177.428 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 47.3 tp -66.72 -45.91 77.18 Favored 'General case' 0 C--O 1.223 -0.323 0 C-N-CA 124.117 0.967 . . . . 0.0 111.363 174.993 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 68.6 t -62.89 -42.16 95.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 C-N-CA 123.903 0.881 . . . . 0.0 111.241 178.339 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.7 mm-40 -59.01 -52.04 67.48 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.677 0.791 . . . . 0.0 111.216 173.436 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.79 -44.74 89.01 Favored 'General case' 0 CA--C 1.538 0.518 0 O-C-N 121.681 -0.637 . . . . 0.0 111.905 -177.842 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 62.5 tp -58.66 -50.03 75.38 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 125.023 1.329 . . . . 0.0 111.217 178.513 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -68.01 -35.83 78.96 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 119.437 1.017 . . . . 0.0 112.291 179.258 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 78.4 mt -67.47 -36.33 80.93 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 118.864 0.757 . . . . 0.0 112.195 176.129 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 33.4 t -67.04 -45.66 86.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 CA-C-N 118.906 0.776 . . . . 0.0 111.482 171.895 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 72.2 m -73.6 -34.54 65.11 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 113.655 0.983 . . . . 0.0 113.655 -176.763 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 64.49 -130.93 37.84 Favored Glycine 0 CA--C 1.529 0.931 0 C-N-CA 124.142 0.877 . . . . 0.0 111.041 -177.698 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -65.91 -15.25 62.78 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 114.47 1.285 . . . . 0.0 114.47 178.842 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 83.4 mtm180 -66.89 -32.75 74.21 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.21 1.004 . . . . 0.0 113.564 -176.641 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.09 176.63 44.36 Favored Glycine 0 CA--C 1.533 1.204 0 C-N-CA 123.867 0.746 . . . . 0.0 112.212 -169.587 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 45.3 p90 -149.14 159.62 44.08 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 114.881 1.437 . . . . 0.0 114.881 -168.99 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 76.8 t80 -100.35 136.44 40.24 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 126.601 1.961 . . . . 0.0 109.691 169.255 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 64.1 t80 -153.94 122.34 6.18 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.775 0.83 . . . . 0.0 112.283 -179.7 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 9.3 t 170.87 136.17 0.07 OUTLIER Pre-proline 0 N--CA 1.479 1.007 0 C-N-CA 129.316 3.046 . . . . 0.0 109.544 170.811 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -85.24 166.71 10.85 Favored 'Trans proline' 0 CA--C 1.536 0.624 0 C-N-CA 123.628 2.885 . . . . 0.0 112.07 174.857 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 94.0 mttt -94.78 -49.44 5.6 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 112.807 0.669 . . . . 0.0 112.807 169.408 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 30.5 p -88.54 -36.23 16.5 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 125.489 1.516 . . . . 0.0 113.499 -173.772 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 30.1 mtpp -81.78 -3.33 53.61 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 124.413 1.085 . . . . 0.0 113.846 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 74.8 ttt-85 . . . . . 0 C--O 1.253 1.247 0 C-N-CA 126.786 2.034 . . . . 0.0 112.672 -177.679 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.541 0 N-CA-C 111.84 -0.504 . . . . 0.0 111.84 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 17.8 tt -60.03 -33.65 53.8 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.256 0 N-CA-C 114.026 1.121 . . . . 0.0 114.026 -170.322 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 41.9 t -66.77 -32.55 58.53 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.99 0 C-N-CA 123.556 0.742 . . . . 0.0 111.745 -178.342 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -69.25 -48.07 62.89 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.398 0.679 . . . . 0.0 110.498 169.799 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 31.7 tt0 -69.1 -45.63 69.76 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 124.005 0.922 . . . . 0.0 111.979 -169.946 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 61.0 m -64.05 -24.49 67.72 Favored 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 113.617 0.969 . . . . 0.0 113.617 175.475 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 37.3 t -92.95 -42.6 9.38 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 118.746 0.703 . . . . 0.0 112.158 -177.714 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 69.6 p -79.67 -21.95 44.09 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 124.981 1.313 . . . . 0.0 113.64 179.361 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 9.0 t -142.14 -166.89 2.34 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.327 1.451 . . . . 0.0 111.099 175.326 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 71.0 mt -97.76 112.23 29.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 O-C-N 120.57 -1.331 . . . . 0.0 108.172 170.889 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 31.6 p -83.58 156.62 22.66 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 123.694 0.798 . . . . 0.0 111.298 171.036 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 48.7 m -83.59 149.64 26.43 Favored 'General case' 0 N--CA 1.471 0.613 0 O-C-N 120.747 -1.221 . . . . 0.0 111.72 -178.118 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 74.2 mt -60.81 -26.71 67.5 Favored 'General case' 0 CA--C 1.546 0.801 0 O-C-N 121.048 -1.032 . . . . 0.0 111.556 171.008 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 82.7 t80 -65.12 -28.53 69.49 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 124.885 1.274 . . . . 0.0 113.808 169.807 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 94.5 mt-30 -79.56 -36.15 38.72 Favored 'General case' 0 N--CA 1.472 0.628 0 O-C-N 121.048 -1.033 . . . . 0.0 110.279 174.59 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 82.1 mt -61.26 -42.99 99.57 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 118.598 0.635 . . . . 0.0 111.419 169.082 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 45.8 mm-40 -60.75 -34.3 74.23 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.561 1.144 . . . . 0.0 113.312 170.84 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 17.0 t30 -64.63 -28.65 69.76 Favored 'General case' 0 CA--C 1.546 0.817 0 O-C-N 121.021 -1.049 . . . . 0.0 112.703 179.2 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 23.8 m-85 -87.79 -12.22 45.7 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 124.547 1.139 . . . . 0.0 113.394 173.727 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 35.1 t -80.53 174.01 12.03 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.416 1.486 . . . . 0.0 111.525 168.784 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 12.6 m-80 . . . . . 0 C--O 1.251 1.146 0 C-N-CA 125.126 1.37 . . . . 0.0 112.672 171.336 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 71.1 m-85 . . . . . 0 N--CA 1.489 1.489 0 N-CA-C 111.466 0.173 . . . . 0.0 111.466 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 8.5 p -63.36 150.0 9.94 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.125 0 C-N-CA 124.734 1.214 . . . . 0.0 112.435 178.337 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 43.4 t30 81.24 178.96 0.08 Allowed 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 127.628 2.371 . . . . 0.0 113.421 172.262 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 38.0 mt-30 -134.99 -179.97 5.95 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 127.091 2.156 . . . . 0.0 110.218 -176.976 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 27.0 m-70 -69.68 135.67 50.13 Favored 'General case' 0 CA--C 1.546 0.821 0 O-C-N 121.202 -0.936 . . . . 0.0 110.246 168.691 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 87.7 mt -137.34 118.59 14.57 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 126.803 2.041 . . . . 0.0 109.601 -176.888 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 85.9 m -123.7 139.6 53.83 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.213 1.405 . . . . 0.0 111.307 -178.268 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 50.84 -123.88 18.31 Favored Glycine 0 N--CA 1.473 1.14 0 C-N-CA 124.693 1.14 . . . . 0.0 114.582 169.518 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 18.5 m -56.02 -32.74 64.28 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.542 1.137 . . . . 0.0 113.389 178.63 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 1.4 t-80 -72.72 -35.04 67.49 Favored 'General case' 0 CA--C 1.54 0.585 0 O-C-N 120.825 -1.172 . . . . 0.0 111.537 176.711 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 49.8 tp -68.43 -42.1 79.38 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 123.66 0.784 . . . . 0.0 111.474 171.446 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 65.3 t -59.94 -44.07 93.67 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 C-N-CA 123.577 0.751 . . . . 0.0 110.566 173.707 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -63.12 -44.24 96.16 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.52 0.728 . . . . 0.0 112.215 174.842 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.47 -39.87 94.82 Favored 'General case' 0 CA--C 1.537 0.479 0 O-C-N 121.221 -0.924 . . . . 0.0 112.179 175.896 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 37.0 mt -62.71 -41.7 99.28 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 123.612 0.765 . . . . 0.0 111.455 173.748 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 19.7 m-85 -61.42 -40.99 96.42 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-N 119.915 1.234 . . . . 0.0 112.376 171.601 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 77.8 mt -68.22 -42.59 79.59 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.772 0.829 . . . . 0.0 112.816 178.188 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 46.8 t -72.71 -47.43 50.23 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 124.005 0.922 . . . . 0.0 111.608 178.512 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 33.9 t -83.35 -41.37 18.29 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 113.432 0.901 . . . . 0.0 113.432 -170.393 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 70.62 -143.07 36.27 Favored Glycine 0 CA--C 1.53 1.025 0 C-N-CA 124.217 0.913 . . . . 0.0 112.514 -176.943 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -64.67 -18.58 65.09 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 125.234 1.414 . . . . 0.0 113.518 -178.161 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 71.0 mtm180 -60.84 -30.67 70.25 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.664 1.185 . . . . 0.0 114.084 -177.236 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 80.46 142.23 2.98 Favored Glycine 0 CA--C 1.534 1.237 0 C-N-CA 125.57 1.557 . . . . 0.0 113.352 179.628 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 52.7 p90 -129.41 155.85 45.01 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 125.199 1.4 . . . . 0.0 112.579 -177.764 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -85.83 143.67 28.14 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.485 1.114 . . . . 0.0 110.571 171.248 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 65.0 t80 -158.84 130.61 6.52 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.242 1.017 . . . . 0.0 112.732 -179.775 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 98.6 m -144.25 121.95 6.69 Favored Pre-proline 0 N--CA 1.475 0.803 0 C-N-CA 126.302 1.841 . . . . 0.0 108.065 170.09 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_endo -80.83 153.01 19.52 Favored 'Trans proline' 0 N--CA 1.458 -0.617 0 C-N-CA 123.053 2.502 . . . . 0.0 110.548 177.215 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 5.2 tmtt? -67.52 -14.17 62.7 Favored 'General case' 0 CA--C 1.547 0.865 0 N-CA-C 114.081 1.141 . . . . 0.0 114.081 -178.079 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 27.1 p -69.53 -29.18 66.72 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 125.643 1.577 . . . . 0.0 112.44 170.286 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -86.31 -41.33 14.65 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.436 1.094 . . . . 0.0 112.704 177.833 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 60.0 ttt85 . . . . . 0 C--O 1.252 1.187 0 C-N-CA 125.667 1.587 . . . . 0.0 112.23 -176.929 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.737 0 N-CA-C 111.093 -0.803 . . . . 0.0 111.093 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 9.2 tp -53.39 -35.52 24.94 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.335 0 C-N-CA 125.016 1.326 . . . . 0.0 114.544 -169.853 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 16.4 t -62.78 -33.25 59.09 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.888 0 C-N-CA 124.467 1.107 . . . . 0.0 111.72 -178.139 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -70.05 -21.53 63.16 Favored 'General case' 0 CA--C 1.544 0.72 0 O-C-N 121.508 -0.745 . . . . 0.0 112.485 176.946 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 72.0 tp60 -87.56 -59.34 2.28 Favored 'General case' 0 CA--C 1.535 0.375 0 O-C-N 121.516 -0.74 . . . . 0.0 110.025 170.927 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 63.0 m -70.52 -32.37 69.81 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 114.75 1.389 . . . . 0.0 114.75 -169.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 16.5 t -82.91 -53.62 5.71 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 119.523 1.056 . . . . 0.0 110.936 -176.875 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 17.7 m -77.95 -24.39 48.2 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 126.278 1.831 . . . . 0.0 112.655 -174.008 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.4 t -137.77 -167.28 2.11 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.085 1.354 . . . . 0.0 111.364 176.308 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 69.9 mt -86.04 145.26 8.01 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 C-N-CA 124.699 1.199 . . . . 0.0 109.946 175.694 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.0 p -137.83 159.27 42.46 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 114.146 1.165 . . . . 0.0 114.146 171.583 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 87.9 p -117.57 168.31 10.52 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.63 1.572 . . . . 0.0 113.394 -176.452 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 79.0 mt -57.11 -34.03 67.95 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 124.214 1.006 . . . . 0.0 112.78 177.971 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 89.3 t80 -61.43 -32.76 72.73 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.235 1.014 . . . . 0.0 112.583 175.189 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 90.9 mt-30 -82.75 -31.28 28.44 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.815 0.846 . . . . 0.0 111.107 177.699 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 76.1 mt -65.92 -41.35 91.52 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 118.725 0.693 . . . . 0.0 111.55 169.722 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 45.7 mm-40 -60.27 -37.51 80.65 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.911 1.285 . . . . 0.0 112.705 169.724 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.8 t-20 -61.97 -26.22 68.08 Favored 'General case' 0 CA--C 1.55 0.97 0 O-C-N 121.085 -1.009 . . . . 0.0 113.542 -175.829 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 51.5 m-85 -97.26 -2.0 43.6 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 125.267 1.427 . . . . 0.0 113.874 175.561 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 18.7 t -79.72 172.03 14.34 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.861 1.265 . . . . 0.0 111.394 168.826 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 9.1 m-80 . . . . . 0 C--O 1.256 1.407 0 C-N-CA 124.497 1.119 . . . . 0.0 112.494 171.723 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.48 0 CA-C-O 119.17 -0.443 . . . . 0.0 111.367 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 92.3 t -87.43 110.06 20.15 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 CA-C-N 119.513 1.051 . . . . 0.0 109.273 177.932 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 37.3 t30 -162.53 98.66 1.01 Allowed 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 127.312 2.245 . . . . 0.0 107.615 -179.279 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 6.1 tt0 -161.04 170.28 20.83 Favored 'General case' 0 N--CA 1.476 0.826 0 O-C-N 121.542 -0.724 . . . . 0.0 112.119 -166.264 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 31.6 m-70 -73.77 141.93 46.25 Favored 'General case' 0 CA--C 1.549 0.906 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 164.268 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 76.5 mt -145.21 133.55 21.78 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 126.884 2.073 . . . . 0.0 108.733 175.569 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.7 t -146.69 154.52 41.53 Favored 'General case' 0 N--CA 1.471 0.62 0 O-C-N 121.363 -0.836 . . . . 0.0 113.209 -178.814 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 54.99 -133.98 48.18 Favored Glycine 0 N--CA 1.471 0.989 0 C-N-CA 124.436 1.017 . . . . 0.0 113.021 176.612 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 18.4 m -54.36 -36.55 63.97 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.207 1.003 . . . . 0.0 113.028 177.889 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 17.5 t-160 -67.76 -39.05 84.18 Favored 'General case' 0 CA--C 1.544 0.733 0 O-C-N 120.942 -1.099 . . . . 0.0 111.721 179.598 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 39.8 tp -67.62 -42.75 81.87 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 123.569 0.747 . . . . 0.0 111.882 172.017 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 54.2 t -59.99 -43.41 92.41 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 C-N-CA 123.361 0.665 . . . . 0.0 110.867 175.244 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -64.86 -42.42 94.87 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 123.624 0.77 . . . . 0.0 112.4 174.339 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.28 -42.33 98.46 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 119.443 1.02 . . . . 0.0 112.106 174.459 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 51.0 mt -61.91 -43.08 99.57 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.688 0.795 . . . . 0.0 111.489 174.408 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 13.6 m-85 -59.79 -44.09 94.1 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 119.885 1.221 . . . . 0.0 112.329 172.224 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 74.5 mt -66.67 -42.03 87.21 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.829 0.852 . . . . 0.0 112.437 179.875 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 60.1 t -76.24 -49.38 25.27 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 123.359 0.664 . . . . 0.0 111.977 179.818 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 48.5 t -79.13 -39.62 33.11 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 113.014 0.746 . . . . 0.0 113.014 -172.209 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 69.39 -142.03 36.51 Favored Glycine 0 CA--C 1.53 1.016 0 C-N-CA 124.326 0.965 . . . . 0.0 112.296 -179.348 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -64.26 -19.08 65.15 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 125.221 1.408 . . . . 0.0 113.637 -176.658 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 80.3 mtm180 -60.73 -32.87 72.12 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.899 1.28 . . . . 0.0 113.797 -178.368 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 80.52 142.79 3.16 Favored Glycine 0 CA--C 1.534 1.263 0 C-N-CA 125.212 1.387 . . . . 0.0 113.419 -178.491 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 50.8 p90 -129.11 158.43 38.98 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.653 1.581 . . . . 0.0 112.766 -175.518 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 81.7 t80 -83.41 140.75 32.19 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.862 0.865 . . . . 0.0 110.893 169.625 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 65.1 t80 -149.46 142.47 24.86 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.714 1.206 . . . . 0.0 111.723 173.52 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 3.5 m -162.42 131.4 3.05 Favored Pre-proline 0 N--CA 1.478 0.938 0 C-N-CA 127.65 2.38 . . . . 0.0 107.325 173.077 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -72.07 113.09 3.58 Favored 'Trans proline' 0 C--N 1.35 0.656 0 C-N-CA 122.712 2.275 . . . . 0.0 110.239 178.376 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 28.4 tptp -93.2 -55.61 3.26 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.765 0.826 . . . . 0.0 111.574 -179.539 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 25.4 p -100.17 -19.16 16.56 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 126.022 1.729 . . . . 0.0 113.153 176.9 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 26.8 tptp -75.63 -20.2 58.67 Favored 'General case' 0 CA--C 1.553 1.058 0 C-N-CA 124.814 1.246 . . . . 0.0 113.483 174.806 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 51.7 tpt85 . . . . . 0 C--O 1.253 1.275 0 C-N-CA 125.734 1.614 . . . . 0.0 113.292 -178.37 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.408 0 CA-C-O 119.19 -0.784 . . . . 0.0 111.42 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 9.5 tt -177.16 -48.75 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.255 0 C-N-CA 127.812 2.445 . . . . 0.0 111.623 -177.535 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 8.4 p -67.56 -21.92 28.03 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 124.256 1.022 . . . . 0.0 112.445 -174.515 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -64.1 -10.19 20.99 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 125.882 1.673 . . . . 0.0 113.173 171.625 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 11.6 tt0 -113.06 -50.98 2.85 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 126.137 1.775 . . . . 0.0 109.452 168.368 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 61.0 m -67.49 -22.46 65.46 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 115.404 1.631 . . . . 0.0 115.404 -171.249 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 37.2 t -102.58 -33.76 9.35 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 119.398 0.999 . . . . 0.0 113.0 177.436 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 44.5 p -72.35 -34.53 68.08 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 125.211 1.404 . . . . 0.0 111.969 178.694 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 9.1 t -134.05 -161.32 1.13 Allowed 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 126.453 1.901 . . . . 0.0 110.031 172.844 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 66.9 mt -101.86 116.61 45.8 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 C-N-CA 124.628 1.171 . . . . 0.0 108.148 171.223 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 21.7 p -89.58 152.69 21.27 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.294 0.637 . . . . 0.0 111.111 169.777 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 36.9 t -80.61 151.32 29.1 Favored 'General case' 0 N--CA 1.47 0.561 0 O-C-N 120.902 -1.124 . . . . 0.0 112.089 -176.449 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 80.0 mt -57.96 -32.78 68.16 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 121.402 -0.811 . . . . 0.0 111.217 170.268 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 83.4 t80 -64.35 -27.43 69.01 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.053 0.941 . . . . 0.0 113.071 173.654 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 80.2 mt-30 -80.79 -39.0 27.5 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 123.399 0.68 . . . . 0.0 110.551 173.445 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 58.6 mt -57.24 -42.31 81.23 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 119.275 0.943 . . . . 0.0 111.783 172.045 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -60.54 -17.51 46.33 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 114.74 1.385 . . . . 0.0 114.74 174.927 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 14.6 t-20 -70.04 -24.06 63.2 Favored 'General case' 0 CA--C 1.547 0.843 0 CA-C-N 119.878 1.217 . . . . 0.0 112.963 176.014 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 88.4 m-85 -94.01 -2.06 53.59 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.118 1.367 . . . . 0.0 113.805 -177.916 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 82.9 m -70.03 132.2 45.52 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.61 1.164 . . . . 0.0 112.112 177.445 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.253 1.261 0 C-N-CA 128.229 2.611 . . . . 0.0 112.313 -172.447 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 72.1 m-85 . . . . . 0 N--CA 1.486 1.366 0 CA-C-O 119.439 -0.315 . . . . 0.0 110.541 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 7.6 p -161.5 144.99 4.23 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 C-N-CA 124.576 1.15 . . . . 0.0 111.245 -178.726 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 53.1 t30 -85.82 -157.8 0.35 Allowed 'General case' 0 CA--C 1.557 1.224 0 C-N-CA 125.423 1.489 . . . . 0.0 111.029 174.483 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 45.8 mm-40 -135.31 173.08 12.11 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 126.083 1.753 . . . . 0.0 110.792 175.247 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 32.4 m-70 -69.0 133.43 48.13 Favored 'General case' 0 CA--C 1.544 0.72 0 O-C-N 121.647 -0.658 . . . . 0.0 109.988 169.469 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 87.2 mt -133.84 120.47 20.49 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 125.871 1.669 . . . . 0.0 109.843 -176.244 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -121.5 140.04 52.71 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 125.05 1.34 . . . . 0.0 111.988 -179.321 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 52.94 -126.46 33.03 Favored Glycine 0 CA--C 1.53 1.006 0 C-N-CA 124.79 1.186 . . . . 0.0 114.484 169.867 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 20.6 m -56.41 -29.59 61.75 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 124.533 1.133 . . . . 0.0 113.325 178.499 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 29.6 m80 -69.47 -40.68 76.95 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 120.877 -1.139 . . . . 0.0 111.335 176.541 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 49.5 tp -65.9 -43.14 89.1 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.307 1.043 . . . . 0.0 111.153 173.657 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 41.5 t -59.87 -46.24 94.06 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 124.469 1.108 . . . . 0.0 111.188 174.364 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -64.24 -44.0 93.18 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 123.502 0.721 . . . . 0.0 111.404 177.151 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.41 -44.12 92.91 Favored 'General case' 0 CA--C 1.539 0.521 0 O-C-N 121.557 -0.715 . . . . 0.0 111.253 175.896 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 18.1 mt -60.31 -45.34 93.72 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.899 0.879 . . . . 0.0 111.878 175.538 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -57.51 -44.75 85.27 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 119.439 1.018 . . . . 0.0 112.759 174.236 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 10.0 mp -69.69 -41.18 75.78 Favored 'General case' 0 N--CA 1.471 0.575 0 C-N-CA 123.432 0.693 . . . . 0.0 112.454 178.888 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 29.9 t -66.46 -43.53 90.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 124.388 1.075 . . . . 0.0 111.485 178.629 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 71.2 m -72.94 -45.37 58.45 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 118.795 0.725 . . . . 0.0 112.763 -178.586 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.4 -129.68 40.21 Favored Glycine 0 CA--C 1.533 1.198 0 C-N-CA 124.269 0.938 . . . . 0.0 112.0 179.308 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -59.84 -21.16 60.55 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 125.081 1.352 . . . . 0.0 113.557 -179.514 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 83.5 mtm180 -67.94 -16.37 64.03 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.548 1.139 . . . . 0.0 113.841 177.226 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.87 159.93 25.4 Favored Glycine 0 CA--C 1.53 1.006 0 C-N-CA 125.35 1.452 . . . . 0.0 113.35 -179.919 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 68.8 t80 -159.15 148.27 18.48 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.482 1.113 . . . . 0.0 112.346 178.114 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 90.2 t80 -174.82 114.8 0.16 Allowed 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 127.778 2.431 . . . . 0.0 109.624 168.318 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 35.5 t80 -167.84 143.28 3.84 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 126.004 1.722 . . . . 0.0 110.439 178.558 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 10.3 p -103.4 129.21 25.89 Favored Pre-proline 0 N--CA 1.475 0.817 0 C-N-CA 124.825 1.25 . . . . 0.0 112.15 -169.71 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -85.82 150.11 9.81 Favored 'Trans proline' 0 C--N 1.352 0.734 0 C-N-CA 123.762 2.974 . . . . 0.0 111.403 176.178 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 81.7 tttt -60.79 -17.69 50.81 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 124.833 1.253 . . . . 0.0 113.867 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 7.0 m -57.83 -39.92 78.8 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 126.868 2.067 . . . . 0.0 112.52 176.924 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 20.5 pttp -136.46 -0.38 2.42 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 115.813 1.783 . . . . 0.0 115.813 -172.83 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 7.0 tpm_? . . . . . 0 C--O 1.251 1.158 0 C-N-CA 125.027 1.331 . . . . 0.0 111.361 169.49 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.644 0 N-CA-C 111.116 -0.793 . . . . 0.0 111.116 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 15.1 tt -59.16 -31.13 45.31 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 N-CA-C 115.537 1.68 . . . . 0.0 115.537 -169.204 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 4.7 p -59.64 -34.01 53.79 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.248 0 CA-C-N 119.87 1.214 . . . . 0.0 112.562 176.585 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -69.61 -14.71 62.97 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 123.982 0.913 . . . . 0.0 112.648 178.625 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 27.6 tt0 -99.89 -55.69 2.57 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.816 0.846 . . . . 0.0 111.098 171.683 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 59.6 m -59.08 -27.77 65.85 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 114.578 1.325 . . . . 0.0 114.578 -171.78 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 68.2 m -70.44 -29.86 66.56 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 113.641 0.978 . . . . 0.0 113.641 -179.086 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 33.5 p -122.66 -37.57 2.75 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 125.003 1.321 . . . . 0.0 112.781 -170.124 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 50.8 m -100.46 163.99 12.12 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.319 1.447 . . . . 0.0 110.992 171.072 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 16.0 tt -81.46 132.07 32.39 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 O-C-N 121.542 -0.724 . . . . 0.0 109.534 174.865 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 13.9 p -128.2 165.92 19.52 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.6 1.16 . . . . 0.0 111.975 -176.764 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 38.1 t -116.03 151.39 35.6 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 -169.456 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 9.6 mp -58.26 -28.89 65.34 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 123.707 0.803 . . . . 0.0 111.742 169.817 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 87.7 t80 -60.36 -32.37 71.22 Favored 'General case' 0 CA--C 1.541 0.622 0 O-C-N 121.623 -0.673 . . . . 0.0 112.567 171.583 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 56.9 mt-30 -80.49 -35.24 35.01 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 123.953 0.901 . . . . 0.0 111.017 176.676 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 82.4 mt -59.27 -43.12 92.52 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-N 118.459 0.572 . . . . 0.0 111.189 171.294 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -68.5 -33.68 74.57 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 123.675 0.79 . . . . 0.0 112.972 172.779 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 22.7 t-20 -66.22 -33.19 75.2 Favored 'General case' 0 CA--C 1.546 0.801 0 O-C-N 120.606 -1.309 . . . . 0.0 112.356 176.287 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 19.2 m-85 -82.59 -1.46 50.9 Favored 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 125.513 1.525 . . . . 0.0 113.658 171.161 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 10.6 t -86.78 179.5 6.74 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 124.844 1.257 . . . . 0.0 112.17 170.02 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 . . . . . 0 C--O 1.253 1.244 0 C-N-CA 125.578 1.551 . . . . 0.0 113.235 179.776 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 34.0 t80 . . . . . 0 N--CA 1.49 1.557 0 CA-C-O 119.435 -0.317 . . . . 0.0 110.829 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 7.0 p -60.76 -23.96 30.75 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 C-N-CA 124.731 1.212 . . . . 0.0 114.054 -173.742 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 2.9 p30 -137.99 136.65 37.13 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.949 1.3 . . . . 0.0 109.646 167.718 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 5.0 tt0 -169.23 169.31 9.32 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.163 0.985 . . . . 0.0 111.246 -167.336 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 99.6 m-70 -85.12 142.77 29.28 Favored 'General case' 0 CA--C 1.543 0.703 0 O-C-N 121.381 -0.825 . . . . 0.0 108.782 165.5 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 86.0 mt -148.66 132.15 16.7 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 125.827 1.651 . . . . 0.0 109.65 -179.039 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.7 t -145.16 136.09 24.68 Favored 'General case' 0 N--CA 1.469 0.522 0 O-C-N 121.346 -0.846 . . . . 0.0 113.068 -178.348 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 58.56 -122.8 31.2 Favored Glycine 0 N--CA 1.469 0.862 0 C-N-CA 124.564 1.078 . . . . 0.0 112.962 174.795 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 25.8 p -54.36 -34.77 61.83 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.767 1.227 . . . . 0.0 113.281 176.8 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 35.1 m80 -68.49 -40.77 80.78 Favored 'General case' 0 CA--C 1.543 0.708 0 O-C-N 120.909 -1.12 . . . . 0.0 111.599 177.311 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 63.4 tp -67.92 -43.43 79.21 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 123.807 0.843 . . . . 0.0 110.999 175.06 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 44.9 t -59.49 -46.02 93.26 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 124.131 0.973 . . . . 0.0 110.647 174.625 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -63.37 -43.31 97.99 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.524 0.729 . . . . 0.0 111.65 176.179 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.65 -42.89 97.91 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 118.911 0.778 . . . . 0.0 112.192 174.679 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 49.0 mt -62.16 -39.54 92.98 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 118.718 0.69 . . . . 0.0 111.879 175.474 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 30.4 m-85 -67.58 -38.32 83.87 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 119.407 1.003 . . . . 0.0 113.104 172.665 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 75.4 mt -69.33 -44.28 71.99 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 119.295 0.952 . . . . 0.0 112.079 176.943 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 73.9 t -77.54 -41.05 29.02 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 C-N-CA 124.49 1.116 . . . . 0.0 112.171 -177.297 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -139.43 8.77 2.44 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 115.925 1.824 . . . . 0.0 115.925 -168.75 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -61.95 -31.04 77.1 Favored Glycine 0 N--CA 1.476 1.359 0 CA-C-N 120.135 1.334 . . . . 0.0 114.725 -171.654 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -78.48 -33.96 47.88 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 118.198 0.999 . . . . 0.0 112.623 176.97 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 81.2 mtm180 -72.71 -29.01 63.02 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 124.079 0.952 . . . . 0.0 111.806 170.968 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 83.19 109.03 0.5 Allowed Glycine 0 CA--C 1.529 0.911 0 C-N-CA 126.549 2.023 . . . . 0.0 111.196 -179.262 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 50.6 p90 -86.83 145.27 26.67 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.44 0.696 . . . . 0.0 112.209 175.526 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -82.74 -28.57 30.33 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.205 1.002 . . . . 0.0 112.643 -177.176 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 49.6 t80 -66.04 151.63 46.42 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 114.822 1.416 . . . . 0.0 114.822 -171.49 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 49.0 m -138.45 122.48 11.5 Favored Pre-proline 0 CA--C 1.539 0.531 0 C-N-CA 125.957 1.703 . . . . 0.0 107.687 169.029 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 78.3 Cg_exo -56.58 156.92 20.49 Favored 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 123.729 2.953 . . . . 0.0 113.778 177.958 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 58.3 tptt -59.68 -29.89 68.39 Favored 'General case' 0 CA--C 1.549 0.92 0 N-CA-C 113.032 0.753 . . . . 0.0 113.032 173.211 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 21.7 p -81.36 -19.88 41.77 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 126.91 2.084 . . . . 0.0 113.583 173.187 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 54.2 mtmt 71.15 164.35 0.28 Allowed 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 128.814 2.846 . . . . 0.0 114.234 175.546 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 86.8 mtm-85 . . . . . 0 C--O 1.255 1.383 0 C-N-CA 125.464 1.506 . . . . 0.0 111.781 173.618 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.52 0 N-CA-C 111.818 -0.513 . . . . 0.0 111.818 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 12.3 tt -87.72 -28.7 5.53 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 N-CA-C 114.056 1.132 . . . . 0.0 114.056 -175.897 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 9.3 p -63.83 -35.62 73.82 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.265 0 CA-C-N 120.458 1.481 . . . . 0.0 112.566 -177.847 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -72.04 -8.9 57.2 Favored 'General case' 0 CA--C 1.547 0.835 0 N-CA-C 113.471 0.915 . . . . 0.0 113.471 176.262 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 21.7 tt0 -93.73 -58.51 2.24 Favored 'General case' 0 N--CA 1.464 0.246 0 C-N-CA 124.788 1.235 . . . . 0.0 109.083 168.607 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 71.4 m -72.33 -22.3 61.2 Favored 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 114.555 1.317 . . . . 0.0 114.555 -169.945 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 4.7 t -77.51 -18.25 57.21 Favored 'General case' 0 N--CA 1.473 0.72 0 O-C-N 121.453 -0.779 . . . . 0.0 112.471 171.853 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 31.7 m -103.78 -42.56 5.58 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 126.663 1.985 . . . . 0.0 111.463 -173.216 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 67.3 m -124.54 168.7 12.75 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 126.795 2.038 . . . . 0.0 111.856 -179.478 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 31.8 mm -66.54 133.73 30.87 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 O-C-N 120.749 -1.219 . . . . 0.0 109.638 171.224 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.7 m -116.32 158.78 22.88 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 122.645 1.212 . . . . 0.0 113.534 175.614 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 20.9 t -122.43 162.29 21.94 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 126.443 1.897 . . . . 0.0 112.443 -176.244 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.485 ' H ' HD12 ' A' ' 13' ' ' LEU . 5.4 mp -64.12 -32.96 74.71 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 124.707 1.203 . . . . 0.0 111.923 -176.414 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 82.3 t80 -61.67 -30.79 70.96 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 123.701 0.8 . . . . 0.0 112.773 175.828 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 -78.21 -33.92 49.69 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.817 0.847 . . . . 0.0 110.667 176.766 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 90.2 mt -66.49 -46.49 76.11 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 118.644 0.656 . . . . 0.0 111.678 171.47 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 -64.11 -20.87 66.27 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 113.803 1.038 . . . . 0.0 113.803 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.7 t30 -57.01 -28.26 62.31 Favored 'General case' 0 CA--C 1.548 0.878 0 CA-C-N 119.356 0.98 . . . . 0.0 112.978 172.676 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 98.0 m-85 -98.61 -2.78 37.69 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.395 1.478 . . . . 0.0 113.487 178.547 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 12.3 t -84.65 -149.56 0.11 Allowed 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 125.989 1.716 . . . . 0.0 111.025 173.71 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 41.1 m-80 . . . . . 0 C--O 1.255 1.364 0 C-N-CA 127.045 2.138 . . . . 0.0 112.177 176.758 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 50.9 t80 . . . . . 0 N--CA 1.484 1.262 0 CA-C-O 119.627 -0.225 . . . . 0.0 111.019 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 7.1 p -70.18 -38.21 74.02 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.3 0 C-N-CA 124.023 0.929 . . . . 0.0 113.37 -173.541 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -74.23 111.68 9.64 Favored 'General case' 0 CA--C 1.544 0.718 0 N-CA-C 108.218 -1.03 . . . . 0.0 108.218 169.186 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 -170.64 172.34 5.89 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 123.932 0.893 . . . . 0.0 110.965 -165.219 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 95.1 m-70 -68.29 138.83 55.81 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 107.261 -1.385 . . . . 0.0 107.261 163.277 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 92.7 mt -138.2 126.39 22.95 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 125.177 1.391 . . . . 0.0 109.204 -178.334 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 6.3 t -146.42 145.11 30.13 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 123.312 0.645 . . . . 0.0 111.665 -174.651 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 51.92 -128.13 32.97 Favored Glycine 0 N--CA 1.472 1.091 0 C-N-CA 124.457 1.027 . . . . 0.0 112.75 175.822 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 36.2 m -58.73 -31.42 68.27 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 113.275 0.843 . . . . 0.0 113.275 179.277 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -72.05 -36.82 69.71 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 119.16 0.891 . . . . 0.0 111.641 176.571 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 57.5 tp -65.95 -47.29 75.14 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 118.591 0.632 . . . . 0.0 110.74 171.336 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 54.1 t -60.99 -43.76 96.76 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 C-N-CA 123.525 0.73 . . . . 0.0 110.618 -179.724 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -64.4 -46.25 84.11 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.602 0.761 . . . . 0.0 112.056 175.153 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.4 -42.3 99.32 Favored 'General case' 0 CA--C 1.539 0.548 0 O-C-N 121.408 -0.808 . . . . 0.0 111.857 177.5 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 46.0 tp -63.5 -41.22 98.55 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.652 1.181 . . . . 0.0 111.252 177.238 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 7.2 m-85 -60.41 -45.9 91.95 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 119.253 0.933 . . . . 0.0 112.435 169.831 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 72.2 mt -65.94 -43.5 87.86 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 123.305 0.642 . . . . 0.0 112.377 -179.378 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 53.2 t -76.97 -37.77 27.29 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 123.877 0.871 . . . . 0.0 112.327 -177.723 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 44.1 t -77.2 -41.82 39.92 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 118.779 0.718 . . . . 0.0 112.569 177.72 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 73.07 -148.21 40.8 Favored Glycine 0 CA--C 1.529 0.951 0 C-N-CA 124.646 1.117 . . . . 0.0 112.744 179.587 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -62.49 -19.98 64.13 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.257 1.423 . . . . 0.0 113.733 -177.522 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 86.9 mtm180 -57.32 -35.1 69.44 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 125.237 1.415 . . . . 0.0 114.043 179.153 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.07 144.9 2.42 Favored Glycine 0 CA--C 1.532 1.123 0 C-N-CA 125.272 1.415 . . . . 0.0 113.4 -178.148 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 48.0 p90 -113.23 151.2 31.34 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.186 1.395 . . . . 0.0 112.007 177.886 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 37.9 p90 -93.43 -10.09 36.32 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 114.34 1.237 . . . . 0.0 114.34 -178.646 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 74.7 t80 -70.2 148.25 48.84 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.934 1.294 . . . . 0.0 114.283 -177.761 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 85.7 m -127.47 131.2 23.71 Favored Pre-proline 0 N--CA 1.478 0.938 0 C-N-CA 126.389 1.876 . . . . 0.0 107.862 170.231 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -67.2 133.04 29.4 Favored 'Trans proline' 0 C--N 1.351 0.677 0 C-N-CA 122.888 2.392 . . . . 0.0 112.337 -173.14 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 84.0 tttt -66.49 -22.5 66.19 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 124.163 0.985 . . . . 0.0 112.971 177.875 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 34.5 p -81.28 -6.79 59.27 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 127.297 2.239 . . . . 0.0 113.521 171.534 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 57.5 tttm 75.0 -28.49 0.19 Allowed 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 128.679 2.792 . . . . 0.0 114.31 176.784 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 1.4 ttp180 . . . . . 0 C--O 1.252 1.2 0 C-N-CA 128.47 2.708 . . . . 0.0 111.729 176.762 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.622 0 N-CA-C 111.138 -0.785 . . . . 0.0 111.138 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 8.7 tp -51.43 -34.97 15.89 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.202 0 C-N-CA 125.761 1.624 . . . . 0.0 114.114 -170.567 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 5.7 p -62.58 -29.67 47.44 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 C-N-CA 123.556 0.742 . . . . 0.0 112.89 -179.522 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -76.86 -8.24 56.97 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 119.566 1.075 . . . . 0.0 112.855 179.188 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 79.7 mm-40 -97.19 -59.95 1.68 Allowed 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.985 0.914 . . . . 0.0 108.869 169.039 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 94.5 m -69.09 -29.03 67.04 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 114.923 1.453 . . . . 0.0 114.923 -170.538 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 7.9 t -80.65 -43.26 20.73 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 119.392 0.996 . . . . 0.0 111.03 176.847 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 23.2 m -68.97 -38.14 79.19 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 127.011 2.124 . . . . 0.0 112.917 -175.966 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.4 t -146.79 -172.04 3.89 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.949 1.299 . . . . 0.0 111.146 179.459 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 50.1 mt -76.64 124.0 34.11 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 O-C-N 120.893 -1.129 . . . . 0.0 109.0 170.72 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 23.8 p -103.25 157.76 16.79 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.062 0.945 . . . . 0.0 111.453 170.635 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 34.4 t -92.8 156.21 17.14 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.57 0.748 . . . . 0.0 111.847 179.687 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 59.2 mt -58.4 -29.36 66.01 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 123.398 0.679 . . . . 0.0 111.719 172.684 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.3 t80 -62.84 -33.04 74.41 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 113.16 0.8 . . . . 0.0 113.16 172.289 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 60.6 mm-40 -77.02 -34.55 57.33 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 123.281 0.633 . . . . 0.0 110.721 175.919 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 95.6 mt -65.1 -44.37 89.05 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 118.552 0.614 . . . . 0.0 111.186 171.772 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.422 ' HA ' ' SG ' ' A' ' 20' ' ' CYS . 24.6 mt-10 -63.85 -25.5 68.19 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 113.907 1.077 . . . . 0.0 113.907 175.929 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 -63.05 -21.25 66.04 Favored 'General case' 0 CA--C 1.547 0.832 0 CA-C-N 119.14 0.882 . . . . 0.0 112.87 175.944 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 73.7 m-85 -102.01 -0.21 34.02 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.161 1.384 . . . . 0.0 114.389 177.024 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.422 ' SG ' ' HA ' ' A' ' 17' ' ' GLU . 67.4 m -65.31 144.75 56.93 Favored 'General case' 0 CA--C 1.544 0.746 0 CA-C-N 119.373 0.988 . . . . 0.0 110.473 169.132 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 21.4 t-20 . . . . . 0 C--O 1.255 1.347 0 C-N-CA 124.867 1.267 . . . . 0.0 113.105 -175.643 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 68.5 t80 . . . . . 0 N--CA 1.484 1.23 0 CA-C-O 119.931 -0.081 . . . . 0.0 110.898 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 16.9 m -67.66 148.82 11.78 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.025 0 C-N-CA 124.181 0.993 . . . . 0.0 112.566 -178.422 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 42.9 54.9 4.6 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 126.123 1.769 . . . . 0.0 114.483 174.696 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 3.1 mm-40 -145.54 -177.21 5.45 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.963 1.705 . . . . 0.0 110.832 -175.258 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 27.6 m-70 -64.48 131.21 46.47 Favored 'General case' 0 CA--C 1.546 0.809 0 O-C-N 121.312 -0.868 . . . . 0.0 109.836 168.238 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 78.4 mt -141.77 127.02 18.6 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 126.2 1.8 . . . . 0.0 109.07 -177.79 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.7 t -145.14 143.43 30.35 Favored 'General case' 0 N--CA 1.472 0.653 0 O-C-N 121.357 -0.839 . . . . 0.0 112.327 -175.322 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 56.68 -127.43 44.24 Favored Glycine 0 CA--C 1.531 1.081 0 C-N-CA 124.165 0.888 . . . . 0.0 113.252 175.293 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 31.6 p -56.82 -33.7 67.0 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.731 1.213 . . . . 0.0 113.706 177.277 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 19.1 t-160 -70.89 -37.32 73.01 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 121.119 -0.988 . . . . 0.0 111.576 176.377 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 43.1 tp -69.97 -41.68 74.14 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 123.78 0.832 . . . . 0.0 111.747 172.907 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 37.8 t -58.16 -46.14 88.52 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 C-N-CA 124.152 0.981 . . . . 0.0 110.472 172.812 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -64.48 -42.61 95.79 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.829 0.852 . . . . 0.0 112.219 176.517 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.35 -40.69 95.2 Favored 'General case' 0 CA--C 1.538 0.516 0 O-C-N 121.347 -0.846 . . . . 0.0 112.14 174.477 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 47.8 mt -65.16 -39.06 92.43 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.522 -0.736 . . . . 0.0 112.047 174.896 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 15.7 m-85 -59.56 -44.3 93.33 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 119.568 1.076 . . . . 0.0 112.037 170.052 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 80.8 mt -68.9 -43.2 75.73 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.95 0.9 . . . . 0.0 112.62 179.615 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 42.2 t -72.29 -48.23 49.38 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 124.204 1.002 . . . . 0.0 111.821 -179.048 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 84.6 m -77.54 -34.39 53.91 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 121.432 -0.793 . . . . 0.0 113.0 -177.344 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 65.02 -132.26 36.57 Favored Glycine 0 CA--C 1.527 0.821 0 C-N-CA 124.06 0.838 . . . . 0.0 111.748 179.079 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -63.12 -20.16 65.11 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 124.533 1.133 . . . . 0.0 113.257 178.874 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 85.3 mtm180 -63.83 -35.32 80.23 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.795 0.838 . . . . 0.0 113.022 179.127 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.53 179.14 34.37 Favored Glycine 0 CA--C 1.537 1.452 0 C-N-CA 124.488 1.042 . . . . 0.0 112.9 -169.868 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 46.6 p90 -158.29 169.47 24.41 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 125.416 1.486 . . . . 0.0 113.658 -172.572 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 69.6 t80 -121.85 112.95 18.97 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.302 1.441 . . . . 0.0 110.252 173.093 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 45.7 t80 -74.93 138.22 42.21 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 123.552 0.741 . . . . 0.0 111.739 177.814 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 23.2 p -128.09 108.03 19.87 Favored Pre-proline 0 N--CA 1.478 0.957 0 C-N-CA 124.375 1.07 . . . . 0.0 111.825 179.507 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 31.0 Cg_exo -66.85 171.06 11.6 Favored 'Trans proline' 0 CA--C 1.538 0.681 0 C-N-CA 124.237 3.291 . . . . 0.0 112.072 168.853 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 60.4 tttp -73.79 -27.4 61.12 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 112.847 0.684 . . . . 0.0 112.847 169.635 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 23.7 p -75.22 -34.77 61.5 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 125.682 1.593 . . . . 0.0 113.08 -176.512 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 51.3 mtpt -78.97 133.33 36.87 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 123.374 0.67 . . . . 0.0 111.622 177.451 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 7.1 tpm_? . . . . . 0 C--O 1.252 1.235 0 C-N-CA 127.072 2.149 . . . . 0.0 111.196 -173.753 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.777 0 N-CA-C 112.423 -0.271 . . . . 0.0 112.423 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 10.8 tp -59.86 -33.71 53.49 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 O-C-N 121.487 -1.007 . . . . 0.0 113.516 -172.287 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 58.2 t -68.64 -23.89 28.41 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 C-N-CA 123.71 0.804 . . . . 0.0 112.241 179.064 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -80.74 -46.47 15.42 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.639 -0.663 . . . . 0.0 110.063 168.909 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 13.2 tp60 -68.31 -46.69 69.57 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.191 0.996 . . . . 0.0 112.853 -169.509 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 61.5 m -72.15 -21.13 61.5 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 113.12 0.785 . . . . 0.0 113.12 176.874 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 10.8 t -88.11 -48.62 7.6 Favored 'General case' 0 N--CA 1.467 0.395 0 O-C-N 121.407 -0.808 . . . . 0.0 111.632 -176.821 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 68.2 p -75.75 -22.44 56.5 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 125.03 1.332 . . . . 0.0 113.558 -178.919 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.3 t -150.24 -175.28 5.01 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.652 1.181 . . . . 0.0 111.743 178.19 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 62.4 mt -76.79 134.53 28.6 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 C-N-CA 124.551 1.141 . . . . 0.0 110.019 176.248 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.9 p -126.31 160.63 29.82 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.964 1.306 . . . . 0.0 110.973 170.271 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 90.3 p -110.82 165.36 11.91 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.44 1.096 . . . . 0.0 112.714 -179.103 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 10.2 mp -58.29 -28.34 64.91 Favored 'General case' 0 N--CA 1.473 0.681 0 O-C-N 121.609 -0.682 . . . . 0.0 112.515 173.602 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 78.3 t80 -64.31 -33.92 76.95 Favored 'General case' 0 CA--C 1.542 0.666 0 O-C-N 121.59 -0.694 . . . . 0.0 112.857 172.521 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 65.7 mm-40 -75.66 -24.24 56.36 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.623 0.769 . . . . 0.0 111.984 173.209 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 81.2 mt -75.93 -47.24 26.02 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 119.238 0.926 . . . . 0.0 111.447 172.268 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -65.29 -20.42 66.4 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 113.192 0.812 . . . . 0.0 113.192 177.146 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.5 t30 -54.79 -30.29 56.52 Favored 'General case' 0 CA--C 1.549 0.92 0 CA-C-N 119.144 0.884 . . . . 0.0 113.235 171.732 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 98.2 m-85 -98.18 -2.06 40.72 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.583 1.553 . . . . 0.0 113.646 178.567 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 11.3 t -78.31 169.5 18.16 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.465 1.506 . . . . 0.0 111.533 171.192 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 9.9 m-80 . . . . . 0 C--O 1.252 1.233 0 C-N-CA 124.857 1.263 . . . . 0.0 112.409 173.943 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 67.6 t80 . . . . . 0 N--CA 1.486 1.347 0 CA-C-O 119.681 -0.2 . . . . 0.0 110.697 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 13.0 m -80.71 68.56 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 C-N-CA 125.042 1.337 . . . . 0.0 111.144 177.149 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 39.7 p-10 -156.2 147.9 22.86 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.47 1.508 . . . . 0.0 113.426 -174.49 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 1.6 mm-40 -176.44 177.26 1.49 Allowed 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 126.982 2.113 . . . . 0.0 110.569 -177.551 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 27.0 m-70 -77.44 141.45 39.72 Favored 'General case' 0 CA--C 1.548 0.885 0 O-C-N 120.948 -1.095 . . . . 0.0 109.603 166.458 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 69.8 mt -144.12 135.56 25.77 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 126.521 1.928 . . . . 0.0 109.119 174.141 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 5.5 t -149.33 142.7 25.23 Favored 'General case' 0 N--CA 1.473 0.676 0 O-C-N 121.138 -0.976 . . . . 0.0 112.944 -177.464 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 62.57 -131.1 43.87 Favored Glycine 0 CA--C 1.529 0.941 0 C-N-CA 124.613 1.102 . . . . 0.0 113.321 175.46 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 26.1 p -56.02 -35.26 66.66 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 124.734 1.214 . . . . 0.0 113.026 177.6 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 23.6 m80 -64.48 -42.15 96.06 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.193 0.997 . . . . 0.0 111.613 176.541 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 48.0 tp -70.41 -42.51 71.56 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 123.928 0.891 . . . . 0.0 111.68 176.583 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 55.9 t -60.37 -44.28 95.68 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 123.293 0.637 . . . . 0.0 110.694 174.829 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -64.45 -43.09 95.35 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.819 0.848 . . . . 0.0 111.999 175.343 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.37 -44.01 96.02 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 118.609 0.64 . . . . 0.0 111.684 174.449 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 31.8 mt -59.9 -43.67 94.68 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 118.87 0.759 . . . . 0.0 111.345 175.606 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 20.8 m-85 -60.59 -44.87 95.76 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 119.131 0.878 . . . . 0.0 112.624 173.546 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 81.3 mt -69.36 -43.92 72.62 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 123.694 0.797 . . . . 0.0 112.493 -179.502 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 69.6 t -78.03 -40.92 26.9 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 124.766 1.226 . . . . 0.0 111.796 -174.074 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 48.7 t -78.19 -41.43 34.58 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 118.781 0.718 . . . . 0.0 112.282 176.459 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 72.25 -146.83 39.96 Favored Glycine 0 CA--C 1.531 1.064 0 C-N-CA 124.325 0.964 . . . . 0.0 112.741 178.524 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -60.79 -21.1 62.75 Favored 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 125.465 1.506 . . . . 0.0 113.561 -176.663 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 89.1 mtm180 -56.8 -36.12 69.53 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.968 1.307 . . . . 0.0 113.029 175.889 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 80.07 140.71 2.41 Favored Glycine 0 CA--C 1.534 1.273 0 C-N-CA 125.352 1.453 . . . . 0.0 112.935 -178.482 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 38.7 p90 -119.04 162.91 17.78 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.819 1.248 . . . . 0.0 112.258 179.857 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 4.1 t80 -145.31 85.1 1.71 Allowed 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.891 1.276 . . . . 0.0 109.452 175.373 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -78.4 169.4 18.31 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 115.614 1.709 . . . . 0.0 115.614 -173.089 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 87.7 m -106.31 100.92 32.18 Favored Pre-proline 0 N--CA 1.476 0.857 0 C-N-CA 125.572 1.549 . . . . 0.0 109.53 173.824 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -92.55 143.55 2.44 Favored 'Trans proline' 0 C--N 1.35 0.647 0 C-N-CA 123.406 2.738 . . . . 0.0 113.162 -177.959 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt 70.78 -45.89 0.62 Allowed 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 128.801 2.84 . . . . 0.0 115.761 168.607 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 10.9 t -176.08 -143.88 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 128.895 2.878 . . . . 0.0 107.268 -170.037 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -63.49 148.42 48.7 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 124.949 1.3 . . . . 0.0 112.148 172.339 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 81.3 mtt180 . . . . . 0 C--O 1.252 1.201 0 C-N-CA 124.609 1.164 . . . . 0.0 112.624 178.623 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.765 0 N-CA-C 111.952 -0.459 . . . . 0.0 111.952 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 11.2 tp -58.73 -38.52 72.45 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.174 0 N-CA-C 114.25 1.204 . . . . 0.0 114.25 -169.958 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 47.9 t -62.24 -35.66 70.31 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.134 0 CA-C-N 118.624 0.647 . . . . 0.0 111.334 176.267 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -76.67 -7.66 55.73 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.463 1.105 . . . . 0.0 112.91 -179.454 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 35.9 tp60 -103.01 -57.52 2.03 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.935 1.294 . . . . 0.0 109.861 173.941 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 83.4 m -74.34 -25.55 59.61 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 115.16 1.541 . . . . 0.0 115.16 -169.522 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 72.3 m -77.24 -23.31 51.32 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 119.373 0.988 . . . . 0.0 113.019 -179.692 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 18.0 p -114.09 -48.13 2.91 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 125.966 1.707 . . . . 0.0 111.747 -171.315 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 73.2 m -96.67 169.91 9.56 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.505 1.522 . . . . 0.0 111.437 172.087 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 61.8 mt -77.69 130.1 36.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 O-C-N 120.939 -1.101 . . . . 0.0 109.034 172.964 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.3 m -97.56 155.81 16.79 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 122.343 1.068 . . . . 0.0 112.756 173.223 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 90.5 p -118.33 162.76 17.76 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 126.665 1.986 . . . . 0.0 110.996 177.504 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 58.3 mt -62.55 -28.13 69.65 Favored 'General case' 0 CA--C 1.536 0.437 0 O-C-N 121.884 -0.51 . . . . 0.0 111.797 175.484 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 89.4 t80 -65.01 -38.87 92.34 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 123.795 0.838 . . . . 0.0 112.766 172.204 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -72.74 -28.37 62.59 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 123.074 0.55 . . . . 0.0 112.011 175.631 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 86.3 mt -72.39 -44.63 62.22 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-N 118.531 0.605 . . . . 0.0 111.971 169.89 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.0 mm-40 -55.38 -38.4 68.82 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.041 1.336 . . . . 0.0 112.569 172.394 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 -60.09 -22.55 62.9 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 113.554 0.946 . . . . 0.0 113.554 177.351 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 18.7 m-85 -103.39 1.69 32.93 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.672 1.589 . . . . 0.0 114.288 175.982 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 86.4 m -71.97 154.22 41.32 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 120.566 -1.334 . . . . 0.0 111.765 169.07 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 21.4 t-20 . . . . . 0 C--O 1.254 1.313 0 C-N-CA 124.496 1.118 . . . . 0.0 112.933 176.98 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . 0.251 23.4 p90 . . . . . 0 N--CA 1.488 1.448 0 CA-C-O 118.249 -0.881 . . . . 0.0 111.209 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 18.6 m -69.7 161.62 4.33 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.281 0 CA-C-N 120.569 1.532 . . . . 0.0 111.98 170.66 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 8.5 p-10 -55.46 135.85 50.2 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.735 1.214 . . . . 0.0 112.401 171.837 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -166.73 163.23 16.57 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 124.991 1.316 . . . . 0.0 110.979 -169.344 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 98.4 m-70 -69.77 136.47 50.92 Favored 'General case' 0 CA--C 1.545 0.778 0 O-C-N 121.224 -0.922 . . . . 0.0 110.385 168.663 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 72.4 mt -140.67 131.45 25.8 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 124.808 1.243 . . . . 0.0 109.518 -177.472 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.6 t -145.6 147.18 31.78 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -176.71 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 56.1 -123.52 31.33 Favored Glycine 0 CA--C 1.528 0.873 0 C-N-CA 124.742 1.163 . . . . 0.0 113.174 172.441 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 23.8 p -55.85 -41.38 74.24 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.299 1.04 . . . . 0.0 112.986 176.263 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 14.7 m-70 -70.28 -32.21 69.91 Favored 'General case' 0 CA--C 1.541 0.63 0 O-C-N 120.682 -1.261 . . . . 0.0 112.575 178.619 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 46.5 tp -68.14 -41.18 82.04 Favored 'General case' 0 N--CA 1.471 0.59 0 O-C-N 121.581 -0.699 . . . . 0.0 111.003 171.221 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 25.5 t -61.57 -45.74 98.01 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 C-N-CA 124.23 1.012 . . . . 0.0 110.774 173.321 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -59.59 -46.29 89.37 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 123.97 0.908 . . . . 0.0 111.652 174.299 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.89 -41.32 99.38 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 121.505 -0.747 . . . . 0.0 112.215 178.372 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 73.6 mt -64.18 -41.25 97.18 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 118.768 -0.634 . . . . 0.0 111.521 174.542 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 -59.31 -44.55 92.55 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-N 119.798 1.181 . . . . 0.0 112.286 171.0 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 67.8 mt -67.16 -42.28 84.59 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.172 0.989 . . . . 0.0 112.965 -179.636 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 53.8 t -74.93 -49.39 29.03 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 123.419 0.688 . . . . 0.0 111.659 178.975 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 58.1 m -78.03 -33.46 51.06 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 113.267 0.84 . . . . 0.0 113.267 -172.352 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 64.8 -135.33 38.02 Favored Glycine 0 CA--C 1.53 1.006 0 C-N-CA 124.024 0.821 . . . . 0.0 112.125 179.095 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -62.05 -23.21 66.34 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 124.539 1.136 . . . . 0.0 113.554 -178.423 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 88.2 mtm180 -59.79 -38.29 81.48 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.087 0.955 . . . . 0.0 112.876 176.893 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 76.78 178.22 46.12 Favored Glycine 0 CA--C 1.533 1.215 0 C-N-CA 124.12 0.867 . . . . 0.0 112.117 -168.606 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 54.4 p90 -141.41 157.46 45.15 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 113.898 1.073 . . . . 0.0 113.898 -171.612 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -96.42 158.36 15.47 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 126.304 1.841 . . . . 0.0 108.943 167.93 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 26.2 t80 -148.1 143.77 27.38 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 121.403 -0.811 . . . . 0.0 111.906 -173.861 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 18.6 m -141.33 115.54 7.0 Favored Pre-proline 0 N--CA 1.475 0.82 0 C-N-CA 124.725 1.21 . . . . 0.0 109.676 179.592 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -83.55 166.06 13.88 Favored 'Trans proline' 0 CA--C 1.538 0.701 0 C-N-CA 124.316 3.344 . . . . 0.0 111.97 179.496 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 40.6 ttpt -68.82 -32.21 71.75 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 123.692 0.797 . . . . 0.0 112.667 170.628 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 16.7 p -127.9 -77.01 0.57 Allowed 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 126.904 2.082 . . . . 0.0 110.314 -177.885 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 15.0 ttpp -162.96 168.35 21.26 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 126.524 1.93 . . . . 0.0 111.275 -177.398 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 1.6 mmp_? . . . . . 0 C--O 1.254 1.304 0 C-N-CA 126.447 1.899 . . . . 0.0 110.61 168.801 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.652 0 N-CA-C 111.719 -0.553 . . . . 0.0 111.719 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.526 HG22 ' H ' ' B' ' 27' ' ' THR . 8.3 tt -56.88 -34.4 43.92 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.141 0 C-N-CA 124.447 1.099 . . . . 0.0 113.63 -172.364 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 55.6 t -62.52 -30.51 49.33 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 CA-C-N 119.069 0.85 . . . . 0.0 111.176 178.862 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -69.5 -36.89 76.9 Favored 'General case' 0 CA--C 1.541 0.608 0 O-C-N 120.813 -1.18 . . . . 0.0 111.009 174.94 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 19.8 tp60 -77.73 -36.47 50.85 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.757 0.823 . . . . 0.0 112.219 -179.754 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 56.2 m -97.47 -27.26 14.52 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 115.069 1.507 . . . . 0.0 115.069 -175.85 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 22.8 t -102.01 -58.0 1.96 Allowed 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 120.006 1.275 . . . . 0.0 111.964 -176.927 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 15.5 m -65.8 -55.62 16.21 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 124.413 1.085 . . . . 0.0 109.498 177.32 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 74.8 m -89.89 176.0 6.99 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 124.112 0.965 . . . . 0.0 111.035 167.329 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 11.3 tt -92.65 147.09 5.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 124.033 0.933 . . . . 0.0 110.466 171.453 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.6 p -130.3 154.73 47.32 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 114.034 1.124 . . . . 0.0 114.034 176.643 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 47.0 t -92.95 153.94 18.47 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.698 1.599 . . . . 0.0 112.824 178.59 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 10.8 mp -59.36 -28.49 66.91 Favored 'General case' 0 N--CA 1.47 0.548 0 O-C-N 121.321 -0.862 . . . . 0.0 111.824 172.214 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.8 t80 -60.85 -36.22 78.57 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 121.466 -0.772 . . . . 0.0 112.529 170.647 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -76.22 -37.5 57.66 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 123.809 0.844 . . . . 0.0 110.392 177.637 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 93.7 mt -59.48 -43.13 93.35 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 123.288 0.635 . . . . 0.0 111.539 172.708 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -67.64 -33.05 74.19 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 113.412 0.894 . . . . 0.0 113.412 172.578 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 -70.59 -27.48 64.14 Favored 'General case' 0 CA--C 1.544 0.749 0 CA-C-N 119.652 1.115 . . . . 0.0 113.504 177.04 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 17.2 m-85 -79.0 -5.38 53.77 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 124.069 0.948 . . . . 0.0 113.482 169.351 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 2.8 t -82.04 168.35 17.89 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.785 1.234 . . . . 0.0 112.367 171.065 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.251 1.177 0 C-N-CA 125.34 1.456 . . . . 0.0 113.0 -174.303 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 65.6 m-85 . . . . . 0 N--CA 1.487 1.416 0 CA-C-O 119.642 -0.218 . . . . 0.0 110.525 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 26.8 t -84.97 115.76 27.37 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 N-CA-C 106.742 -1.577 . . . . 0.0 106.742 168.689 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -154.89 146.25 22.98 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.352 1.061 . . . . 0.0 112.92 -169.554 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 29.3 tt0 -158.62 160.36 36.45 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.13 0.972 . . . . 0.0 111.144 -169.831 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 70.7 m-70 -86.56 128.74 35.0 Favored 'General case' 0 CA--C 1.545 0.762 0 O-C-N 121.509 -0.745 . . . . 0.0 110.578 168.89 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 66.3 mt -143.03 133.91 25.44 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 126.604 1.962 . . . . 0.0 109.582 -173.224 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -137.76 140.08 40.44 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 123.89 0.876 . . . . 0.0 112.24 -172.074 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 52.94 -123.35 24.07 Favored Glycine 0 N--CA 1.474 1.171 0 C-N-CA 124.387 0.994 . . . . 0.0 114.39 169.536 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 25.2 p -58.64 -36.38 74.01 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.174 0.989 . . . . 0.0 113.119 177.109 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 93.3 m-70 -66.87 -36.83 83.2 Favored 'General case' 0 CA--C 1.54 0.559 0 O-C-N 120.739 -1.225 . . . . 0.0 111.791 175.001 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 40.2 tp -67.97 -41.75 81.9 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 123.721 0.808 . . . . 0.0 111.753 173.506 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 50.9 t -59.44 -47.67 89.88 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.137 0 C-N-CA 124.329 1.051 . . . . 0.0 111.038 172.808 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -63.57 -40.45 97.0 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 123.116 0.567 . . . . 0.0 112.042 176.336 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.1 -42.65 99.64 Favored 'General case' 0 CA--C 1.534 0.342 0 O-C-N 121.273 -0.892 . . . . 0.0 112.292 174.807 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 49.2 mt -58.94 -43.1 91.15 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 118.887 0.767 . . . . 0.0 111.566 174.925 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 23.7 m-85 -61.19 -47.29 86.81 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 118.479 0.581 . . . . 0.0 112.319 172.641 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 72.3 mt -68.85 -42.29 77.3 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.587 0.755 . . . . 0.0 112.807 -177.713 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 74.0 t -79.17 -41.79 23.21 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 C-N-CA 124.403 1.081 . . . . 0.0 111.821 -173.905 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 21.7 t -85.8 -33.2 21.43 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 113.809 1.04 . . . . 0.0 113.809 178.607 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 83.84 -153.78 30.08 Favored Glycine 0 CA--C 1.53 1.023 0 C-N-CA 124.468 1.032 . . . . 0.0 112.464 -174.768 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -68.56 -7.34 31.76 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 115.296 1.591 . . . . 0.0 115.296 -172.815 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 85.0 mtm180 -58.96 -36.58 75.05 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 124.906 1.282 . . . . 0.0 113.29 -178.579 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 86.48 147.16 10.5 Favored Glycine 0 CA--C 1.534 1.273 0 C-N-CA 125.2 1.381 . . . . 0.0 113.748 175.085 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 54.0 p90 -138.72 175.2 9.76 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.96 1.704 . . . . 0.0 112.594 -170.714 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -136.65 109.71 7.72 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.12 1.368 . . . . 0.0 109.236 169.46 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -88.68 149.72 23.36 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 113.215 0.82 . . . . 0.0 113.215 -179.292 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 27' ' ' THR . . . . . 0.526 ' H ' HG22 ' A' ' 2' ' ' ILE . 19.0 p -120.39 73.25 21.15 Favored Pre-proline 0 N--CA 1.475 0.79 0 C-N-CA 125.868 1.667 . . . . 0.0 112.543 -172.356 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_endo -72.12 144.84 43.03 Favored 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 123.338 2.692 . . . . 0.0 110.789 169.48 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 70.3 tttt -72.63 -10.24 59.56 Favored 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 124.046 0.938 . . . . 0.0 113.517 -175.883 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 30.1 p -82.9 -20.01 36.24 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 126.589 1.955 . . . . 0.0 114.199 -176.639 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 62.1 pttt -149.27 29.07 0.8 Allowed 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 114.7 1.37 . . . . 0.0 114.7 -170.344 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 2.9 mpt_? . . . . . 0 N--CA 1.482 1.161 0 C-N-CA 126.47 1.908 . . . . 0.0 110.386 169.087 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.433 0 N-CA-C 112.015 -0.434 . . . . 0.0 112.015 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 16.6 tt -81.34 -28.69 10.62 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 N-CA-C 113.954 1.094 . . . . 0.0 113.954 -175.522 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 23.5 t -61.08 -39.97 84.13 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.062 0 CA-C-N 118.924 0.784 . . . . 0.0 110.408 -177.962 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -64.7 -16.62 63.15 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 126.07 1.748 . . . . 0.0 113.138 176.551 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 40.2 tt0 -90.68 -59.58 2.14 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 123.535 0.734 . . . . 0.0 109.247 168.964 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 76.0 m -55.91 -35.39 66.52 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 114.612 1.338 . . . . 0.0 114.612 -171.379 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 74.1 m -81.29 -20.8 40.07 Favored 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 113.885 1.068 . . . . 0.0 113.885 -178.967 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 38.3 m -114.83 -36.9 4.34 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 124.886 1.275 . . . . 0.0 112.534 -168.406 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 7.6 t -125.61 -164.91 1.35 Allowed 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 126.207 1.803 . . . . 0.0 109.911 171.343 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 13.9 tt -86.36 145.9 7.12 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.676 0 C-N-CA 124.387 1.075 . . . . 0.0 110.79 174.528 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 13.7 p -137.08 156.1 48.82 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.144 0.978 . . . . 0.0 112.334 174.389 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 14.5 m -107.24 149.21 28.0 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 113.953 1.094 . . . . 0.0 113.953 -167.749 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 27.4 mt -61.45 -29.93 70.26 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 121.272 -0.892 . . . . 0.0 111.696 174.959 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 91.7 t80 -59.95 -30.87 69.37 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.304 1.441 . . . . 0.0 113.05 170.693 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 59.1 mt-30 -80.88 -36.26 31.54 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 123.617 0.767 . . . . 0.0 110.921 174.731 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 59.7 mt -62.69 -40.54 97.46 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 118.656 0.662 . . . . 0.0 112.354 173.478 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 26.8 mt-10 -60.29 -20.38 58.86 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 114.814 1.413 . . . . 0.0 114.814 175.204 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 26.6 t30 -59.69 -27.39 66.38 Favored 'General case' 0 CA--C 1.546 0.813 0 CA-C-N 119.579 1.081 . . . . 0.0 112.723 174.343 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 76.9 m-85 -100.8 -0.06 37.78 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.331 1.452 . . . . 0.0 114.293 -174.495 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 65.8 m -75.18 126.59 31.33 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.431 0.692 . . . . 0.0 111.822 176.503 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.252 1.228 0 C-N-CA 129.169 2.988 . . . . 0.0 112.154 -171.925 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 5.9 p90 . . . . . 0 N--CA 1.483 1.221 0 N-CA-C 111.587 0.217 . . . . 0.0 111.587 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 72.3 t -90.26 146.51 6.1 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.222 0 C-N-CA 124.874 1.27 . . . . 0.0 109.503 171.333 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 53.1 p-10 -149.89 151.32 33.24 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 124.761 1.224 . . . . 0.0 113.568 -178.983 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 2.9 mm-40 -163.71 172.23 14.49 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.359 1.464 . . . . 0.0 111.944 -170.075 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 99.8 m-70 -90.62 135.05 33.95 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.615 1.166 . . . . 0.0 109.905 168.523 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 78.6 mt -149.41 139.44 22.06 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 124.775 1.23 . . . . 0.0 110.359 -174.607 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 2.4 t -151.57 152.36 32.8 Favored 'General case' 0 C--O 1.237 0.402 0 O-C-N 121.072 -1.018 . . . . 0.0 113.405 177.029 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 56.31 -128.1 45.22 Favored Glycine 0 CA--C 1.53 0.988 0 C-N-CA 124.738 1.161 . . . . 0.0 113.743 171.602 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 29.6 p -57.29 -37.53 72.57 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 124.36 1.064 . . . . 0.0 112.91 177.38 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 66.9 m-70 -72.31 -29.03 63.47 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 119.589 1.086 . . . . 0.0 113.027 176.665 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 50.8 tp -72.08 -45.27 61.35 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 119.035 0.834 . . . . 0.0 110.926 170.51 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 45.1 t -58.59 -40.91 80.55 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.159 0 C-N-CA 124.205 1.002 . . . . 0.0 111.231 174.184 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 13' ' ' GLU . . . . . 0.409 ' HA ' ' CE2' ' B' ' 16' ' ' TYR . 39.9 tt0 -61.25 -46.38 90.6 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 125.234 1.414 . . . . 0.0 112.036 171.092 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.23 -41.36 96.73 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 121.55 -0.719 . . . . 0.0 111.799 176.637 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -55.96 -51.98 65.79 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 119.138 0.881 . . . . 0.0 110.728 172.011 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 16' ' ' TYR . . . . . 0.409 ' CE2' ' HA ' ' B' ' 13' ' ' GLU 0.265 1.0 OUTLIER -69.47 -29.41 67.06 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 113.819 1.044 . . . . 0.0 113.819 -177.718 . . . . . . . . 4 4 . 1 . 017 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 82.4 mt -74.33 -41.74 60.6 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.161 0.984 . . . . 0.0 112.551 173.931 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 38.8 t -67.84 -47.91 77.56 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 C-N-CA 123.698 0.799 . . . . 0.0 110.786 177.81 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 86.2 m -73.75 -39.12 64.45 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 112.682 0.623 . . . . 0.0 112.682 -177.619 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.25 -129.0 40.06 Favored Glycine 0 CA--C 1.528 0.876 0 C-N-CA 123.913 0.768 . . . . 0.0 111.687 -179.624 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -60.37 -23.97 64.73 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.905 1.282 . . . . 0.0 113.182 177.527 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 85.3 mtm180 -65.39 -30.15 70.94 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.042 0.937 . . . . 0.0 113.248 178.738 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.89 175.99 11.76 Favored Glycine 0 CA--C 1.536 1.372 0 C-N-CA 124.889 1.233 . . . . 0.0 113.164 -173.766 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 15.9 p90 -143.15 161.12 39.05 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.759 1.224 . . . . 0.0 111.669 174.448 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 9.0 t80 -127.78 -13.7 5.23 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 113.822 1.045 . . . . 0.0 113.822 -176.115 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 88.3 t80 -61.18 127.12 29.99 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 124.198 0.999 . . . . 0.0 113.622 -179.569 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 12.2 p -92.49 128.71 43.39 Favored Pre-proline 0 CA--C 1.54 0.569 0 C-N-CA 125.466 1.507 . . . . 0.0 110.212 174.539 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_endo -67.38 131.47 24.91 Favored 'Trans proline' 0 C--N 1.35 0.655 0 C-N-CA 123.273 2.649 . . . . 0.0 111.421 -169.94 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 96.8 mttt 63.46 -2.25 0.5 Allowed 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 126.787 2.035 . . . . 0.0 114.281 -179.028 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 85.0 m -111.77 -46.87 3.2 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 126.268 1.827 . . . . 0.0 111.376 -169.765 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 81.4 tttt 76.57 134.56 0.06 Allowed 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 128.264 2.626 . . . . 0.0 112.482 -178.133 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.254 1.339 0 C-N-CA 125.011 1.324 . . . . 0.0 114.497 -174.463 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.811 0 N-CA-C 111.349 -0.7 . . . . 0.0 111.349 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 44.6 pt -66.44 -19.36 25.56 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.061 0 N-CA-C 115.5 1.667 . . . . 0.0 115.5 -169.2 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' VAL . . . . . 0.648 HG21 ' HA ' ' B' ' 28' ' ' PRO . 75.2 t -56.07 -35.98 43.44 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.313 0 CA-C-N 120.462 1.483 . . . . 0.0 111.193 178.23 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 18.4 tt0 -70.81 -17.92 62.75 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 123.735 0.814 . . . . 0.0 112.769 179.102 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 37.5 tt0 -88.69 -51.76 5.5 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 124.816 1.246 . . . . 0.0 109.434 168.826 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 88.5 m -55.92 -38.77 70.72 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.444 1.098 . . . . 0.0 112.747 -176.231 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 96.0 m -76.14 -27.87 57.19 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 113.74 1.015 . . . . 0.0 113.74 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 82.0 p -102.95 -22.85 13.77 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 124.829 1.252 . . . . 0.0 113.161 -172.783 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 10.6 t -151.2 -166.2 2.46 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.289 1.836 . . . . 0.0 110.371 -174.868 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 56.7 mt -81.1 139.36 18.17 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 O-C-N 120.448 -1.407 . . . . 0.0 110.594 174.658 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 11.8 p -133.81 161.08 35.72 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 124.532 1.133 . . . . 0.0 111.207 168.628 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 24.2 p -103.1 159.28 15.67 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 113.669 0.989 . . . . 0.0 113.669 -171.552 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 56.4 mt -68.04 -27.46 66.55 Favored 'General case' 0 CA--C 1.537 0.451 0 O-C-N 121.193 -0.942 . . . . 0.0 111.86 174.805 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.9 t80 -66.05 -34.03 77.14 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 123.595 0.758 . . . . 0.0 112.766 171.471 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 70.1 mt-30 -67.12 -43.29 82.81 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 118.834 -0.603 . . . . 0.0 110.804 170.704 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 36.9 mt -58.65 -45.9 88.3 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 118.932 0.787 . . . . 0.0 111.852 175.502 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 11.3 tt0 -65.47 -23.01 66.81 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 113.78 1.03 . . . . 0.0 113.78 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 13.8 t-20 -62.55 -22.4 66.3 Favored 'General case' 0 CA--C 1.549 0.91 0 O-C-N 120.983 -1.073 . . . . 0.0 113.089 176.8 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -98.55 2.86 47.88 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 125.626 1.571 . . . . 0.0 113.794 175.57 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 11.5 t -76.64 169.93 17.36 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.627 1.171 . . . . 0.0 111.46 169.534 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 8.2 m-80 . . . . . 0 C--O 1.251 1.165 0 C-N-CA 124.036 0.934 . . . . 0.0 112.109 172.343 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 44.0 t80 . . . . . 0 N--CA 1.484 1.225 0 CA-C-O 119.784 -0.15 . . . . 0.0 110.876 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 13.8 p -66.54 150.55 10.95 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 C-N-CA 124.539 1.136 . . . . 0.0 111.708 175.337 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . 0.269 0.8 OUTLIER 47.98 59.03 4.5 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 126.244 1.818 . . . . 0.0 113.861 -179.998 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 -129.85 162.44 28.53 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.327 1.451 . . . . 0.0 111.028 -172.744 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 28.2 m80 -76.44 135.41 39.41 Favored 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 164.942 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 82.3 mt -141.76 126.83 18.4 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 124.993 1.317 . . . . 0.0 109.856 -176.993 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 3.7 t -144.89 151.2 38.34 Favored 'General case' 0 N--CA 1.468 0.456 0 O-C-N 121.383 -0.823 . . . . 0.0 112.851 176.976 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.13 -124.93 34.36 Favored Glycine 0 CA--C 1.53 0.973 0 C-N-CA 125.018 1.294 . . . . 0.0 112.847 172.025 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 11.4 p -50.16 -48.64 53.74 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 125.361 1.464 . . . . 0.0 112.981 175.69 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -67.07 -34.56 77.93 Favored 'General case' 0 CA--C 1.541 0.63 0 O-C-N 121.171 -0.956 . . . . 0.0 112.216 -178.261 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 11' ' ' LEU . . . . . 0.592 HD21 HG22 ' A' ' 3' ' ' VAL . 52.2 tp -70.91 -42.57 69.77 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.623 0.769 . . . . 0.0 111.723 175.007 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 50.9 t -62.1 -43.09 97.3 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.858 0 C-N-CA 124.063 0.945 . . . . 0.0 110.547 174.531 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 27.1 mm-40 -63.82 -42.07 97.74 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 123.25 0.62 . . . . 0.0 112.175 173.573 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.03 -41.68 99.59 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 119.512 1.051 . . . . 0.0 111.811 175.571 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 28.0 mt -58.67 -44.54 90.21 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.822 0.849 . . . . 0.0 111.438 172.804 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 20.0 m-85 -63.01 -41.74 99.65 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 119.243 0.929 . . . . 0.0 112.952 173.268 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 64.7 mt -67.52 -41.09 84.97 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 123.919 0.887 . . . . 0.0 112.274 179.268 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 41.8 t -72.25 -48.56 48.09 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 C-N-CA 124.05 0.94 . . . . 0.0 111.934 177.583 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 48.6 t -81.62 -37.31 27.76 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 112.887 0.699 . . . . 0.0 112.887 -171.839 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 69.65 -144.27 40.02 Favored Glycine 0 CA--C 1.529 0.964 0 C-N-CA 124.111 0.862 . . . . 0.0 112.567 178.364 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -62.59 -21.52 65.68 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 125.091 1.356 . . . . 0.0 113.384 -177.211 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 90.4 mtm180 -58.76 -35.96 73.6 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.866 1.266 . . . . 0.0 113.262 178.82 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.12 142.42 1.92 Allowed Glycine 0 CA--C 1.535 1.313 0 C-N-CA 125.519 1.533 . . . . 0.0 113.517 -178.937 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 52.8 p90 -113.36 147.54 37.49 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.102 1.361 . . . . 0.0 111.077 176.397 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 45.4 p90 -94.97 -14.83 24.04 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.378 1.071 . . . . 0.0 113.709 -176.105 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 25.4 t80 -87.26 107.07 18.33 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.139 1.376 . . . . 0.0 113.506 -169.627 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 20.8 p -76.38 145.63 76.34 Favored Pre-proline 0 N--CA 1.475 0.802 0 C-N-CA 124.657 1.183 . . . . 0.0 110.064 168.831 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 28' ' ' PRO . . . . . 0.648 ' HA ' HG21 ' A' ' 3' ' ' VAL . 73.4 Cg_endo -72.6 151.84 53.05 Favored 'Trans proline' 0 CA--C 1.537 0.651 0 C-N-CA 122.612 2.208 . . . . 0.0 112.59 -172.406 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 22.2 tptm -61.78 -28.78 69.7 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 123.956 0.903 . . . . 0.0 112.26 171.584 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 22.7 p -92.3 40.05 1.04 Allowed 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 128.261 2.624 . . . . 0.0 111.954 177.917 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 81.0 tttt -57.72 143.42 41.86 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 125.431 1.493 . . . . 0.0 113.496 -176.962 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 78.3 ttt180 . . . . . 0 C--O 1.253 1.259 0 C-N-CA 125.912 1.685 . . . . 0.0 112.756 178.781 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.477 0 N-CA-C 110.921 -0.871 . . . . 0.0 110.921 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 10.8 tp -99.39 -26.54 3.71 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.988 0 N-CA-C 114.179 1.177 . . . . 0.0 114.179 175.711 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 5.4 p -66.32 -44.25 91.08 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.102 0 CA-C-N 120.394 1.452 . . . . 0.0 112.621 -172.7 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -75.06 -32.96 61.65 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 118.778 0.717 . . . . 0.0 111.468 174.826 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -65.96 -29.93 70.41 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 124.424 1.09 . . . . 0.0 112.35 -179.858 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 65.6 m -100.6 -26.53 13.79 Favored 'General case' 0 CA--C 1.543 0.703 0 N-CA-C 114.987 1.477 . . . . 0.0 114.987 174.141 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 15.1 t -96.14 -43.97 7.51 Favored 'General case' 0 N--CA 1.479 1.021 0 CA-C-N 120.021 1.282 . . . . 0.0 112.814 -174.974 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 25.5 m -86.18 -44.81 11.9 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 124.652 1.181 . . . . 0.0 110.167 176.898 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 75.4 m -101.36 175.4 5.59 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.976 1.31 . . . . 0.0 111.801 170.109 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 7.7 mt -96.98 141.88 14.94 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 C-N-CA 125.157 1.383 . . . . 0.0 109.468 -179.409 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 12.8 p -136.6 156.29 48.76 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 115.155 1.539 . . . . 0.0 115.155 -177.913 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 34.4 t -101.09 160.85 14.04 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 127.121 2.168 . . . . 0.0 111.334 173.916 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 54.9 mt -58.06 -27.5 63.68 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 123.844 0.858 . . . . 0.0 112.094 171.484 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 86.6 t80 -61.53 -32.11 72.16 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.292 1.037 . . . . 0.0 113.465 172.354 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 37.4 mt-30 -80.31 -33.29 37.7 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 123.901 0.88 . . . . 0.0 110.958 176.625 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 55.5 mt -61.3 -43.94 98.04 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.143 0.577 . . . . 0.0 111.679 169.469 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.3 tt0 -55.58 -28.75 56.81 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.721 1.608 . . . . 0.0 113.849 179.918 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 -63.04 -20.99 65.85 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 113.551 0.945 . . . . 0.0 113.551 178.213 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 73.3 m-85 -102.8 -1.23 30.18 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 125.527 1.531 . . . . 0.0 113.449 -179.165 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 72.0 m -69.47 148.9 48.9 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.162 0.985 . . . . 0.0 113.162 174.443 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 28.4 m120 . . . . . 0 C--O 1.251 1.176 0 C-N-CA 125.024 1.33 . . . . 0.0 112.35 169.325 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 54.8 p90 . . . . . 0 N--CA 1.482 1.168 0 CA-C-O 119.761 -0.161 . . . . 0.0 110.867 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 13.4 p -70.61 122.17 21.9 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.975 0 C-N-CA 123.585 0.754 . . . . 0.0 111.582 -178.909 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 55.7 t30 -169.49 118.21 0.63 Allowed 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.876 1.67 . . . . 0.0 109.901 -177.33 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 2.7 mm-40 -161.25 171.62 18.07 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.816 1.246 . . . . 0.0 111.301 -171.065 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 82.4 m-70 -83.19 141.32 32.0 Favored 'General case' 0 CA--C 1.545 0.782 0 O-C-N 121.51 -0.744 . . . . 0.0 110.829 169.054 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 72.6 mt -141.88 138.88 32.41 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 126.349 1.859 . . . . 0.0 109.049 174.982 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 2.7 t -151.77 148.0 27.34 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 123.176 0.59 . . . . 0.0 112.232 -175.786 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.19 -130.63 47.69 Favored Glycine 0 N--CA 1.472 1.043 0 C-N-CA 124.501 1.048 . . . . 0.0 113.128 174.43 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 18.6 m -53.93 -37.11 63.51 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 124.829 1.252 . . . . 0.0 113.121 177.838 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 88.9 m-70 -68.57 -39.29 81.06 Favored 'General case' 0 CA--C 1.543 0.687 0 O-C-N 121.116 -0.99 . . . . 0.0 111.685 178.612 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 58.3 tp -65.96 -44.5 84.78 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 123.645 0.778 . . . . 0.0 111.462 173.365 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 50.2 t -60.48 -44.89 97.36 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 C-N-CA 124.178 0.991 . . . . 0.0 111.141 176.962 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 27.3 mm-40 -65.28 -42.72 92.87 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.161 0.584 . . . . 0.0 111.943 175.003 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.58 -40.16 96.24 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 119.401 1.0 . . . . 0.0 112.295 177.19 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 32.1 mt -58.46 -50.53 73.4 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 123.217 0.607 . . . . 0.0 110.422 171.671 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 23.5 m-85 -61.86 -33.47 74.24 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 119.637 1.108 . . . . 0.0 113.453 176.52 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 69.4 mt -69.05 -41.9 77.02 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 119.174 0.897 . . . . 0.0 112.419 173.866 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 56.0 t -70.66 -44.36 76.67 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 CA-C-N 118.781 0.719 . . . . 0.0 111.872 177.951 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 34.9 m -81.32 -18.77 44.6 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 114.094 1.146 . . . . 0.0 114.094 -176.281 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 66.99 -146.78 48.64 Favored Glycine 0 CA--C 1.531 1.042 0 C-N-CA 124.229 0.919 . . . . 0.0 111.703 -174.247 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 2.5 pm0 -67.22 -15.51 63.74 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.926 1.291 . . . . 0.0 113.95 179.659 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 76.9 mtp85 -68.71 -31.43 70.51 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.848 0.859 . . . . 0.0 112.52 177.216 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.61 -177.03 49.96 Favored Glycine 0 CA--C 1.533 1.206 0 C-N-CA 125.191 1.377 . . . . 0.0 113.831 -179.156 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 42.4 p90 -123.22 161.95 23.53 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.058 1.343 . . . . 0.0 111.861 178.348 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 82.7 t80 -128.08 115.34 18.29 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.194 0.998 . . . . 0.0 110.056 172.925 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 49.0 t80 -169.28 153.52 5.4 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 125.478 1.511 . . . . 0.0 112.635 -175.089 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 17.4 p -128.29 106.94 19.46 Favored Pre-proline 0 N--CA 1.473 0.714 0 C-N-CA 126.424 1.889 . . . . 0.0 109.933 173.845 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -56.4 142.81 88.54 Favored 'Trans proline' 0 C--N 1.351 0.71 0 C-N-CA 124.255 3.303 . . . . 0.0 112.75 173.451 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 62.1 pttt -65.64 -15.19 62.53 Favored 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 114.852 1.427 . . . . 0.0 114.852 -175.82 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 14.2 t -73.58 -36.37 65.56 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 125.206 1.402 . . . . 0.0 112.17 177.043 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 19.4 ptpt -95.08 -13.75 24.87 Favored 'General case' 0 N--CA 1.477 0.883 0 N-CA-C 114.591 1.33 . . . . 0.0 114.591 178.969 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.252 1.22 0 C-N-CA 125.804 1.642 . . . . 0.0 111.369 -176.839 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.729 0 N-CA-C 111.089 -0.804 . . . . 0.0 111.089 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -53.0 -40.62 37.87 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.068 0 C-N-CA 124.925 1.29 . . . . 0.0 114.477 -169.329 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 84.2 t -65.76 -52.91 44.32 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 CA-C-N 118.75 0.705 . . . . 0.0 110.452 -175.328 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -64.25 -36.95 85.74 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 117.842 0.292 . . . . 0.0 111.131 178.156 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 52.5 tt0 -62.85 -53.97 45.99 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.812 1.245 . . . . 0.0 111.671 -179.199 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 51.9 m -70.24 -26.52 63.88 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 113.13 0.789 . . . . 0.0 113.13 178.008 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 89.8 m -71.14 -53.29 15.07 Favored 'General case' 0 N--CA 1.472 0.662 0 O-C-N 120.965 -1.085 . . . . 0.0 111.274 173.894 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 82.4 p -83.97 -16.92 42.3 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 124.599 1.16 . . . . 0.0 114.11 -171.308 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 77.6 p -143.48 168.33 20.1 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.904 0.882 . . . . 0.0 112.677 -179.011 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 20.4 mt -68.2 131.57 33.32 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 O-C-N 121.265 -0.897 . . . . 0.0 110.038 172.555 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 13.6 p -126.23 179.12 5.41 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.505 1.122 . . . . 0.0 111.914 171.789 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 88.2 p -139.78 165.14 28.08 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 125.258 1.423 . . . . 0.0 111.759 -171.547 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 11.2 mp -61.5 -29.42 69.97 Favored 'General case' 0 CA--C 1.54 0.562 0 O-C-N 121.29 -0.881 . . . . 0.0 112.306 -179.409 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 81.9 t80 -63.51 -37.48 87.47 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 112.872 0.693 . . . . 0.0 112.872 170.92 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 60.1 mt-30 -74.43 -33.74 63.04 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 124.063 0.945 . . . . 0.0 111.403 175.45 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 89.2 mt -63.28 -51.5 65.83 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 118.604 0.638 . . . . 0.0 110.988 171.601 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 25.0 mt-10 -66.28 -27.94 68.32 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 113.483 0.92 . . . . 0.0 113.483 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 16.1 t30 -58.84 -28.72 66.34 Favored 'General case' 0 CA--C 1.546 0.822 0 CA-C-N 119.317 0.962 . . . . 0.0 112.84 176.9 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 52.0 m-85 -98.09 5.69 48.38 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.615 1.566 . . . . 0.0 113.308 176.606 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 81.1 m -98.7 163.84 12.47 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.837 1.255 . . . . 0.0 112.62 170.911 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 73.4 m-80 . . . . . 0 C--O 1.251 1.17 0 CA-C-O 117.935 -1.031 . . . . 0.0 112.779 177.223 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 26.6 t80 . . . . . 0 N--CA 1.487 1.383 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 4.3 p -60.89 148.75 8.64 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 CA-C-N 120.409 1.459 . . . . 0.0 112.482 -178.803 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 1.9 t30 65.45 52.63 1.36 Allowed 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 125.319 1.447 . . . . 0.0 111.586 172.562 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 2.9 mm-40 -149.21 167.6 25.55 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.32 1.048 . . . . 0.0 111.7 -177.725 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 28.0 m-70 -78.55 143.84 36.15 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 123.35 0.66 . . . . 0.0 109.382 167.991 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 60.8 mt -140.86 126.25 18.74 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 125.596 1.558 . . . . 0.0 109.483 174.425 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 5.2 t -142.53 149.62 39.36 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 121.598 -0.689 . . . . 0.0 112.414 -175.687 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 59.5 -132.06 51.49 Favored Glycine 0 CA--C 1.529 0.955 0 C-N-CA 124.392 0.996 . . . . 0.0 113.488 172.362 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 24.4 p -57.15 -36.22 70.47 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.81 1.244 . . . . 0.0 113.11 177.927 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 67.5 m-70 -71.97 -29.65 64.47 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 119.665 1.12 . . . . 0.0 113.001 175.643 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 58.3 tp -70.75 -42.75 70.06 Favored 'General case' 0 N--CA 1.471 0.581 0 O-C-N 121.287 -0.883 . . . . 0.0 111.403 170.367 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 43.5 t -58.95 -48.39 86.65 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 124.415 1.086 . . . . 0.0 110.533 173.909 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -55.96 -49.7 72.83 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.354 1.462 . . . . 0.0 111.692 173.611 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.27 -47.91 83.86 Favored 'General case' 0 CA--C 1.534 0.359 0 O-C-N 121.618 -0.676 . . . . 0.0 111.937 178.487 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 50.4 mt -60.23 -40.9 91.83 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 118.884 0.765 . . . . 0.0 111.524 178.568 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 11.8 m-85 -63.63 -47.13 82.63 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-N 119.139 0.881 . . . . 0.0 112.716 173.575 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 9.2 mp -69.7 -38.23 76.9 Favored 'General case' 0 N--CA 1.472 0.632 0 O-C-N 121.614 -0.679 . . . . 0.0 112.463 -178.373 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 73.8 t -76.08 -43.76 37.94 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 C-N-CA 124.391 1.077 . . . . 0.0 111.633 -177.559 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 64.5 m -96.71 -20.62 18.12 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 114.763 1.394 . . . . 0.0 114.763 -173.81 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 71.68 -143.56 35.47 Favored Glycine 0 CA--C 1.533 1.2 0 C-N-CA 124.584 1.087 . . . . 0.0 112.466 179.243 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -63.67 -17.7 63.22 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 125.012 1.325 . . . . 0.0 113.65 -178.531 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 61.6 mtm180 -61.23 -31.2 70.99 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.354 1.062 . . . . 0.0 113.729 -179.516 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.18 171.81 29.66 Favored Glycine 0 CA--C 1.533 1.173 0 C-N-CA 124.192 0.901 . . . . 0.0 113.872 178.634 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 51.7 p90 -137.67 155.98 48.54 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 125.682 1.593 . . . . 0.0 113.333 -169.793 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 2.8 t80 -100.43 114.17 27.52 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.548 1.539 . . . . 0.0 108.944 169.108 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 15.6 t80 -85.36 57.2 4.32 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 124.953 1.301 . . . . 0.0 112.245 -173.285 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 2.7 m -65.89 122.69 82.18 Favored Pre-proline 0 N--CA 1.476 0.869 0 C-N-CA 125.255 1.422 . . . . 0.0 112.413 -169.598 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -80.01 -171.84 1.36 Allowed 'Trans proline' 0 CA--C 1.537 0.655 0 C-N-CA 124.165 3.244 . . . . 0.0 111.305 175.151 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 61.4 tttm -60.66 -35.64 76.71 Favored 'General case' 0 CA--C 1.547 0.842 0 O-C-N 121.273 -0.892 . . . . 0.0 113.284 174.025 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 30.5 p -130.75 -95.47 0.37 Allowed 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 126.315 1.846 . . . . 0.0 110.78 -169.896 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 23.1 pttp -155.77 24.48 0.39 Allowed 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 126.377 1.871 . . . . 0.0 113.093 -170.979 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 70.5 mtt180 . . . . . 0 C--O 1.252 1.224 0 C-N-CA 126.994 2.118 . . . . 0.0 113.44 -176.252 . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.739 0 N-CA-C 111.872 -0.491 . . . . 0.0 111.872 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 18.1 tt -53.66 -31.23 19.56 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.144 0 N-CA-C 115.921 1.823 . . . . 0.0 115.921 -169.341 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 5.4 p -62.24 -27.21 42.14 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 O-C-N 121.294 -0.879 . . . . 0.0 112.492 176.105 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -73.71 -1.25 18.35 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 124.808 1.243 . . . . 0.0 112.862 174.821 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 12.2 tt0 -111.3 -57.46 2.24 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.046 1.338 . . . . 0.0 108.978 168.129 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 67.2 m -67.0 -27.61 67.58 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 114.802 1.408 . . . . 0.0 114.802 -170.604 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 11.9 t -92.64 -30.65 15.48 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.459 0.703 . . . . 0.0 112.819 -177.592 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 37.8 p -87.85 -31.65 19.42 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 126.344 1.857 . . . . 0.0 112.251 -178.965 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 9.1 t -142.59 -164.81 1.9 Allowed 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 126.268 1.827 . . . . 0.0 109.997 179.798 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 23.1 mm -86.52 144.66 8.94 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 C-N-CA 125.28 1.432 . . . . 0.0 110.469 177.057 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 15.0 p -137.29 172.81 12.43 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.119 1.368 . . . . 0.0 111.337 169.087 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 46.3 t -120.1 151.32 39.22 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 124.249 1.019 . . . . 0.0 112.354 -175.846 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 26.1 mt -60.77 -27.38 67.94 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.76 0.824 . . . . 0.0 112.116 175.431 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 87.1 t80 -60.87 -32.29 71.73 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 123.885 0.874 . . . . 0.0 113.178 170.262 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 68.6 mt-30 -77.73 -31.77 52.42 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.785 0.834 . . . . 0.0 110.934 176.989 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 41.2 mt -59.96 -50.37 74.0 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 122.95 0.5 . . . . 0.0 110.309 169.707 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -60.96 -28.92 69.34 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 113.294 0.85 . . . . 0.0 113.294 175.333 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 31.6 t30 -73.28 -33.88 65.46 Favored 'General case' 0 CA--C 1.545 0.778 0 CA-C-N 118.859 0.754 . . . . 0.0 112.415 176.674 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -70.81 -48.59 53.36 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.972 0.909 . . . . 0.0 112.09 171.937 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 85.0 m -54.13 134.61 44.23 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.067 1.347 . . . . 0.0 113.244 179.399 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 5.4 p30 . . . . . 0 C--O 1.252 1.189 0 C-N-CA 126.13 1.772 . . . . 0.0 113.518 -174.999 . . . . . . . . 0 0 . 1 . 021 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 60.5 t80 . . . . . 0 N--CA 1.486 1.361 0 CA-C-O 119.618 -0.23 . . . . 0.0 110.527 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 10.3 t 78.37 -34.65 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 C-N-CA 128.346 2.658 . . . . 0.0 111.336 -175.99 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 11.4 p-10 -71.19 135.08 47.38 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 125.863 1.665 . . . . 0.0 112.459 169.594 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 3.3 tt0 -167.85 169.88 11.16 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.881 1.272 . . . . 0.0 111.701 179.705 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 98.5 m-70 -86.75 147.48 25.83 Favored 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 165.02 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 64.5 mt -149.22 141.26 23.86 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.784 1.634 . . . . 0.0 109.632 174.91 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.7 t -147.88 144.35 28.04 Favored 'General case' 0 N--CA 1.474 0.75 0 O-C-N 120.97 -1.081 . . . . 0.0 112.997 -178.076 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 50.04 -125.23 19.24 Favored Glycine 0 N--CA 1.471 1.003 0 C-N-CA 125.123 1.344 . . . . 0.0 113.841 171.496 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 20.0 m -56.83 -33.15 66.47 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.568 1.147 . . . . 0.0 113.248 178.492 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -73.25 -36.27 66.36 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.075 -1.016 . . . . 0.0 111.802 176.727 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 26.8 tp -68.49 -43.41 76.95 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 123.889 0.876 . . . . 0.0 111.041 173.253 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 50.4 t -60.45 -44.25 95.87 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.984 0 C-N-CA 124.731 1.212 . . . . 0.0 111.253 173.277 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -64.56 -43.88 92.52 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 123.446 0.698 . . . . 0.0 111.537 175.68 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.07 -45.18 94.65 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 123.33 0.652 . . . . 0.0 111.677 176.594 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 18.9 mt -53.66 -51.0 64.56 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.196 0.999 . . . . 0.0 111.118 172.869 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 21.1 m-85 -60.46 -46.52 89.77 Favored 'General case' 0 CA--C 1.542 0.662 0 O-C-N 121.479 -0.763 . . . . 0.0 113.025 177.207 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 84.4 mt -67.72 -40.72 84.22 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 123.672 0.789 . . . . 0.0 112.907 -178.998 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 49.5 t -75.21 -44.56 43.0 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 C-N-CA 123.826 0.85 . . . . 0.0 111.598 -178.599 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 78.3 m -87.53 -23.79 24.27 Favored 'General case' 0 N--CA 1.466 0.348 0 N-CA-C 114.413 1.264 . . . . 0.0 114.413 -171.619 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 52.35 -103.88 0.14 Allowed Glycine 0 CA--C 1.533 1.18 0 C-N-CA 124.428 1.013 . . . . 0.0 114.04 169.43 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -80.1 -16.11 55.7 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 126.181 1.792 . . . . 0.0 114.729 -177.468 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -70.76 -31.05 67.72 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 119.077 0.853 . . . . 0.0 112.385 175.753 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 82.64 142.16 4.26 Favored Glycine 0 CA--C 1.535 1.314 0 C-N-CA 125.027 1.299 . . . . 0.0 112.213 -173.913 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -80.62 173.39 12.65 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 114.197 1.184 . . . . 0.0 114.197 -175.387 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 19.3 t80 -156.37 39.82 0.35 Allowed 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.444 1.097 . . . . 0.0 112.033 -174.388 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 60.3 t80 -54.66 140.56 35.08 Favored 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 113.74 1.015 . . . . 0.0 113.74 -177.861 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 38.6 m -140.02 117.79 8.39 Favored Pre-proline 0 N--CA 1.474 0.765 0 C-N-CA 125.119 1.368 . . . . 0.0 109.651 177.688 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_exo -56.36 -178.71 0.08 OUTLIER 'Trans proline' 0 C--N 1.353 0.8 1 C-N-CA 125.668 4.245 . . . . 0.0 115.427 170.136 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 45.1 mttm -50.35 -51.65 43.88 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 125.373 1.469 . . . . 0.0 113.387 -179.038 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 19.3 p -125.91 109.0 11.97 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 126.812 2.045 . . . . 0.0 108.781 -179.078 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . 0.272 65.1 pttt 45.42 -144.0 0.21 Allowed 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 126.822 2.049 . . . . 0.0 113.993 -178.082 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 97.1 mtt180 . . . . . 0 C--O 1.253 1.272 0 C-N-CA 126.613 1.965 . . . . 0.0 111.012 -179.891 . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.315 0 N-CA-C 111.239 -0.744 . . . . 0.0 111.239 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -86.26 -19.72 8.19 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 N-CA-C 114.875 1.435 . . . . 0.0 114.875 -177.576 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 23.2 t -59.45 -41.58 85.03 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.171 0 CA-C-N 119.879 1.218 . . . . 0.0 110.618 -174.248 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -70.3 -9.2 55.37 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.93 1.692 . . . . 0.0 113.472 -179.569 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 54.8 tt0 -103.54 -62.98 1.23 Allowed 'General case' 0 C--O 1.226 -0.178 0 C-N-CA 124.38 1.072 . . . . 0.0 109.24 169.815 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 86.8 m -55.48 -32.67 63.01 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 114.656 1.354 . . . . 0.0 114.656 -169.547 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 84.1 m -76.0 -20.59 57.72 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 113.889 1.07 . . . . 0.0 113.889 -176.456 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 39.5 p -126.09 -43.49 1.81 Allowed 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 125.564 1.545 . . . . 0.0 112.251 -171.053 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 67.5 m -102.84 176.51 5.13 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 127.136 2.174 . . . . 0.0 110.963 171.527 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 69.1 mt -82.24 145.57 8.44 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 O-C-N 120.619 -1.3 . . . . 0.0 110.077 173.781 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 15.0 p -136.57 -179.9 5.97 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.113 1.365 . . . . 0.0 111.432 170.492 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 93.4 p -138.49 159.86 41.02 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 121.149 -0.969 . . . . 0.0 112.02 -171.798 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 39.7 mt -62.42 -30.94 71.59 Favored 'General case' 0 CA--C 1.541 0.597 0 O-C-N 122.043 -0.411 . . . . 0.0 111.516 174.956 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.3 t80 -63.93 -34.15 77.32 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 123.784 0.833 . . . . 0.0 113.17 172.168 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 36.1 mt-30 -76.82 -26.59 54.54 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 123.639 0.776 . . . . 0.0 111.914 172.888 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 38.0 mt -71.05 -41.67 70.46 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 119.427 1.012 . . . . 0.0 111.901 169.673 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -53.55 -33.1 53.46 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.401 1.08 . . . . 0.0 113.182 175.055 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.0 t-20 -60.08 -22.44 62.73 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 178.075 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 70.1 m-85 -107.91 9.26 28.75 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.718 1.607 . . . . 0.0 114.184 177.357 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 75.9 m -83.39 147.31 27.96 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 121.113 -0.992 . . . . 0.0 111.795 169.545 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 83.4 m-20 . . . . . 0 C--O 1.254 1.3 0 CA-C-O 117.774 -1.107 . . . . 0.0 112.074 173.086 . . . . . . . . 0 0 . 1 . 022 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . 0.277 8.8 p90 . . . . . 0 N--CA 1.496 1.83 0 CA-C-O 117.978 -1.011 . . . . 0.0 108.984 . . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 48.8 t -140.76 91.46 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 C-N-CA 126.33 1.852 . . . . 0.0 106.718 169.523 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 -162.36 152.1 16.15 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.617 1.167 . . . . 0.0 113.088 -167.836 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -174.98 177.68 1.92 Allowed 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 126.646 1.978 . . . . 0.0 110.688 -174.977 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -83.19 145.25 29.28 Favored 'General case' 0 CA--C 1.546 0.794 0 O-C-N 120.983 -1.073 . . . . 0.0 109.692 167.454 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 77.2 mt -147.99 138.43 22.93 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 125.892 1.677 . . . . 0.0 110.106 177.261 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 3.6 t -148.0 155.45 41.53 Favored 'General case' 0 CA--C 1.535 0.401 0 O-C-N 120.977 -1.077 . . . . 0.0 113.117 175.342 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 53.93 -130.6 43.69 Favored Glycine 0 N--CA 1.469 0.894 0 C-N-CA 124.874 1.226 . . . . 0.0 113.402 171.791 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.8 m -52.3 -39.35 60.42 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 124.529 1.132 . . . . 0.0 112.768 178.667 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 12.9 t60 -76.19 -30.67 58.12 Favored 'General case' 0 CA--C 1.541 0.626 0 O-C-N 121.097 -1.002 . . . . 0.0 112.578 -177.209 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 50.2 tp -67.94 -41.2 82.87 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 121.54 -0.725 . . . . 0.0 110.899 169.091 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 53.8 t -63.43 -43.1 98.31 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 C-N-CA 124.267 1.027 . . . . 0.0 111.389 174.64 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 57.0 mt-10 -56.88 -50.33 72.83 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.64 0.776 . . . . 0.0 111.341 170.58 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.63 -43.69 93.72 Favored 'General case' 0 CA--C 1.539 0.546 0 O-C-N 121.693 -0.629 . . . . 0.0 111.715 179.628 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 31.3 mt -59.02 -45.11 91.53 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.656 0.782 . . . . 0.0 111.842 173.682 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 18.4 m-85 -62.01 -42.33 99.04 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-N 119.585 1.084 . . . . 0.0 112.918 174.328 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 8.9 mp -68.41 -40.88 81.12 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 118.673 0.67 . . . . 0.0 112.029 178.472 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 54.7 t -70.7 -45.37 74.19 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 123.78 0.832 . . . . 0.0 111.852 179.46 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 57.2 m -80.38 -27.86 38.08 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 113.632 0.975 . . . . 0.0 113.632 -177.859 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 67.42 -138.94 34.7 Favored Glycine 0 CA--C 1.53 0.992 0 C-N-CA 123.891 0.758 . . . . 0.0 111.711 -176.426 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 2.4 pm0 -69.37 -15.49 63.32 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.786 1.234 . . . . 0.0 113.757 178.104 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 54.6 mtm180 -69.06 -34.36 75.04 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.296 1.039 . . . . 0.0 112.646 179.706 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.09 177.64 36.97 Favored Glycine 0 CA--C 1.533 1.175 0 C-N-CA 124.453 1.025 . . . . 0.0 113.711 -175.415 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 7.3 p90 -117.26 166.44 12.28 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 126.485 1.914 . . . . 0.0 112.922 -176.529 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 47.0 p90 -128.7 8.99 5.87 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.276 1.43 . . . . 0.0 113.731 175.145 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 5.2 p90 -55.13 147.43 16.15 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 115.167 1.543 . . . . 0.0 115.167 -171.951 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 23.6 p -89.25 134.75 32.37 Favored Pre-proline 0 N--CA 1.47 0.529 0 C-N-CA 124.596 1.158 . . . . 0.0 110.041 170.015 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -80.06 177.54 8.18 Favored 'Trans proline' 0 CA--C 1.538 0.712 0 C-N-CA 123.145 2.564 . . . . 0.0 111.397 176.859 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 40.6 ttpt -59.04 -34.71 72.23 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 123.751 0.82 . . . . 0.0 113.06 177.156 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 27.0 m -122.96 82.51 2.0 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.904 1.682 . . . . 0.0 108.481 178.958 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -63.33 131.51 48.54 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 124.092 0.957 . . . . 0.0 111.954 179.008 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 77.5 ttt180 . . . . . 0 C--O 1.252 1.223 0 C-N-CA 125.576 1.551 . . . . 0.0 111.985 177.109 . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.486 0 N-CA-C 111.121 -0.792 . . . . 0.0 111.121 . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 10.2 tt -96.56 -31.72 4.07 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 N-CA-C 112.902 0.705 . . . . 0.0 112.902 172.77 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 87.4 t -65.83 -46.19 89.43 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 CA-C-N 119.418 1.008 . . . . 0.0 112.151 -169.244 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -73.69 -29.59 62.38 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 119.235 0.925 . . . . 0.0 112.084 174.474 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 -67.95 -35.77 78.95 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.586 1.155 . . . . 0.0 112.219 179.398 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 14.8 m -97.48 -25.57 15.13 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 114.992 1.479 . . . . 0.0 114.992 176.842 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 27.8 t -95.06 -59.18 1.96 Allowed 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 120.014 1.279 . . . . 0.0 112.157 -176.305 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 20.9 m -71.26 -50.48 32.34 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.39 1.076 . . . . 0.0 109.847 179.265 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 75.2 m -91.22 171.16 9.43 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 124.203 1.001 . . . . 0.0 111.129 168.623 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 12.3 tt -91.87 147.38 5.34 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 124.124 0.97 . . . . 0.0 110.893 175.411 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 18.9 p -135.71 150.98 49.72 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 113.568 0.951 . . . . 0.0 113.568 177.325 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 13.2 t -106.53 164.14 12.31 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 125.262 1.425 . . . . 0.0 111.206 176.092 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 78.0 mt -59.39 -25.88 64.65 Favored 'General case' 0 CA--C 1.541 0.617 0 O-C-N 121.355 -0.841 . . . . 0.0 113.037 -177.755 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.8 t80 -60.01 -32.53 70.96 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 123.832 0.853 . . . . 0.0 113.224 170.397 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -81.08 -30.51 34.7 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.452 1.101 . . . . 0.0 110.927 176.181 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -64.89 -44.49 89.44 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 119.546 1.066 . . . . 0.0 110.626 169.238 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -59.84 -28.59 67.63 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 124.449 1.1 . . . . 0.0 113.822 176.421 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 22.4 t30 -59.36 -28.24 66.68 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 123.764 0.825 . . . . 0.0 113.095 177.446 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 97.6 m-85 -99.99 2.2 43.27 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.848 1.259 . . . . 0.0 113.899 -179.292 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 64.8 m -72.28 170.08 14.88 Favored 'General case' 0 CA--C 1.549 0.907 0 O-C-N 120.959 -1.088 . . . . 0.0 111.951 169.642 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.253 1.261 0 C-N-CA 125.374 1.469 . . . . 0.0 112.678 176.402 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 64.2 m-85 . . . . . 0 N--CA 1.488 1.469 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 8.0 t -85.92 57.48 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.369 0 CA-C-N 120.228 1.376 . . . . 0.0 109.223 174.456 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -97.32 130.36 44.5 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.535 1.534 . . . . 0.0 113.027 -170.749 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 41.1 mt-30 -148.01 163.77 35.85 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.872 1.669 . . . . 0.0 111.124 -174.903 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 57.5 m-70 -94.44 129.55 41.14 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 167.439 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 69.8 mt -137.06 135.1 37.21 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 126.184 1.794 . . . . 0.0 109.03 -176.36 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 1.4 t -143.02 142.95 31.72 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.256 0.622 . . . . 0.0 111.87 -171.918 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 51.17 -121.6 12.12 Favored Glycine 0 CA--C 1.53 0.973 0 C-N-CA 124.567 1.08 . . . . 0.0 113.957 170.439 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 16.3 t -55.51 -39.82 70.98 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.13 0.972 . . . . 0.0 112.701 178.199 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 72.6 m-70 -73.56 -27.93 61.59 Favored 'General case' 0 CA--C 1.542 0.661 0 O-C-N 120.455 -1.403 . . . . 0.0 113.348 178.013 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 41.8 tp -72.86 -41.79 64.39 Favored 'General case' 0 N--CA 1.467 0.415 0 O-C-N 121.437 -0.789 . . . . 0.0 111.654 170.836 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 24.9 t -60.67 -43.31 94.66 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.851 0 C-N-CA 124.495 1.118 . . . . 0.0 111.0 172.084 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -60.34 -46.8 88.65 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.312 1.445 . . . . 0.0 111.68 173.011 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.15 -40.99 95.91 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 121.461 -0.774 . . . . 0.0 112.23 175.907 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 59.6 mt -63.14 -42.18 99.42 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 118.915 0.779 . . . . 0.0 111.846 174.51 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 21.7 m-85 -61.58 -40.04 93.34 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 119.269 0.94 . . . . 0.0 112.521 172.309 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 79.0 mt -69.46 -44.51 71.07 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 123.824 0.849 . . . . 0.0 112.28 177.997 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 79.3 t -74.66 -44.46 46.56 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 C-N-CA 123.921 0.888 . . . . 0.0 112.095 -177.63 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 40.5 m -87.55 -26.61 23.05 Favored 'General case' 0 N--CA 1.474 0.772 0 N-CA-C 113.599 0.963 . . . . 0.0 113.599 -176.159 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 73.48 -153.09 47.29 Favored Glycine 0 CA--C 1.531 1.069 0 C-N-CA 125.188 1.375 . . . . 0.0 112.998 -179.698 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -59.14 -22.12 60.4 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.372 1.469 . . . . 0.0 113.867 -176.741 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.97 -26.98 68.82 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.759 1.223 . . . . 0.0 113.087 178.009 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 79.09 -172.62 55.27 Favored Glycine 0 CA--C 1.53 0.969 0 C-N-CA 124.543 1.068 . . . . 0.0 113.657 -176.098 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 40.4 p90 -148.92 161.02 42.7 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.011 1.324 . . . . 0.0 113.658 -169.321 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 57.3 m-85 -88.48 149.19 23.78 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 125.35 1.46 . . . . 0.0 109.364 167.89 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 48.4 t80 -138.5 130.36 28.08 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 121.455 -0.778 . . . . 0.0 112.864 -176.097 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 78.5 m -141.13 108.18 6.27 Favored Pre-proline 0 N--CA 1.472 0.666 0 C-N-CA 124.688 1.195 . . . . 0.0 110.267 -179.348 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_endo -80.88 168.65 17.25 Favored 'Trans proline' 0 N--CA 1.455 -0.756 0 C-N-CA 123.528 2.819 . . . . 0.0 110.908 169.487 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 39.7 ttpt -57.11 -29.94 63.95 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 123.351 0.66 . . . . 0.0 112.291 172.009 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 4.2 m -59.49 -26.52 65.35 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 127.869 2.468 . . . . 0.0 113.696 -179.808 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 36.7 ttmt -71.94 -20.94 61.68 Favored 'General case' 0 CA--C 1.551 1.008 0 N-CA-C 113.334 0.864 . . . . 0.0 113.334 178.796 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.23 0 C-N-CA 125.514 1.526 . . . . 0.0 112.968 -177.665 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.611 0 N-CA-C 111.718 -0.553 . . . . 0.0 111.718 . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 9.8 tt -109.14 -10.33 11.28 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.251 0 C-N-CA 124.978 1.311 . . . . 0.0 114.332 -172.112 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 9.0 p -58.9 -35.67 57.63 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 O-C-N 121.106 -0.996 . . . . 0.0 113.636 -169.809 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 55.1 mt-10 -73.13 -10.46 59.8 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 119.178 0.899 . . . . 0.0 113.325 175.864 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 -93.26 -60.34 1.81 Allowed 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 108.565 -0.902 . . . . 0.0 108.565 169.053 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 56.1 m -62.83 -29.97 71.13 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 115.304 1.594 . . . . 0.0 115.304 -173.461 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 13.9 t -89.7 -29.0 19.05 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.581 0.752 . . . . 0.0 112.802 -175.847 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 28.1 m -97.07 -39.09 9.49 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 125.835 1.654 . . . . 0.0 111.502 -176.171 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 70.2 m -124.96 -173.21 2.75 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.247 1.819 . . . . 0.0 110.017 176.062 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 11.6 tt -88.41 143.47 11.15 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 O-C-N 120.336 -1.478 . . . . 0.0 110.577 176.281 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 18.9 p -130.92 166.08 21.69 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.438 1.095 . . . . 0.0 111.754 175.677 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 44.9 p -108.08 159.98 16.15 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 113.718 1.007 . . . . 0.0 113.718 -174.199 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 77.0 mt -64.53 -30.83 71.86 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 121.332 -0.855 . . . . 0.0 111.433 172.369 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 87.6 t80 -65.63 -34.67 78.76 Favored 'General case' 0 CA--C 1.542 0.645 0 O-C-N 121.481 -0.762 . . . . 0.0 112.816 174.153 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -71.46 -26.53 62.75 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 123.6 0.76 . . . . 0.0 112.07 172.837 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 98.5 mt -74.49 -41.82 60.05 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 119.143 0.883 . . . . 0.0 112.01 169.769 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -55.97 -29.07 59.66 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 124.21 1.004 . . . . 0.0 113.237 176.735 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 17.8 t30 -52.88 -32.04 42.92 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.729 1.211 . . . . 0.0 113.511 174.376 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 87.4 m-85 -97.69 2.03 49.26 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 125.398 1.479 . . . . 0.0 114.695 -175.766 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 73.0 m -78.43 150.83 32.99 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.005 0.922 . . . . 0.0 113.239 178.575 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 . . . . . 0 C--O 1.25 1.101 0 C-N-CA 124.31 1.044 . . . . 0.0 112.243 170.535 . . . . . . . . 0 0 . 1 . 024 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 52.8 p90 . . . . . 0 N--CA 1.485 1.288 0 CA-C-O 118.832 -0.604 . . . . 0.0 110.721 . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . 0.3 24.0 m 58.59 -37.3 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 C-N-CA 130.39 3.476 . . . . 0.0 116.44 -173.809 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 17.6 m120 -126.95 138.53 53.29 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 127.329 2.251 . . . . 0.0 109.209 169.011 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 33.0 tp60 -158.95 160.43 36.02 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 123.51 0.724 . . . . 0.0 111.483 -169.365 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 95.9 m-70 -98.13 133.03 43.14 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 123.881 0.872 . . . . 0.0 109.017 167.724 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 88.5 mt -146.57 141.88 27.42 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 124.986 1.314 . . . . 0.0 110.383 -171.799 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 2.0 t -153.25 146.26 24.55 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.157 0.583 . . . . 0.0 111.823 -177.247 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 52.3 -126.47 30.93 Favored Glycine 0 N--CA 1.475 1.263 0 C-N-CA 124.766 1.174 . . . . 0.0 114.086 171.952 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 31.4 p -58.97 -33.87 71.15 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.628 1.171 . . . . 0.0 113.142 178.301 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 22.4 t-160 -71.55 -37.22 71.13 Favored 'General case' 0 CA--C 1.544 0.731 0 O-C-N 121.036 -1.04 . . . . 0.0 111.57 176.497 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 64.0 tp -65.15 -44.99 86.8 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 123.587 0.755 . . . . 0.0 111.525 171.689 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 40.4 t -60.82 -43.85 96.32 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 C-N-CA 124.286 1.034 . . . . 0.0 111.177 175.414 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -64.42 -42.75 95.88 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 123.59 0.756 . . . . 0.0 111.725 175.628 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.37 -41.61 98.76 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 121.677 -0.639 . . . . 0.0 111.885 175.782 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 36.6 mt -58.78 -47.84 83.34 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 118.46 0.573 . . . . 0.0 110.852 172.906 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 26.2 m-85 -59.47 -41.54 89.98 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 119.679 1.127 . . . . 0.0 112.876 175.252 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 77.6 mt -67.0 -41.32 86.94 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.998 0.919 . . . . 0.0 112.424 177.511 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 44.3 t -69.86 -42.37 79.88 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 C-N-CA 124.239 1.016 . . . . 0.0 111.798 178.62 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 61.4 m -81.6 -32.0 32.23 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 113.837 1.051 . . . . 0.0 113.837 -176.003 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 82.04 -148.21 26.84 Favored Glycine 0 CA--C 1.53 1.01 0 C-N-CA 124.616 1.103 . . . . 0.0 112.686 -177.832 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 3.8 pm0 -62.88 -23.43 67.33 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 126.292 1.837 . . . . 0.0 115.494 -169.032 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 18.1 mtm-85 -83.7 -20.18 33.96 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 124.663 1.185 . . . . 0.0 113.221 -177.951 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.9 -161.63 54.3 Favored Glycine 0 CA--C 1.532 1.155 0 C-N-CA 124.611 1.101 . . . . 0.0 113.38 -174.96 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 9.9 p90 -125.73 164.83 19.8 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 126.252 1.821 . . . . 0.0 112.993 -172.947 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 43.0 p90 -101.58 3.71 40.26 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 124.793 1.237 . . . . 0.0 112.394 168.301 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 79.8 t80 -48.86 141.91 6.99 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 126.623 1.969 . . . . 0.0 115.438 -177.166 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 24.1 p -136.77 137.2 22.86 Favored Pre-proline 0 N--CA 1.472 0.659 0 C-N-CA 126.084 1.753 . . . . 0.0 109.247 168.322 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -77.06 162.47 31.77 Favored 'Trans proline' 0 N--CA 1.459 -0.531 0 C-N-CA 123.358 2.705 . . . . 0.0 110.915 173.989 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 52.3 mtpt -68.73 -12.0 60.93 Favored 'General case' 0 CA--C 1.547 0.858 0 N-CA-C 114.057 1.132 . . . . 0.0 114.057 -177.779 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 24.0 p -76.86 -24.1 52.64 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 126.069 1.748 . . . . 0.0 112.937 171.163 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -110.45 5.36 21.32 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 125.388 1.475 . . . . 0.0 114.049 -177.154 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.242 0 C-N-CA 125.832 1.653 . . . . 0.0 112.845 177.545 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.397 0 N-CA-C 111.957 -0.457 . . . . 0.0 111.957 . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 10.0 tp -89.69 -34.33 6.64 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 N-CA-C 113.265 0.839 . . . . 0.0 113.265 -177.383 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 10.6 p -69.53 -38.76 77.46 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 C-N-CA 123.534 0.734 . . . . 0.0 112.503 -171.185 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 21.3 pm0 -72.51 -2.51 19.95 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 123.964 0.906 . . . . 0.0 113.333 174.855 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -105.17 -57.46 2.03 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.77 1.228 . . . . 0.0 110.417 172.23 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 21.4 m -68.22 -28.33 67.15 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 114.58 1.326 . . . . 0.0 114.58 -175.462 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 73.5 m -73.62 -47.15 42.43 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-N 119.644 1.111 . . . . 0.0 111.078 170.941 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 27.4 m -71.3 -37.17 71.84 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 126.538 1.935 . . . . 0.0 112.291 -170.737 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 48.2 m -137.2 167.7 21.05 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 125.326 1.45 . . . . 0.0 111.572 -176.313 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 39.2 mt -63.31 132.88 29.29 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 O-C-N 121.289 -0.882 . . . . 0.0 109.958 170.774 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 7.1 p -135.12 156.63 48.67 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.179 0.992 . . . . 0.0 112.635 176.254 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 34.2 t -108.79 160.83 15.66 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 126.138 1.775 . . . . 0.0 111.558 -175.229 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 23.7 mt -57.46 -28.01 62.98 Favored 'General case' 0 N--CA 1.469 0.504 0 O-C-N 121.62 -0.675 . . . . 0.0 111.838 173.17 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 85.9 t80 -61.85 -31.16 71.4 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 124.237 1.015 . . . . 0.0 113.665 173.06 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 34.5 mt-30 -79.16 -32.0 44.17 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.725 0.81 . . . . 0.0 111.015 174.381 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 55.0 mt -67.58 -41.14 84.62 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.36 0.664 . . . . 0.0 112.255 171.578 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -55.31 -33.15 63.06 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 124.866 1.266 . . . . 0.0 113.099 175.184 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 17.3 t30 -61.27 -26.5 67.81 Favored 'General case' 0 CA--C 1.547 0.839 0 N-CA-C 113.141 0.793 . . . . 0.0 113.141 176.811 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 49.2 m-85 -99.6 -1.77 37.31 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.409 1.484 . . . . 0.0 114.168 -179.293 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 73.5 m -67.26 151.03 48.23 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 120.867 -1.146 . . . . 0.0 112.957 173.202 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 90.0 m-20 . . . . . 0 C--O 1.252 1.208 0 C-N-CA 124.376 1.07 . . . . 0.0 111.95 169.754 . . . . . . . . 0 0 . 1 . 025 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 43.8 p90 . . . . . 0 N--CA 1.487 1.378 0 CA-C-O 119.11 -0.471 . . . . 0.0 110.7 . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 15.4 m -77.78 63.94 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.444 0 C-N-CA 125.513 1.525 . . . . 0.0 112.914 -173.17 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 38.8 t30 -157.87 109.7 2.31 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.917 1.687 . . . . 0.0 109.654 -175.35 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 2.6 mm-40 -168.09 175.65 6.51 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 125.291 1.436 . . . . 0.0 110.713 -169.626 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 49.0 m-70 -68.22 134.73 50.91 Favored 'General case' 0 CA--C 1.544 0.728 0 O-C-N 120.7 -1.25 . . . . 0.0 109.485 168.017 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 76.4 mt -135.31 126.89 28.87 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 125.631 1.572 . . . . 0.0 109.119 176.083 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.7 t -143.76 150.16 38.19 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 113.093 0.775 . . . . 0.0 113.093 -174.041 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 54.98 -128.27 43.14 Favored Glycine 0 N--CA 1.469 0.86 0 C-N-CA 124.68 1.133 . . . . 0.0 113.059 173.755 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 15.8 m -54.78 -36.17 64.61 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.518 1.127 . . . . 0.0 113.282 177.832 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 73.9 m-70 -76.76 -29.21 56.02 Favored 'General case' 0 CA--C 1.539 0.526 0 O-C-N 120.895 -1.128 . . . . 0.0 113.036 178.061 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 56.3 tp -69.54 -44.75 70.3 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 118.888 0.767 . . . . 0.0 110.689 169.908 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 25.3 t -60.22 -43.72 93.93 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.981 0 C-N-CA 124.904 1.282 . . . . 0.0 111.017 175.027 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -59.45 -50.44 73.92 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 125.142 1.377 . . . . 0.0 111.45 172.317 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.59 -40.75 97.91 Favored 'General case' 0 CA--C 1.537 0.466 0 O-C-N 121.397 -0.815 . . . . 0.0 111.978 179.683 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 40.0 mt -61.27 -42.66 99.02 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 123.661 0.784 . . . . 0.0 111.683 173.771 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 19.3 m-85 -61.97 -42.0 98.63 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-N 119.885 1.221 . . . . 0.0 112.678 172.702 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 9.0 mp -68.3 -42.39 79.5 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 118.613 0.642 . . . . 0.0 112.145 178.676 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 54.5 t -71.19 -45.31 71.7 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 C-N-CA 123.622 0.769 . . . . 0.0 111.809 -179.806 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 43.9 m -89.33 -20.01 24.57 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 114.027 1.121 . . . . 0.0 114.027 -173.023 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 66.91 -149.52 51.35 Favored Glycine 0 CA--C 1.532 1.132 0 C-N-CA 124.544 1.068 . . . . 0.0 113.078 177.956 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -61.26 -23.3 65.56 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 125.248 1.419 . . . . 0.0 113.531 -177.062 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 78.2 mtp85 -64.14 -29.44 70.56 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.34 1.056 . . . . 0.0 112.921 177.441 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.42 -169.69 54.64 Favored Glycine 0 CA--C 1.531 1.093 0 C-N-CA 124.464 1.031 . . . . 0.0 113.14 -175.238 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 54.9 p90 -147.07 157.71 43.7 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.503 1.121 . . . . 0.0 113.684 -171.164 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 60.1 t80 -88.77 147.36 24.49 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.89 1.676 . . . . 0.0 109.869 169.192 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 65.1 t80 -151.02 139.92 20.92 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.816 0.846 . . . . 0.0 111.997 -175.975 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 15.4 t -168.12 141.51 2.65 Favored Pre-proline 0 N--CA 1.472 0.65 0 C-N-CA 126.421 1.889 . . . . 0.0 109.681 -178.318 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -87.8 -163.69 0.17 Allowed 'Trans proline' 0 CA--C 1.54 0.819 0 C-N-CA 124.15 3.234 . . . . 0.0 111.821 178.099 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 39.8 ttmt -60.96 -36.23 78.83 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.861 1.264 . . . . 0.0 113.924 -175.407 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 9.0 t -156.87 -133.97 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 125.998 1.719 . . . . 0.0 109.152 -174.817 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 64.8 pttt -66.9 -4.9 10.54 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 125.627 1.571 . . . . 0.0 114.028 170.372 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 41.5 ptt180 . . . . . 0 C--O 1.255 1.374 0 C-N-CA 129.859 3.263 . . . . 0.0 110.581 -175.558 . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.671 0 N-CA-C 111.922 -0.471 . . . . 0.0 111.922 . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.406 HD12 ' CD1' ' A' ' 19' ' ' TYR . 12.4 tt -53.38 -34.57 23.04 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.174 0 C-N-CA 125.162 1.385 . . . . 0.0 113.687 -173.099 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 5.4 p -63.11 -27.92 44.08 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 O-C-N 121.518 -0.738 . . . . 0.0 112.92 178.901 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -72.14 -11.97 60.98 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 123.633 0.773 . . . . 0.0 112.833 176.27 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 22.6 tt0 -95.16 -66.49 0.91 Allowed 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 123.855 0.862 . . . . 0.0 109.144 169.165 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 57.0 m -68.94 -26.73 65.22 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 115.797 1.777 . . . . 0.0 115.797 -168.803 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 15.4 t -84.14 -43.26 15.18 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 119.631 1.105 . . . . 0.0 111.179 176.696 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 24.2 m -69.4 -32.33 71.27 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 126.116 1.766 . . . . 0.0 112.609 -179.245 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 91.8 p -147.26 169.12 20.07 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.946 1.298 . . . . 0.0 112.498 -174.967 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 38.7 mt -64.73 134.14 29.58 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.864 0 O-C-N 120.935 -1.103 . . . . 0.0 110.52 174.144 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 9.7 p -133.34 177.37 7.74 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 125.079 1.351 . . . . 0.0 111.195 169.907 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.4 t -139.69 167.33 22.35 Favored 'General case' 0 N--CA 1.466 0.366 0 O-C-N 120.927 -1.108 . . . . 0.0 112.786 179.433 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 46.8 mt -62.59 -30.11 71.09 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.445 1.098 . . . . 0.0 112.71 -169.658 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 83.3 t80 -63.61 -28.14 69.72 Favored 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 172.918 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 60.9 mt-30 -82.83 -23.18 33.86 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 123.84 0.856 . . . . 0.0 111.674 175.804 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 47.7 mt -67.83 -43.57 79.27 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 118.905 0.775 . . . . 0.0 110.742 171.661 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -56.13 -24.99 44.36 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 113.894 1.072 . . . . 0.0 113.894 175.707 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 29.4 t30 -60.47 -27.83 67.86 Favored 'General case' 0 CA--C 1.548 0.871 0 CA-C-N 119.628 1.104 . . . . 0.0 113.072 175.242 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.406 ' CD1' HD12 ' A' ' 2' ' ' ILE . 89.1 m-85 -96.71 2.33 51.92 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.505 1.522 . . . . 0.0 112.874 177.865 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 70.4 m -98.55 161.03 13.89 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.973 1.309 . . . . 0.0 112.535 177.357 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 75.7 m-20 . . . . . 0 C--O 1.25 1.126 0 C-N-CA 123.629 0.772 . . . . 0.0 112.355 175.911 . . . . . . . . 0 0 . 1 . 026 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 55.0 t80 . . . . . 0 N--CA 1.491 1.609 0 N-CA-C 110.077 -0.342 . . . . 0.0 110.077 . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 15.4 m -64.27 144.61 14.55 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 O-C-N 121.05 -1.031 . . . . 0.0 111.864 176.303 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 5.3 t30 54.49 60.29 3.64 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 125.517 1.527 . . . . 0.0 113.268 174.419 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 29.8 mm-40 -145.69 171.05 15.3 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 125.853 1.661 . . . . 0.0 111.601 -178.852 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 25.3 m-70 -81.02 143.19 32.68 Favored 'General case' 0 CA--C 1.545 0.776 0 O-C-N 120.956 -1.09 . . . . 0.0 109.607 167.356 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 67.0 mt -140.73 130.45 24.26 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 126.123 1.769 . . . . 0.0 109.148 175.26 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.6 t -135.68 144.31 45.9 Favored 'General case' 0 N--CA 1.472 0.645 0 O-C-N 121.53 -0.731 . . . . 0.0 112.784 -174.826 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 49.78 -123.33 13.11 Favored Glycine 0 N--CA 1.471 1.0 0 C-N-CA 125.287 1.423 . . . . 0.0 114.043 170.955 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 20.2 m -55.12 -38.25 67.94 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.322 1.049 . . . . 0.0 112.55 177.92 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 1.4 t-80 -70.04 -34.2 72.94 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 120.881 -1.137 . . . . 0.0 111.748 179.023 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 43.2 tp -69.99 -41.43 74.4 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 123.889 0.876 . . . . 0.0 111.507 173.653 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 55.0 t -62.15 -42.69 96.08 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 124.755 1.222 . . . . 0.0 110.91 173.313 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -64.39 -41.22 96.78 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.596 0.759 . . . . 0.0 112.233 173.071 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.1 -42.84 99.62 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 119.661 1.119 . . . . 0.0 111.792 174.977 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 26.2 mt -59.36 -44.75 92.67 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 123.362 0.665 . . . . 0.0 111.893 173.166 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 6.1 m-85 -57.76 -48.32 79.99 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.605 0.762 . . . . 0.0 112.208 172.999 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 7.9 mp -67.87 -41.27 83.11 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 123.704 0.801 . . . . 0.0 112.321 -178.077 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 61.5 t -74.33 -46.77 42.95 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.693 0 CA-C-N 118.188 0.449 . . . . 0.0 111.774 -177.061 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 86.3 m -99.96 -25.95 14.15 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 114.178 1.177 . . . . 0.0 114.178 -169.931 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 55.05 -121.64 22.79 Favored Glycine 0 CA--C 1.531 1.051 0 C-N-CA 124.386 0.993 . . . . 0.0 113.477 169.85 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -62.18 -22.9 66.28 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.721 1.608 . . . . 0.0 113.365 -177.073 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 24.6 mmm180 -62.31 -37.34 85.2 Favored 'General case' 0 N--CA 1.472 0.674 0 O-C-N 121.438 -0.788 . . . . 0.0 112.255 175.848 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.2 164.91 9.04 Favored Glycine 0 CA--C 1.535 1.296 0 C-N-CA 124.462 1.029 . . . . 0.0 112.911 -171.105 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 54.7 p90 -146.99 155.09 41.98 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.467 1.107 . . . . 0.0 113.689 -172.483 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 53.7 t80 -105.38 84.17 2.06 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.659 1.584 . . . . 0.0 109.672 175.197 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 66.5 t80 -68.12 140.18 56.19 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.675 -0.641 . . . . 0.0 111.11 172.632 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 15.7 p -133.29 119.22 15.31 Favored Pre-proline 0 CA--C 1.539 0.543 0 C-N-CA 125.132 1.373 . . . . 0.0 110.647 179.583 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -77.58 -179.13 5.14 Favored 'Trans proline' 0 CA--C 1.538 0.7 0 C-N-CA 123.287 2.658 . . . . 0.0 111.023 173.944 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 28.9 ttpp -60.23 -27.1 66.93 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 124.258 1.023 . . . . 0.0 112.804 170.725 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 1.4 m -75.13 -12.79 60.38 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 127.278 2.231 . . . . 0.0 112.6 174.453 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 37.9 ttpt 75.69 -42.82 0.47 Allowed 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 129.059 2.944 . . . . 0.0 113.525 177.899 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 51.0 tpt85 . . . . . 0 C--O 1.251 1.181 0 C-N-CA 126.276 1.83 . . . . 0.0 112.563 -177.907 . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.512 0 N-CA-C 111.106 -0.798 . . . . 0.0 111.106 . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 7.8 tp -164.62 -48.65 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.069 0 C-N-CA 125.999 1.72 . . . . 0.0 113.039 178.592 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 10.0 p -66.85 -34.9 72.99 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.19 0 CA-C-N 119.873 1.215 . . . . 0.0 111.297 179.962 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -69.38 -11.46 60.84 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.941 1.296 . . . . 0.0 113.535 172.103 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 27.2 tt0 -91.07 -61.18 1.72 Allowed 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 123.681 0.792 . . . . 0.0 108.973 168.751 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 59.9 m -66.31 -21.5 66.27 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 114.647 1.351 . . . . 0.0 114.647 -169.961 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 7.6 t -86.87 -19.1 29.41 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 124.592 1.157 . . . . 0.0 113.008 176.232 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 34.4 m -104.11 -45.96 4.58 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 125.996 1.719 . . . . 0.0 111.28 -174.816 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 66.9 m -120.89 178.1 4.85 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 127.26 2.224 . . . . 0.0 110.11 177.087 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 10.7 tt -84.28 137.13 21.41 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 O-C-N 120.679 -1.263 . . . . 0.0 110.708 178.178 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.8 m -106.75 172.5 6.78 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 125.249 1.419 . . . . 0.0 111.586 176.989 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 34.6 t -122.13 149.17 43.96 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 125.32 1.448 . . . . 0.0 112.08 176.98 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 82.6 mt -60.08 -29.12 68.36 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 121.422 -0.799 . . . . 0.0 111.747 171.076 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 79.1 t80 -63.98 -28.15 69.61 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 113.272 0.842 . . . . 0.0 113.272 173.776 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 90.3 mt-30 -76.26 -37.68 57.27 Favored 'General case' 0 CA--C 1.534 0.328 0 O-C-N 121.621 -0.675 . . . . 0.0 110.466 172.689 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 31.7 mt -64.09 -40.33 96.0 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 118.668 0.667 . . . . 0.0 112.13 175.181 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -54.92 -34.26 62.97 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.297 1.039 . . . . 0.0 113.309 171.631 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 -69.03 -21.43 64.12 Favored 'General case' 0 CA--C 1.549 0.912 0 O-C-N 121.309 -0.869 . . . . 0.0 113.158 179.005 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 75.0 m-85 -96.45 -0.96 48.38 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.186 1.394 . . . . 0.0 114.009 175.758 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 72.7 m -71.31 150.32 45.25 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 119.237 0.926 . . . . 0.0 112.88 173.565 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 . . . . . 0 C--O 1.255 1.383 0 C-N-CA 125.259 1.424 . . . . 0.0 112.762 176.243 . . . . . . . . 0 0 . 1 . 027 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 46.2 t80 . . . . . 0 N--CA 1.486 1.365 0 CA-C-O 119.752 -0.166 . . . . 0.0 111.398 . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 21.0 t 74.98 -57.29 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.325 0 C-N-CA 128.321 2.648 . . . . 0.0 111.114 -175.996 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 25.1 m120 -111.99 134.99 53.2 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.729 1.212 . . . . 0.0 112.326 177.864 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -151.63 155.52 38.56 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 125.28 1.432 . . . . 0.0 111.646 -175.569 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 95.4 m-70 -93.15 133.37 36.4 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 108.004 -1.109 . . . . 0.0 108.004 166.148 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 84.0 mt -143.52 134.71 25.78 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 124.687 1.195 . . . . 0.0 110.538 -170.972 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.6 t -149.49 132.41 16.13 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 123.399 0.68 . . . . 0.0 111.883 -175.107 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 58.65 -124.41 36.46 Favored Glycine 0 N--CA 1.472 1.047 0 C-N-CA 124.356 0.979 . . . . 0.0 112.861 177.295 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.8 m -52.02 -37.77 54.54 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.789 1.236 . . . . 0.0 112.827 177.454 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 40.8 m80 -66.21 -40.18 90.16 Favored 'General case' 0 CA--C 1.543 0.684 0 O-C-N 121.084 -1.01 . . . . 0.0 111.582 -179.143 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 53.3 tp -66.86 -41.62 87.01 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.056 0.942 . . . . 0.0 111.171 174.636 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 40.1 t -62.63 -43.06 98.21 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 C-N-CA 124.337 1.055 . . . . 0.0 111.457 175.313 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -61.05 -49.33 77.81 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.565 0.746 . . . . 0.0 111.259 173.797 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.99 -42.15 98.83 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 123.493 0.717 . . . . 0.0 111.501 -179.397 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 29.9 mt -57.37 -52.11 66.7 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 118.613 -0.708 . . . . 0.0 111.339 173.561 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -66.87 -31.83 72.7 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 120.118 1.326 . . . . 0.0 112.484 -178.627 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 79.5 mt -69.64 -39.09 77.33 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 123.903 0.881 . . . . 0.0 112.475 174.82 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 42.4 t -70.73 -44.6 76.24 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 C-N-CA 123.904 0.882 . . . . 0.0 111.954 175.285 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 59.2 m -80.52 -26.45 38.11 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 113.575 0.954 . . . . 0.0 113.575 -174.399 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 71.1 -147.81 43.42 Favored Glycine 0 CA--C 1.532 1.097 0 C-N-CA 124.437 1.018 . . . . 0.0 111.535 -173.256 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -63.24 -14.99 55.62 Favored 'General case' 0 CA--C 1.544 0.732 0 N-CA-C 114.451 1.278 . . . . 0.0 114.451 -178.559 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 59.1 mtm180 -65.36 -35.59 81.43 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.891 1.277 . . . . 0.0 112.742 177.092 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.04 -178.69 51.0 Favored Glycine 0 CA--C 1.533 1.202 0 C-N-CA 124.234 0.921 . . . . 0.0 113.611 -172.852 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 45.7 p90 -124.99 165.86 17.38 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.791 1.636 . . . . 0.0 112.709 -175.056 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 34.6 t80 -142.19 41.99 1.65 Allowed 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 126.669 1.987 . . . . 0.0 110.081 -179.281 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -64.59 156.08 31.12 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 124.685 1.194 . . . . 0.0 114.161 -177.79 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 22.9 p -122.68 67.22 29.39 Favored Pre-proline 0 N--CA 1.48 1.062 0 C-N-CA 125.041 1.336 . . . . 0.0 112.807 -170.618 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -72.76 157.23 52.29 Favored 'Trans proline' 0 C--N 1.348 0.509 0 C-N-CA 123.103 2.536 . . . . 0.0 111.672 176.237 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 94.1 mttt 87.66 119.44 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 129.114 2.965 . . . . 0.0 112.455 172.075 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 31.3 p -59.44 -22.19 61.12 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 126.36 1.864 . . . . 0.0 113.998 173.464 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 83.3 tttt -69.6 -17.68 63.55 Favored 'General case' 0 CA--C 1.553 1.07 0 C-N-CA 125.197 1.399 . . . . 0.0 113.815 177.105 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 59.7 ttm-85 . . . . . 0 C--O 1.252 1.232 0 C-N-CA 126.472 1.909 . . . . 0.0 113.12 -177.974 . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.801 0 N-CA-C 111.582 -0.607 . . . . 0.0 111.582 . . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 17.2 tt -58.79 -27.73 35.68 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.221 0 N-CA-C 115.972 1.841 . . . . 0.0 115.972 -168.82 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 3.7 p -58.88 -29.54 40.86 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 CA-C-N 120.413 1.46 . . . . 0.0 112.17 173.399 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -73.04 -10.4 59.76 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.567 1.147 . . . . 0.0 112.693 177.033 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -99.74 -58.92 1.81 Allowed 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 124.387 1.075 . . . . 0.0 109.115 168.831 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 90.8 m -62.46 -29.85 70.82 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 115.085 1.513 . . . . 0.0 115.085 -172.74 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 8.1 t -87.93 -27.52 22.08 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 123.829 0.851 . . . . 0.0 112.562 179.188 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 23.1 m -90.47 -34.51 15.56 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 126.251 1.821 . . . . 0.0 111.992 -175.418 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.7 t -145.65 -163.68 1.78 Allowed 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 126.356 1.862 . . . . 0.0 110.18 178.654 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 17.8 mm -80.35 146.1 8.11 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 C-N-CA 124.927 1.291 . . . . 0.0 110.713 173.598 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 18.1 p -135.1 170.43 15.91 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.31 1.444 . . . . 0.0 111.886 169.433 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 74.7 m -124.89 153.43 42.64 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.184 1.394 . . . . 0.0 112.627 -170.05 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 43.1 mt -60.36 -31.65 70.53 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 113.619 0.97 . . . . 0.0 113.619 -173.87 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 91.9 t80 -62.43 -31.63 72.36 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 123.886 0.874 . . . . 0.0 113.243 172.909 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 68.5 mt-30 -75.44 -34.94 61.02 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.754 0.822 . . . . 0.0 110.53 176.014 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 57.9 mt -64.05 -48.17 77.32 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 123.334 0.654 . . . . 0.0 110.938 173.344 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -56.35 -28.87 60.42 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.802 1.241 . . . . 0.0 113.715 176.06 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 27.7 t30 -58.25 -26.97 63.55 Favored 'General case' 0 CA--C 1.546 0.823 0 O-C-N 120.931 -1.105 . . . . 0.0 113.523 178.3 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -97.86 -2.81 39.99 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.284 1.434 . . . . 0.0 113.606 179.614 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 80.3 m -82.83 161.3 22.0 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.456 1.103 . . . . 0.0 113.022 177.698 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 16.5 t-20 . . . . . 0 C--O 1.253 1.257 0 C-N-CA 124.911 1.284 . . . . 0.0 113.453 -175.727 . . . . . . . . 0 0 . 1 . 028 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 36.9 p90 . . . . . 0 N--CA 1.487 1.402 0 N-CA-C 111.914 0.338 . . . . 0.0 111.914 . . . . . . . . . 0 0 . 1 . 028 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 49.0 t 71.69 -58.68 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.342 0 C-N-CA 128.463 2.705 . . . . 0.0 113.871 171.431 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 34.6 m120 -78.48 125.46 29.39 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.388 1.475 . . . . 0.0 111.911 -174.71 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -150.79 159.94 44.2 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.281 1.032 . . . . 0.0 112.165 -179.352 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 86.2 m-70 -97.71 136.31 38.25 Favored 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 107.066 -1.457 . . . . 0.0 107.066 165.365 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 87.0 mt -147.2 137.2 23.17 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.505 1.122 . . . . 0.0 110.814 -177.16 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.8 t -152.38 138.76 18.51 Favored 'General case' 0 N--CA 1.47 0.559 0 O-C-N 121.318 -0.864 . . . . 0.0 113.024 -177.901 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 58.32 -128.16 46.91 Favored Glycine 0 N--CA 1.47 0.965 0 C-N-CA 124.35 0.976 . . . . 0.0 113.334 174.303 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.7 m -55.25 -32.54 62.41 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.528 1.131 . . . . 0.0 113.046 176.993 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 25.0 m80 -69.85 -41.41 74.93 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 121.16 -0.962 . . . . 0.0 111.325 177.328 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 64.1 tp -64.89 -45.92 83.91 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.132 0.973 . . . . 0.0 110.782 173.763 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 38.6 t -57.55 -46.31 86.13 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.928 0 C-N-CA 124.717 1.207 . . . . 0.0 111.229 175.494 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -64.84 -42.99 94.48 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.429 0.691 . . . . 0.0 111.811 176.0 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.22 -41.62 98.56 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 121.574 -0.704 . . . . 0.0 112.21 176.766 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -56.66 -46.79 80.86 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.533 0.733 . . . . 0.0 110.963 173.51 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 31.6 m-85 -65.37 -36.51 84.22 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 113.453 0.909 . . . . 0.0 113.453 175.534 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 77.9 mt -71.31 -42.34 68.74 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 118.98 0.809 . . . . 0.0 112.684 177.4 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 54.8 t -72.07 -47.82 52.73 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.726 0 C-N-CA 124.334 1.054 . . . . 0.0 111.292 -177.885 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 81.4 m -93.75 -9.63 36.99 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 114.243 1.201 . . . . 0.0 114.243 -174.734 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 70.82 -154.33 52.12 Favored Glycine 0 CA--C 1.532 1.122 0 C-N-CA 124.998 1.285 . . . . 0.0 112.929 177.387 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -64.03 -9.07 13.92 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.972 1.309 . . . . 0.0 114.335 176.252 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 14.6 ttp180 -61.53 -30.99 70.99 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.668 1.587 . . . . 0.0 113.038 179.195 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 82.09 173.97 49.21 Favored Glycine 0 CA--C 1.53 1.024 0 C-N-CA 125.31 1.433 . . . . 0.0 114.17 174.639 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 23.4 p90 -151.16 155.22 38.43 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.26 1.424 . . . . 0.0 113.42 -176.159 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 74.9 t80 -90.99 -29.85 17.15 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.367 1.067 . . . . 0.0 113.71 -170.924 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 85.3 t80 -70.21 153.32 43.23 Favored 'General case' 0 CA--C 1.546 0.808 0 N-CA-C 114.915 1.45 . . . . 0.0 114.915 -170.266 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 24.3 p -136.02 142.75 41.4 Favored Pre-proline 0 N--CA 1.476 0.829 0 C-N-CA 126.903 2.081 . . . . 0.0 108.784 169.045 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -70.29 124.29 10.73 Favored 'Trans proline' 0 C--N 1.35 0.619 0 C-N-CA 122.78 2.32 . . . . 0.0 111.099 -170.658 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 25.3 mmmt -64.22 -14.56 56.27 Favored 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 -178.198 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 19.4 m -62.92 -33.0 74.41 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 126.503 1.921 . . . . 0.0 111.95 169.953 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 80.8 tttt -122.09 -19.25 6.65 Favored 'General case' 0 CA--C 1.547 0.839 0 N-CA-C 114.514 1.301 . . . . 0.0 114.514 -171.475 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 80.7 mmt-85 . . . . . 0 C--O 1.249 1.053 0 C-N-CA 125.713 1.605 . . . . 0.0 112.346 -178.477 . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.67 0 CA-C-O 119.582 -0.565 . . . . 0.0 112.085 . . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.443 HG22 ' H ' ' B' ' 27' ' ' THR . 9.0 tp -57.24 -34.58 46.11 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.204 0 CA-C-N 119.1 1.45 . . . . 0.0 113.626 -171.301 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 5.0 p -63.74 -26.92 41.79 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 O-C-N 121.088 -1.008 . . . . 0.0 112.982 176.651 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 65.4 tt0 -72.05 -13.61 61.64 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.857 1.263 . . . . 0.0 112.351 175.154 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 31.9 tt0 -104.97 -45.32 4.58 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.223 1.409 . . . . 0.0 110.946 176.269 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 29.7 m -80.95 -25.91 37.03 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 115.502 1.667 . . . . 0.0 115.502 -175.672 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 49.4 t -87.99 -55.25 3.84 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 120.249 1.386 . . . . 0.0 112.6 -173.416 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 25.9 p -77.86 -20.23 53.41 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 125.471 1.508 . . . . 0.0 113.371 -176.574 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.4 t -132.83 -173.36 3.16 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.533 1.533 . . . . 0.0 111.257 171.723 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 71.0 mt -87.5 139.72 16.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 124.785 1.234 . . . . 0.0 110.209 178.241 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.3 p -131.26 153.8 49.14 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 122.081 0.943 . . . . 0.0 112.125 169.424 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 41.5 t -95.24 153.91 17.44 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 125.802 1.641 . . . . 0.0 112.77 -178.695 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 11.1 mp -58.99 -27.85 65.79 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 121.466 -0.771 . . . . 0.0 111.613 169.305 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 74.5 t80 -62.41 -31.72 72.45 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 123.884 0.873 . . . . 0.0 113.093 171.729 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 35.4 mt-30 -77.28 -42.39 37.15 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 123.961 0.905 . . . . 0.0 110.49 174.34 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 80.7 mt -56.71 -52.72 63.85 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 123.764 0.826 . . . . 0.0 111.612 174.565 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -60.54 -34.66 74.45 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 123.841 0.857 . . . . 0.0 112.854 178.428 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -71.38 -32.19 68.18 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 123.688 0.795 . . . . 0.0 112.627 175.483 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -72.8 -43.4 62.8 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.117 0.967 . . . . 0.0 111.811 175.284 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 87.9 m -55.49 136.35 49.94 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 125.695 1.598 . . . . 0.0 112.229 170.92 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 4.4 p30 . . . . . 0 C--O 1.252 1.237 0 C-N-CA 126.945 2.098 . . . . 0.0 112.882 -171.399 . . . . . . . . 0 0 . 1 . 029 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 82.7 m-85 . . . . . 0 N--CA 1.485 1.307 0 N-CA-C 111.125 0.046 . . . . 0.0 111.125 . . . . . . . . . 0 0 . 1 . 029 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 57.4 t -66.77 137.59 24.55 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 C-N-CA 123.723 0.809 . . . . 0.0 109.334 171.884 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -158.48 150.48 21.48 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.451 1.101 . . . . 0.0 112.504 -170.64 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -175.85 176.9 1.75 Allowed 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 125.994 1.718 . . . . 0.0 110.703 -178.277 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 53.9 m-70 -77.94 135.72 37.88 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 124.5 1.12 . . . . 0.0 109.672 166.155 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 49.5 mt -141.81 135.82 30.02 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 126.607 1.963 . . . . 0.0 109.779 175.731 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 2.1 t -139.27 145.23 38.91 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 -174.315 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 50.21 -125.02 19.48 Favored Glycine 0 N--CA 1.471 0.976 0 C-N-CA 125.102 1.334 . . . . 0.0 114.277 169.957 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 18.9 m -55.65 -37.24 67.98 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.777 1.231 . . . . 0.0 113.09 178.223 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 70.3 m-70 -74.69 -30.29 61.51 Favored 'General case' 0 CA--C 1.541 0.599 0 O-C-N 120.79 -1.194 . . . . 0.0 112.79 176.99 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 39.2 tp -68.38 -44.68 74.62 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 118.805 0.73 . . . . 0.0 111.296 169.687 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 53.4 t -60.0 -46.21 94.43 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.014 0 C-N-CA 124.023 0.929 . . . . 0.0 110.919 173.993 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -58.61 -47.18 85.21 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 125.038 1.335 . . . . 0.0 111.869 174.33 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.53 -46.39 88.61 Favored 'General case' 0 CA--C 1.532 0.271 0 O-C-N 121.674 -0.641 . . . . 0.0 111.799 176.731 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 28.7 mt -54.84 -45.81 74.54 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 123.837 0.855 . . . . 0.0 111.138 175.788 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 11.0 m-85 -60.61 -51.51 69.11 Favored 'General case' 0 CA--C 1.544 0.722 0 O-C-N 121.041 -1.037 . . . . 0.0 112.819 173.972 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 91.9 mt -68.67 -40.23 80.26 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.133 0.973 . . . . 0.0 113.348 -175.395 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 54.3 t -73.58 -43.98 54.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 124.858 1.263 . . . . 0.0 111.365 -177.209 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 69.3 m -87.93 -27.91 21.84 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 114.705 1.372 . . . . 0.0 114.705 -170.147 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 56.17 -121.56 24.33 Favored Glycine 0 CA--C 1.531 1.045 0 C-N-CA 124.114 0.864 . . . . 0.0 112.799 174.575 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 3.7 pm0 -64.78 -14.62 59.69 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.809 1.643 . . . . 0.0 115.045 -177.064 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 61.1 mtp85 -62.77 -28.43 69.98 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 119.012 0.824 . . . . 0.0 112.655 172.621 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.84 133.05 1.57 Allowed Glycine 0 CA--C 1.53 1.014 0 C-N-CA 125.023 1.297 . . . . 0.0 110.661 -170.59 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -78.17 164.26 25.1 Favored 'General case' 0 CA--C 1.536 0.441 0 O-C-N 122.05 -0.676 . . . . 0.0 112.601 -177.697 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 53.4 t80 -155.75 134.63 11.99 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.398 1.079 . . . . 0.0 110.573 170.706 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 40.6 t80 -135.68 146.37 47.72 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 125.834 1.654 . . . . 0.0 111.849 -175.988 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 27' ' ' THR . . . . . 0.443 ' H ' HG22 ' A' ' 2' ' ' ILE . 27.1 p -141.32 139.68 19.43 Favored Pre-proline 0 CA--C 1.544 0.727 0 C-N-CA 126.108 1.763 . . . . 0.0 110.43 175.721 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -84.7 -177.43 2.87 Favored 'Trans proline' 0 CA--C 1.539 0.759 0 C-N-CA 124.01 3.14 . . . . 0.0 112.55 -174.744 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 33.0 ttpt -78.68 37.54 0.29 Allowed 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 126.437 1.895 . . . . 0.0 112.921 174.855 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 6.2 m 66.06 51.81 1.27 Allowed 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 127.061 2.145 . . . . 0.0 110.137 -176.951 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt -65.64 -26.94 68.03 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 124.63 1.172 . . . . 0.0 113.372 -177.614 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 80.6 ttt180 . . . . . 0 C--O 1.25 1.086 0 C-N-CA 127.002 2.121 . . . . 0.0 110.971 -178.732 . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.649 0 N-CA-C 111.545 -0.622 . . . . 0.0 111.545 . . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 9.0 tp -54.11 -36.54 32.39 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.283 0 N-CA-C 114.971 1.471 . . . . 0.0 114.971 -169.437 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 6.3 p -64.96 -24.72 36.1 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 O-C-N 121.342 -0.849 . . . . 0.0 112.985 178.855 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -75.93 0.28 18.92 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 124.067 0.947 . . . . 0.0 112.319 175.466 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 31.9 tt0 -124.46 -48.21 1.83 Allowed 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.221 1.408 . . . . 0.0 111.216 174.992 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 17.1 m -71.02 -27.39 63.64 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 114.736 1.384 . . . . 0.0 114.736 179.735 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 12.3 t -83.79 -42.07 16.88 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 119.492 1.042 . . . . 0.0 111.449 179.295 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 19.7 p -76.8 -33.94 57.97 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 126.955 2.102 . . . . 0.0 112.911 -177.159 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 73.8 m -134.27 170.8 15.16 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.468 1.507 . . . . 0.0 111.885 179.827 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 58.7 mt -68.47 136.12 27.08 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 O-C-N 120.8 -1.188 . . . . 0.0 110.13 170.833 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.0 p -133.07 162.98 30.28 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.462 1.105 . . . . 0.0 112.975 175.167 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 6.2 t -128.76 172.7 11.01 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 125.479 1.511 . . . . 0.0 112.566 -175.983 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.479 HD22 ' H ' ' A' ' 13' ' ' LEU . 1.9 mm? -59.03 -31.65 69.03 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.133 1.373 . . . . 0.0 113.1 -169.855 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 87.9 t80 -63.5 -33.5 75.71 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 123.608 0.763 . . . . 0.0 113.008 175.951 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 38.0 mt-30 -76.55 -33.7 58.54 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 124.295 1.038 . . . . 0.0 110.683 176.616 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 80.8 mt -68.31 -52.81 29.39 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.871 0.868 . . . . 0.0 111.387 174.038 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -63.95 -21.47 66.5 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 113.56 0.948 . . . . 0.0 113.56 -179.026 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.3 t30 -68.69 -33.32 73.76 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 123.877 0.871 . . . . 0.0 112.618 174.876 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 9.1 m-85 -88.52 -14.34 37.99 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 114.302 1.223 . . . . 0.0 114.302 -179.086 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 91.7 m -71.53 160.34 32.88 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.692 0.797 . . . . 0.0 112.936 170.988 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 7.1 p-10 . . . . . 0 C--O 1.254 1.299 0 C-N-CA 126.895 2.078 . . . . 0.0 113.356 179.675 . . . . . . . . 0 0 . 1 . 030 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 67.5 m-85 . . . . . 0 N--CA 1.484 1.261 0 CA-C-O 117.898 -1.048 . . . . 0.0 108.743 . . . . . . . . . 0 0 . 1 . 030 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 80.2 t -68.62 -36.37 74.25 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.38 0 CA-C-N 120.861 1.664 . . . . 0.0 109.475 168.625 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 51.7 p-10 -65.48 149.02 50.74 Favored 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 125.458 1.503 . . . . 0.0 112.291 168.515 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -162.14 165.3 27.24 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.13 0.972 . . . . 0.0 111.253 -171.441 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 34.0 m-70 -74.86 143.29 43.93 Favored 'General case' 0 CA--C 1.55 0.979 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 164.412 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 40.6 mt -142.97 137.73 29.58 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 125.773 1.629 . . . . 0.0 109.208 174.722 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 3.4 t -145.62 148.76 33.45 Favored 'General case' 0 N--CA 1.47 0.574 0 O-C-N 121.367 -0.833 . . . . 0.0 112.581 -176.2 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 52.89 -128.91 38.03 Favored Glycine 0 N--CA 1.473 1.133 0 C-N-CA 125.08 1.324 . . . . 0.0 114.018 172.141 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 26.7 m -56.87 -38.17 72.36 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.182 0.993 . . . . 0.0 113.03 -178.717 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 69.7 m-70 -73.13 -30.19 63.43 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 119.308 0.958 . . . . 0.0 112.839 177.529 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 51.1 tp -68.5 -45.77 71.42 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 118.881 0.764 . . . . 0.0 111.119 170.85 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 73.8 t -63.94 -42.3 95.33 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 CA-C-N 118.489 0.586 . . . . 0.0 111.351 176.435 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -56.3 -49.54 74.0 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.991 1.317 . . . . 0.0 111.502 171.018 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.38 -43.77 98.3 Favored 'General case' 0 CA--C 1.536 0.423 0 O-C-N 121.547 -0.721 . . . . 0.0 111.448 177.48 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 21.3 mt -58.24 -44.32 88.22 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 123.626 0.771 . . . . 0.0 111.535 176.516 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 14.8 m-85 -63.03 -45.36 92.65 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 119.107 0.867 . . . . 0.0 112.755 174.116 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 9.0 mp -72.75 -41.17 65.41 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 123.799 0.839 . . . . 0.0 113.063 -176.512 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 55.5 t -70.5 -43.48 77.9 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 C-N-CA 124.644 1.178 . . . . 0.0 110.934 -177.741 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 68.7 m -79.82 -15.95 56.42 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 113.412 0.893 . . . . 0.0 113.412 -178.565 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 59.12 -120.72 23.94 Favored Glycine 0 N--CA 1.469 0.884 0 C-N-CA 125.09 1.328 . . . . 0.0 113.427 168.842 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -59.93 -24.07 64.05 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.409 1.484 . . . . 0.0 113.418 -178.332 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 79.9 mtp180 -63.83 -30.36 71.46 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.084 0.954 . . . . 0.0 112.276 173.331 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.22 -155.19 51.38 Favored Glycine 0 CA--C 1.534 1.257 0 C-N-CA 124.461 1.029 . . . . 0.0 111.495 -168.904 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 58.3 t80 -149.36 148.01 29.0 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.431 1.492 . . . . 0.0 109.969 174.923 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 46.6 t80 -159.06 64.69 0.41 Allowed 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 124.234 1.014 . . . . 0.0 111.631 -169.28 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 67.7 t80 -156.97 155.92 32.12 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.713 1.605 . . . . 0.0 111.116 176.336 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 22.9 p -118.96 99.88 50.92 Favored Pre-proline 0 N--CA 1.475 0.785 0 C-N-CA 125.428 1.491 . . . . 0.0 110.557 -179.825 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -63.61 170.44 8.37 Favored 'Trans proline' 0 CA--C 1.539 0.768 0 C-N-CA 123.528 2.819 . . . . 0.0 113.441 173.842 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -59.3 -26.5 65.04 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 114.172 1.175 . . . . 0.0 114.172 -178.384 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 2.4 t -114.21 103.22 10.88 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 126.298 1.839 . . . . 0.0 108.077 169.774 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 28.2 tptp -74.1 124.63 26.66 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 125.479 1.512 . . . . 0.0 112.35 -175.133 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.12 0 C-N-CA 125.619 1.568 . . . . 0.0 112.018 169.983 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.193 0 N-CA-C 110.842 -0.903 . . . . 0.0 110.842 . . . . . . . . . 0 0 . 1 . 031 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 6.3 tp 169.75 -41.62 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.379 0 C-N-CA 130.812 3.645 . . . . 0.0 110.116 171.992 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 7.2 p -61.09 -32.41 52.64 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 O-C-N 121.408 -0.808 . . . . 0.0 112.335 179.46 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.7 pm0 -73.15 -18.98 61.22 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.371 1.068 . . . . 0.0 113.505 175.421 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 25.5 tp60 -88.74 -44.05 10.83 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.226 1.01 . . . . 0.0 110.3 172.445 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 21.4 m -78.82 -32.1 46.11 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 115.254 1.575 . . . . 0.0 115.254 -177.37 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 42.6 t -93.16 -59.24 2.08 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-N 119.825 1.193 . . . . 0.0 112.12 -175.487 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 19.2 m -67.84 -44.58 76.87 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.746 1.218 . . . . 0.0 110.62 -176.525 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.3 t -103.04 -163.16 0.97 Allowed 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.623 1.169 . . . . 0.0 110.832 169.119 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 82.0 mt -109.21 138.91 34.25 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 125.835 1.654 . . . . 0.0 109.471 -179.001 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 10.2 p -129.87 170.54 13.77 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.779 0.832 . . . . 0.0 113.149 173.565 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 81.9 p -120.22 167.13 12.58 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 125.962 1.705 . . . . 0.0 112.562 -175.43 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 51.0 mt -62.16 -30.94 71.4 Favored 'General case' 0 CA--C 1.539 0.554 0 O-C-N 121.751 -0.593 . . . . 0.0 111.954 173.989 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 89.7 t80 -64.81 -36.72 85.25 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 121.416 -0.802 . . . . 0.0 112.739 171.891 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -70.82 -26.16 63.18 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 118.632 -0.699 . . . . 0.0 111.815 173.011 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 74.4 mt -73.95 -43.62 57.62 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 119.423 1.01 . . . . 0.0 112.182 169.728 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -55.51 -34.87 65.02 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 123.575 0.75 . . . . 0.0 112.777 175.11 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 15.1 t30 -58.81 -27.77 65.38 Favored 'General case' 0 CA--C 1.55 0.969 0 N-CA-C 113.679 0.992 . . . . 0.0 113.679 176.551 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 49.9 m-85 -98.3 0.44 45.59 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 125.482 1.513 . . . . 0.0 113.751 179.339 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 37.9 t -75.37 167.74 21.32 Favored 'General case' 0 CA--C 1.544 0.745 0 O-C-N 120.846 -1.159 . . . . 0.0 112.116 169.917 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 25.9 m120 . . . . . 0 C--O 1.251 1.177 0 C-N-CA 126.356 1.862 . . . . 0.0 112.094 177.643 . . . . . . . . 0 0 . 1 . 031 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 33.9 t80 . . . . . 0 N--CA 1.487 1.399 0 CA-C-O 117.985 -1.007 . . . . 0.0 110.106 . . . . . . . . . 0 0 . 1 . 031 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 4.8 p -173.75 102.84 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 C-N-CA 126.601 1.96 . . . . 0.0 107.793 178.13 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 10.4 m120 -144.8 135.77 24.88 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.623 1.169 . . . . 0.0 111.292 -167.156 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 2.8 mm-40 -161.48 170.04 20.69 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.842 1.257 . . . . 0.0 112.542 -177.27 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 86.5 m-70 -86.04 135.02 33.8 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.327 1.051 . . . . 0.0 109.647 167.62 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 82.5 mt -139.85 119.38 13.1 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 125.892 1.677 . . . . 0.0 109.926 178.576 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 72.1 m -123.29 130.63 53.0 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 124.911 1.284 . . . . 0.0 112.243 -174.352 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 56.31 -120.65 20.74 Favored Glycine 0 N--CA 1.472 1.072 0 C-N-CA 124.729 1.156 . . . . 0.0 113.733 169.344 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 22.2 m -54.24 -33.24 57.98 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 124.562 1.145 . . . . 0.0 112.912 177.459 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 34.7 m80 -71.24 -41.11 70.54 Favored 'General case' 0 CA--C 1.539 0.551 0 O-C-N 120.895 -1.128 . . . . 0.0 111.34 178.07 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 60.4 tp -63.79 -45.27 90.44 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 123.637 0.775 . . . . 0.0 111.024 172.648 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 31.8 t -60.33 -46.12 95.43 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 C-N-CA 124.33 1.052 . . . . 0.0 110.77 177.808 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -63.87 -45.92 87.27 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 123.198 0.599 . . . . 0.0 111.767 176.409 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.27 -42.18 96.58 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 118.638 0.654 . . . . 0.0 111.897 179.235 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 27.1 tp -66.14 -37.75 86.46 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.075 0.95 . . . . 0.0 111.292 178.825 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 11.8 m-85 -64.67 -42.97 94.99 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 119.248 0.931 . . . . 0.0 112.448 169.109 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 70.2 mt -63.88 -39.09 93.38 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 119.08 0.855 . . . . 0.0 112.226 177.872 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 39.3 t -68.59 -45.55 81.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 124.052 0.941 . . . . 0.0 112.212 174.353 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 16.8 t -84.96 -23.21 28.85 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 114.238 1.199 . . . . 0.0 114.238 -171.915 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 77.38 -157.59 46.44 Favored Glycine 0 CA--C 1.533 1.165 0 C-N-CA 124.857 1.217 . . . . 0.0 112.372 -174.845 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -69.36 -10.86 59.83 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.034 1.334 . . . . 0.0 114.44 -175.083 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 71.1 mtm-85 -67.7 -25.56 65.74 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.698 1.199 . . . . 0.0 113.883 -175.975 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.17 155.18 12.36 Favored Glycine 0 CA--C 1.533 1.204 0 C-N-CA 124.856 1.217 . . . . 0.0 112.74 -175.02 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 22.2 p90 -115.15 170.89 8.03 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.64 1.576 . . . . 0.0 112.619 -177.591 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 45.2 p90 -108.74 152.06 25.36 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.705 1.202 . . . . 0.0 110.003 167.41 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 49.9 t80 -156.98 144.94 19.28 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 123.563 0.745 . . . . 0.0 112.742 -169.59 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 53.8 m -141.1 134.32 14.55 Favored Pre-proline 0 N--CA 1.473 0.707 0 C-N-CA 126.268 1.827 . . . . 0.0 108.361 173.755 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_endo -76.0 -170.48 0.86 Allowed 'Trans proline' 0 CA--C 1.542 0.91 0 C-N-CA 123.261 2.641 . . . . 0.0 111.896 178.339 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 28.4 ttpp -56.11 -34.26 65.89 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 114.489 1.292 . . . . 0.0 114.489 -175.336 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 9.6 t -162.44 -137.56 0.04 OUTLIER 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 126.726 2.01 . . . . 0.0 108.696 -173.461 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 65.1 pttt -68.6 -15.27 63.47 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.759 1.624 . . . . 0.0 114.358 177.206 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 . . . . . 0 C--O 1.251 1.173 0 C-N-CA 128.686 2.795 . . . . 0.0 110.525 177.159 . . . . . . . . 0 0 . 1 . 032 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.678 0 N-CA-C 111.988 -0.445 . . . . 0.0 111.988 . . . . . . . . . 0 0 . 1 . 032 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 19.5 tt -87.72 -31.04 5.7 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 N-CA-C 114.498 1.296 . . . . 0.0 114.498 -177.924 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 58.0 t -67.68 -39.45 82.17 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.099 0 C-N-CA 123.712 0.805 . . . . 0.0 111.977 -168.16 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.7 pm0 -75.24 -35.49 61.42 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.436 1.094 . . . . 0.0 111.928 171.464 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 11.0 tp60 -74.26 -43.72 55.78 Favored 'General case' 0 CA--C 1.537 0.471 0 O-C-N 121.363 -0.835 . . . . 0.0 111.962 -172.396 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 33.3 m -65.58 -21.08 66.56 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 123.706 0.802 . . . . 0.0 113.072 172.947 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 48.7 t -91.49 -45.75 8.36 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 118.701 0.682 . . . . 0.0 112.09 -178.622 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 49.2 p -76.33 -20.59 57.11 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 125.234 1.413 . . . . 0.0 113.838 179.932 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 7.8 t -143.63 -167.82 2.68 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.733 1.213 . . . . 0.0 110.991 173.653 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 70.3 mt -93.55 132.23 38.29 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 C-N-CA 124.689 1.196 . . . . 0.0 109.052 172.953 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 27.0 p -114.46 164.74 13.55 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.364 1.066 . . . . 0.0 113.305 178.238 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 36.8 t -94.69 152.52 18.41 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 124.802 1.241 . . . . 0.0 112.813 -175.855 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 48.7 mt -60.82 -30.64 70.21 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 121.457 -0.777 . . . . 0.0 111.84 173.724 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 90.9 t80 -60.84 -36.81 80.08 Favored 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 171.788 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 64.6 mt-30 -70.32 -44.56 67.98 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.322 0.649 . . . . 0.0 110.061 176.886 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 98.6 mt -57.77 -42.98 85.2 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.7 0.8 . . . . 0.0 111.958 176.667 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -72.12 -35.09 69.04 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 113.981 1.104 . . . . 0.0 113.981 175.276 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -72.66 -34.77 67.45 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 119.104 0.865 . . . . 0.0 112.958 -177.628 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 27.5 m-85 -80.75 -5.83 57.66 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 113.741 1.015 . . . . 0.0 113.741 173.868 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 8.3 t -76.8 173.32 11.82 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 123.961 0.905 . . . . 0.0 112.785 172.401 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 . . . . . 0 C--O 1.253 1.268 0 C-N-CA 125.363 1.465 . . . . 0.0 114.022 -175.403 . . . . . . . . 0 0 . 1 . 032 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 54.9 p90 . . . . . 0 N--CA 1.483 1.193 0 N-CA-C 111.232 0.086 . . . . 0.0 111.232 . . . . . . . . . 0 0 . 1 . 032 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 17.5 m -71.28 145.97 12.12 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.33 0 C-N-CA 123.909 0.884 . . . . 0.0 112.334 -177.308 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 58.91 70.71 0.63 Allowed 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 125.546 1.538 . . . . 0.0 110.98 178.803 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -141.96 166.12 25.59 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 126.869 2.068 . . . . 0.0 110.228 -168.713 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 24.3 m-70 -68.08 131.87 46.21 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 165.008 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 74.9 mt -140.24 115.75 10.06 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 126.224 1.81 . . . . 0.0 109.072 -173.615 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 78.2 m -121.57 143.82 49.08 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.084 1.353 . . . . 0.0 111.544 -178.649 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 48.62 -124.12 11.46 Favored Glycine 0 N--CA 1.473 1.118 0 C-N-CA 125.298 1.428 . . . . 0.0 114.529 169.338 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 18.7 m -53.6 -39.89 65.26 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.444 1.098 . . . . 0.0 113.338 178.559 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 18.6 t60 -72.4 -31.23 65.35 Favored 'General case' 0 CA--C 1.543 0.677 0 O-C-N 120.971 -1.08 . . . . 0.0 112.058 179.655 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 50.3 tp -67.17 -42.87 83.53 Favored 'General case' 0 C--O 1.224 -0.253 0 O-C-N 121.503 -0.748 . . . . 0.0 110.924 168.885 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 77.2 t -60.81 -43.45 95.45 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 CA-C-N 119.029 0.831 . . . . 0.0 111.241 175.983 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 67.2 mt-10 -54.75 -50.91 67.24 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 118.927 0.785 . . . . 0.0 111.087 171.166 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.02 -44.4 92.68 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.681 0.792 . . . . 0.0 112.11 -177.821 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 33.1 mt -56.22 -48.01 77.32 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 124.169 0.988 . . . . 0.0 110.892 176.338 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 14.2 m-85 -65.41 -43.77 89.53 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 119.074 0.852 . . . . 0.0 112.851 177.201 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 76.9 mt -66.85 -42.93 84.87 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 123.608 0.763 . . . . 0.0 112.552 -179.87 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 71.0 t -77.14 -36.65 24.86 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 C-N-CA 124.557 1.143 . . . . 0.0 111.602 -176.741 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 49.8 t -77.57 -31.48 53.17 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 113.875 1.065 . . . . 0.0 113.875 178.017 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 76.95 -140.37 24.78 Favored Glycine 0 CA--C 1.531 1.054 0 C-N-CA 124.072 0.844 . . . . 0.0 112.886 178.041 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 3.6 pm0 -66.46 -16.67 64.29 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 115.416 1.635 . . . . 0.0 115.416 -169.499 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 49.2 mtm180 -62.74 -37.24 85.82 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 118.785 0.721 . . . . 0.0 112.106 174.957 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.62 139.15 1.51 Allowed Glycine 0 CA--C 1.531 1.07 0 C-N-CA 125.809 1.671 . . . . 0.0 113.147 179.139 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 50.1 t80 -71.48 156.86 38.96 Favored 'General case' 0 CA--C 1.545 0.762 0 O-C-N 122.066 -0.667 . . . . 0.0 112.494 177.701 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 89.7 t80 -156.42 -32.29 0.09 Allowed 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 114.723 1.379 . . . . 0.0 114.723 -168.882 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 79.1 t80 -60.78 131.53 50.99 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.281 1.033 . . . . 0.0 113.285 -176.102 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 39.7 p -74.74 145.92 82.38 Favored Pre-proline 0 N--CA 1.477 0.899 0 O-C-N 121.27 -0.894 . . . . 0.0 111.697 -176.807 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -73.32 137.84 26.47 Favored 'Trans proline' 0 N--CA 1.456 -0.706 0 C-N-CA 122.955 2.437 . . . . 0.0 111.332 -178.537 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 45.3 mmtm -105.24 -20.6 13.45 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 113.628 0.973 . . . . 0.0 113.628 -177.69 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 17.0 m -69.06 -39.16 79.3 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 125.778 1.631 . . . . 0.0 111.476 178.248 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 64.9 tttm -154.11 135.83 14.43 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.789 1.635 . . . . 0.0 110.506 176.152 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.184 0 C-N-CA 127.975 2.51 . . . . 0.0 111.967 -177.503 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.294 0 CA-C-O 118.834 -0.981 . . . . 0.0 111.039 . . . . . . . . . 0 0 . 1 . 033 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 7.1 tp 164.47 -39.1 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.45 0 C-N-CA 130.791 3.636 . . . . 0.0 110.399 172.747 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 48.4 t -59.21 -35.91 60.29 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 C-N-CA 124.188 0.995 . . . . 0.0 110.957 178.437 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 13.0 pm0 -69.67 -9.28 53.66 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.79 1.236 . . . . 0.0 114.047 177.207 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 25.7 tt0 -99.68 -66.41 0.91 Allowed 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.17 0.988 . . . . 0.0 109.152 169.505 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 50.8 m -71.99 -26.53 62.27 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 115.464 1.654 . . . . 0.0 115.464 -168.928 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 13.4 t -85.43 -44.54 12.66 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 119.304 0.956 . . . . 0.0 110.992 176.924 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 27.3 m -65.63 -40.13 92.21 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 126.086 1.754 . . . . 0.0 111.893 -179.743 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 67.3 m -138.25 172.25 13.19 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.232 1.413 . . . . 0.0 112.0 -174.866 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 43.4 mt -64.98 136.17 27.1 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 O-C-N 120.748 -1.22 . . . . 0.0 110.179 170.666 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 9.6 p -134.51 176.72 8.37 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.235 1.414 . . . . 0.0 111.673 170.793 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 22.9 t -138.03 161.78 35.83 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.556 1.143 . . . . 0.0 112.708 -179.936 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.499 HD22 ' H ' ' A' ' 13' ' ' LEU . 1.2 mm? -61.18 -28.88 69.45 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.927 1.291 . . . . 0.0 111.783 -179.932 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 79.9 t80 -63.27 -24.25 67.78 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.68 1.192 . . . . 0.0 113.439 172.954 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 62.8 mt-30 -85.1 -37.43 20.28 Favored 'General case' 0 N--CA 1.469 0.517 0 O-C-N 121.549 -0.719 . . . . 0.0 110.638 171.884 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 27.5 mt -60.97 -33.33 73.04 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 118.965 0.802 . . . . 0.0 113.001 175.532 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.7 mm-40 -50.93 -30.97 16.23 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 124.637 1.175 . . . . 0.0 113.714 169.175 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 -73.93 -19.86 60.55 Favored 'General case' 0 CA--C 1.546 0.82 0 O-C-N 121.09 -1.006 . . . . 0.0 113.101 177.037 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 79.9 m-85 -93.35 -7.19 45.45 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.593 1.557 . . . . 0.0 113.191 176.944 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 33.1 m -74.16 136.44 42.87 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.477 1.111 . . . . 0.0 109.236 167.598 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 9.3 p30 . . . . . 0 C--O 1.253 1.268 0 CA-C-O 118.026 -0.988 . . . . 0.0 113.364 179.293 . . . . . . . . 0 0 . 1 . 033 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 63.7 m-85 . . . . . 0 N--CA 1.488 1.464 0 CA-C-O 119.051 -0.5 . . . . 0.0 110.299 . . . . . . . . . 0 0 . 1 . 033 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 27.6 m -61.02 -34.71 61.07 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.367 0 CA-C-N 119.97 1.259 . . . . 0.0 112.616 179.227 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 24.6 m120 -83.87 120.42 26.05 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.429 1.091 . . . . 0.0 109.737 168.93 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 5.4 tt0 -166.76 163.47 16.52 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 124.172 0.989 . . . . 0.0 111.646 -177.014 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 26.4 m-70 -77.48 142.5 39.11 Favored 'General case' 0 CA--C 1.548 0.87 0 N-CA-C 107.631 -1.248 . . . . 0.0 107.631 163.932 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 58.5 mt -139.72 132.53 29.15 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 125.719 1.607 . . . . 0.0 108.557 175.251 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.6 t -144.04 149.33 36.5 Favored 'General case' 0 N--CA 1.47 0.569 0 O-C-N 121.439 -0.788 . . . . 0.0 112.391 -175.054 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.32 -128.01 43.19 Favored Glycine 0 N--CA 1.469 0.855 0 C-N-CA 124.702 1.144 . . . . 0.0 113.515 172.611 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 27.2 p -53.41 -44.99 69.17 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.437 1.095 . . . . 0.0 112.923 177.363 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 12.8 m-70 -67.38 -31.27 71.39 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 120.941 -1.099 . . . . 0.0 113.352 179.255 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 40.6 tp -70.53 -44.34 67.73 Favored 'General case' 0 N--CA 1.466 0.343 0 O-C-N 121.616 -0.677 . . . . 0.0 110.892 171.517 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 54.0 t -59.02 -43.04 88.03 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 C-N-CA 123.585 0.754 . . . . 0.0 111.168 173.692 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -59.43 -44.5 92.9 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 123.864 0.866 . . . . 0.0 111.819 172.229 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.53 -42.44 99.52 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-N 119.062 0.846 . . . . 0.0 111.982 176.467 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -58.48 -46.04 87.45 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 118.79 0.723 . . . . 0.0 111.599 173.162 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 9.5 m-85 -59.12 -46.09 89.23 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 119.024 0.829 . . . . 0.0 112.339 174.28 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 67.8 mt -68.13 -39.64 82.66 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.196 0.998 . . . . 0.0 112.495 -178.229 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 71.9 t -72.23 -53.49 19.54 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 C-N-CA 123.629 0.772 . . . . 0.0 111.213 177.249 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 65.5 m -79.64 -31.69 41.55 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 113.579 0.955 . . . . 0.0 113.579 -170.729 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.5 -133.97 41.76 Favored Glycine 0 CA--C 1.528 0.871 0 C-N-CA 124.094 0.854 . . . . 0.0 111.815 178.09 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -65.32 -14.57 61.09 Favored 'General case' 0 CA--C 1.543 0.673 0 N-CA-C 114.633 1.346 . . . . 0.0 114.633 -179.632 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 88.0 mtm180 -66.43 -40.03 89.25 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 118.775 0.716 . . . . 0.0 112.216 177.981 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.93 170.74 45.0 Favored Glycine 0 CA--C 1.536 1.377 0 C-N-CA 124.225 0.917 . . . . 0.0 112.67 -168.795 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 54.6 p90 -148.03 166.49 27.6 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 114.835 1.42 . . . . 0.0 114.835 -169.272 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -99.65 141.78 32.0 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.495 1.518 . . . . 0.0 110.418 168.49 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 34.7 t80 -158.24 129.54 6.55 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.049 1.34 . . . . 0.0 111.47 177.893 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 29.5 p -149.22 154.51 39.11 Favored Pre-proline 0 N--CA 1.476 0.863 0 C-N-CA 126.403 1.881 . . . . 0.0 110.613 170.556 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_endo -72.05 176.63 8.16 Favored 'Trans proline' 0 C--N 1.354 0.839 0 C-N-CA 124.272 3.315 . . . . 0.0 112.434 178.154 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 77.8 mttt -58.74 -40.17 83.06 Favored 'General case' 0 CA--C 1.544 0.739 0 N-CA-C 114.43 1.27 . . . . 0.0 114.43 -169.6 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 41.8 m -144.58 -80.42 0.18 Allowed 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 125.62 1.568 . . . . 0.0 110.438 -174.613 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 39.7 ttpt -85.64 128.94 34.92 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.12 0.968 . . . . 0.0 111.989 -176.023 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 51.0 tpt85 . . . . . 0 C--O 1.252 1.211 0 C-N-CA 125.69 1.596 . . . . 0.0 112.85 175.966 . . . . . . . . 0 0 . 1 . 034 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.799 0 N-CA-C 110.911 -0.876 . . . . 0.0 110.911 . . . . . . . . . 0 0 . 1 . 034 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 12.1 tt -64.0 -26.25 40.07 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.088 0 N-CA-C 115.676 1.732 . . . . 0.0 115.676 -169.065 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 2.7 p -64.46 -29.86 48.56 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.193 0 CA-C-N 120.187 1.358 . . . . 0.0 112.735 175.396 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -73.8 -36.4 64.99 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 118.501 0.591 . . . . 0.0 111.394 173.08 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 32.1 tt0 -76.94 -57.96 3.55 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 124.75 1.22 . . . . 0.0 111.952 -174.988 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 21.0 m -67.14 -21.5 65.82 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 113.892 1.071 . . . . 0.0 113.892 -177.27 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 8.1 t -87.82 -30.15 20.43 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.804 0.841 . . . . 0.0 112.702 179.949 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 28.9 m -88.47 -46.49 9.08 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 125.095 1.358 . . . . 0.0 110.949 177.359 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 49.1 m -113.39 167.66 10.38 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 125.714 1.606 . . . . 0.0 111.473 -176.482 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 62.9 mt -75.08 137.17 23.53 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 O-C-N 120.96 -1.088 . . . . 0.0 108.705 170.429 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.4 p -132.87 173.34 11.49 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.61 1.164 . . . . 0.0 112.816 178.01 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 23.2 t -131.88 166.29 21.94 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 125.313 1.445 . . . . 0.0 112.459 -175.67 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 60.0 mt -57.64 -29.16 64.34 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.781 1.233 . . . . 0.0 112.455 177.94 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 86.9 t80 -61.03 -31.31 70.95 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 124.387 1.075 . . . . 0.0 113.317 173.584 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 33.4 mt-30 -79.19 -33.3 44.02 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 123.731 0.812 . . . . 0.0 110.856 175.309 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 88.2 mt -63.61 -42.72 98.2 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 118.779 0.718 . . . . 0.0 111.553 171.728 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -56.38 -34.81 67.05 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.676 0.79 . . . . 0.0 113.027 174.698 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 17.3 t30 -64.14 -26.63 68.62 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 113.109 0.781 . . . . 0.0 113.109 179.76 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 54.7 m-85 -98.37 1.67 47.2 Favored 'General case' 0 CA--C 1.551 1.007 0 C-N-CA 125.363 1.465 . . . . 0.0 113.826 179.475 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 46.4 t -84.53 174.11 10.28 Favored 'General case' 0 CA--C 1.55 0.942 0 C-N-CA 124.886 1.274 . . . . 0.0 111.223 168.151 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 8.3 p30 . . . . . 0 C--O 1.253 1.251 0 C-N-CA 125.177 1.391 . . . . 0.0 112.042 170.535 . . . . . . . . 0 0 . 1 . 034 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 15.2 t80 . . . . . 0 N--CA 1.488 1.439 0 CA-C-O 118.912 -0.566 . . . . 0.0 110.03 . . . . . . . . . 0 0 . 1 . 034 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 30.2 m -65.06 -22.44 31.39 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.341 0 CA-C-N 120.621 1.555 . . . . 0.0 114.433 -174.431 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 23.0 m120 -78.75 118.76 21.13 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.589 1.155 . . . . 0.0 111.545 176.773 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 16.7 tt0 -162.81 164.68 26.05 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.804 1.242 . . . . 0.0 111.096 -179.808 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 97.5 m-70 -79.02 146.62 33.23 Favored 'General case' 0 CA--C 1.544 0.726 0 O-C-N 120.782 -1.199 . . . . 0.0 110.058 167.9 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 83.5 mt -141.24 133.43 27.96 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 125.039 1.335 . . . . 0.0 110.075 175.525 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 5.0 t -153.47 143.26 21.95 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 121.526 -0.734 . . . . 0.0 112.211 -177.319 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 60.36 -133.38 50.37 Favored Glycine 0 CA--C 1.531 1.069 0 C-N-CA 124.377 0.989 . . . . 0.0 112.981 177.375 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.0 m -54.84 -32.76 60.92 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 124.676 1.19 . . . . 0.0 113.16 178.473 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 20.1 m80 -67.71 -43.82 79.15 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.225 -0.922 . . . . 0.0 111.182 177.874 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 59.2 tp -65.1 -44.37 89.04 Favored 'General case' 0 C--N 1.342 0.262 0 C-N-CA 123.587 0.755 . . . . 0.0 111.244 174.072 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 41.0 t -60.45 -45.56 96.64 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 124.173 0.989 . . . . 0.0 110.925 178.431 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -62.98 -47.33 83.63 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 123.469 0.708 . . . . 0.0 111.597 175.65 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.8 -41.9 97.81 Favored 'General case' 0 CA--C 1.542 0.649 0 O-C-N 121.391 -0.818 . . . . 0.0 112.326 179.439 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 30.8 tp -66.76 -37.61 84.96 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.176 0.99 . . . . 0.0 111.086 178.776 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 11.6 m-85 -65.91 -40.93 91.94 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 119.395 0.998 . . . . 0.0 112.45 169.523 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 65.1 mt -64.13 -41.14 97.33 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 119.178 0.899 . . . . 0.0 112.155 176.891 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 41.2 t -70.34 -44.14 77.75 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.954 0 C-N-CA 123.4 0.68 . . . . 0.0 112.468 175.31 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 9.5 t -80.52 -18.29 48.96 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 113.757 1.021 . . . . 0.0 113.757 -175.81 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 71.8 -149.65 45.08 Favored Glycine 0 CA--C 1.527 0.838 0 C-N-CA 125.495 1.521 . . . . 0.0 112.897 174.506 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -62.96 -22.04 66.52 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.21 1.404 . . . . 0.0 113.182 -175.993 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 88.3 mtm-85 -64.46 -33.66 76.39 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.021 0.929 . . . . 0.0 113.126 -179.553 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.29 141.47 0.87 Allowed Glycine 0 CA--C 1.531 1.065 0 C-N-CA 125.323 1.44 . . . . 0.0 112.071 -172.524 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 32.8 p90 -76.06 153.0 36.71 Favored 'General case' 0 CA--C 1.542 0.67 0 O-C-N 121.636 -0.92 . . . . 0.0 113.199 -178.11 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 78.3 t80 -84.97 -24.7 28.19 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.073 1.349 . . . . 0.0 112.641 -179.012 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 52.0 t80 -63.22 158.33 20.35 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 126.42 1.888 . . . . 0.0 115.085 -177.128 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 17.7 p -137.88 132.52 17.25 Favored Pre-proline 0 N--CA 1.471 0.615 0 C-N-CA 126.274 1.83 . . . . 0.0 108.765 168.315 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -79.57 162.33 24.71 Favored 'Trans proline' 0 N--CA 1.46 -0.483 0 C-N-CA 122.936 2.424 . . . . 0.0 111.948 -177.057 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 59.5 mtpt -57.21 -19.44 20.98 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 124.872 1.269 . . . . 0.0 114.41 179.956 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 67.7 p -80.27 -16.37 54.84 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 125.903 1.681 . . . . 0.0 113.297 177.251 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 44.1 mmtm -114.13 -25.99 8.26 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.914 1.285 . . . . 0.0 113.625 -179.393 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 72.0 mtp85 . . . . . 0 C--O 1.251 1.179 0 C-N-CA 125.277 1.431 . . . . 0.0 112.824 175.882 . . . . . . . . 0 0 . 1 . 035 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.681 0 N-CA-C 111.83 -0.508 . . . . 0.0 111.83 . . . . . . . . . 0 0 . 1 . 035 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.409 ' HB ' ' CD2' ' A' ' 19' ' ' TYR . 7.7 tp -73.57 -30.2 28.98 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 N-CA-C 114.716 1.376 . . . . 0.0 114.716 -169.415 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 11.0 p -58.81 -57.1 12.65 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 N-CA-C 112.878 0.696 . . . . 0.0 112.878 -168.44 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 67.0 mt-10 -73.33 -30.23 63.2 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 119.854 1.206 . . . . 0.0 112.205 177.013 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 26.5 tt0 -62.59 -32.62 73.65 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.957 0.903 . . . . 0.0 112.114 -178.934 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 62.0 m -94.61 -27.05 16.11 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 114.505 1.298 . . . . 0.0 114.505 170.701 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 60.8 m -72.37 -64.81 0.87 Allowed 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 120.229 1.377 . . . . 0.0 112.181 178.99 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 40.4 p -87.8 -15.29 37.31 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.131 0.972 . . . . 0.0 113.538 -171.523 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 68.6 m -122.03 167.78 12.71 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.967 1.307 . . . . 0.0 111.72 171.86 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 72.3 mt -79.61 135.35 25.75 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 124.275 1.03 . . . . 0.0 109.352 173.753 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 11.9 p -130.69 163.83 26.37 Favored 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 113.905 1.076 . . . . 0.0 113.905 178.15 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 35.1 t -111.23 159.3 18.03 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.99 1.716 . . . . 0.0 112.346 179.726 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 53.6 mt -60.47 -27.97 67.96 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.81 0.844 . . . . 0.0 111.555 174.108 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 85.9 t80 -62.24 -30.56 71.19 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.283 1.033 . . . . 0.0 113.088 172.456 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 68.3 mt-30 -81.55 -31.06 32.85 Favored 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 123.548 0.739 . . . . 0.0 110.969 174.877 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 66.3 mt -63.74 -43.15 97.35 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 118.968 0.804 . . . . 0.0 111.494 169.657 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -55.98 -35.26 66.55 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.665 1.186 . . . . 0.0 113.526 175.025 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -60.31 -31.08 69.93 Favored 'General case' 0 CA--C 1.547 0.836 0 O-C-N 121.505 -0.747 . . . . 0.0 112.38 178.112 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.409 ' CD2' ' HB ' ' A' ' 2' ' ' ILE . 92.0 m-85 -103.39 10.11 37.52 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.762 1.225 . . . . 0.0 114.163 -177.721 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 76.0 m -73.46 150.74 41.41 Favored 'General case' 0 N--CA 1.468 0.452 0 O-C-N 121.462 -0.774 . . . . 0.0 110.977 167.89 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 21.9 t-20 . . . . . 0 C--O 1.254 1.318 0 C-N-CA 124.385 1.074 . . . . 0.0 113.132 176.336 . . . . . . . . 0 0 . 1 . 035 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 83.1 m-85 . . . . . 0 N--CA 1.487 1.376 0 CA-C-O 117.993 -1.003 . . . . 0.0 110.916 . . . . . . . . . 0 0 . 1 . 035 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 8.7 p -66.39 145.97 13.53 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.276 0 CA-C-N 120.576 1.534 . . . . 0.0 112.051 179.67 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 2.2 t30 58.57 63.8 1.61 Allowed 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 126.177 1.791 . . . . 0.0 111.311 175.874 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 -151.87 160.87 43.39 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.943 0.897 . . . . 0.0 111.83 -169.528 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 68.5 m-70 -76.59 138.14 39.95 Favored 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 164.824 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 66.3 mt -142.37 123.26 14.39 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 126.018 1.727 . . . . 0.0 108.759 177.484 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 5.6 t -141.36 149.92 41.77 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 121.36 -0.837 . . . . 0.0 112.729 -175.082 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.69 -128.42 44.86 Favored Glycine 0 N--CA 1.47 0.916 0 C-N-CA 124.261 0.934 . . . . 0.0 112.718 174.964 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.5 m -53.63 -37.98 63.61 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.681 1.192 . . . . 0.0 112.986 176.782 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 42.4 m-70 -70.59 -35.59 73.11 Favored 'General case' 0 CA--C 1.539 0.521 0 O-C-N 120.977 -1.077 . . . . 0.0 112.242 179.421 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 44.2 tp -67.62 -40.98 84.66 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 123.297 0.639 . . . . 0.0 111.28 171.724 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 25.5 t -59.52 -46.79 92.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 124.338 1.055 . . . . 0.0 111.266 172.789 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -61.19 -46.19 91.48 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 123.773 0.829 . . . . 0.0 111.567 175.077 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.06 -41.06 99.37 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 121.61 -0.681 . . . . 0.0 112.017 179.021 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 43.6 mt -65.92 -40.3 91.34 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 118.487 -0.768 . . . . 0.0 111.81 175.1 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 16.6 m-85 -61.57 -38.78 88.75 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 120.381 1.446 . . . . 0.0 112.765 171.41 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 76.4 mt -68.09 -44.54 76.01 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.801 0.84 . . . . 0.0 112.297 176.422 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 55.2 t -74.07 -45.68 47.57 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 C-N-CA 123.479 0.712 . . . . 0.0 112.232 -179.027 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 49.6 m -84.58 -26.59 27.86 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 113.786 1.032 . . . . 0.0 113.786 -173.789 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 71.81 -149.21 44.4 Favored Glycine 0 CA--C 1.531 1.076 0 C-N-CA 124.576 1.084 . . . . 0.0 112.092 -174.435 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -62.28 -19.82 63.64 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.116 1.366 . . . . 0.0 113.419 -178.815 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 62.7 mtm180 -58.79 -35.55 73.0 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.536 1.134 . . . . 0.0 113.21 178.495 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.68 -173.09 55.32 Favored Glycine 0 CA--C 1.53 1.011 0 C-N-CA 124.282 0.944 . . . . 0.0 113.199 -172.333 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 37.6 p90 -146.69 162.79 37.76 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 126.078 1.751 . . . . 0.0 112.571 -169.114 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 61.6 m-85 -89.95 -27.67 19.66 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 114.193 1.182 . . . . 0.0 114.193 -177.042 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 4.1 t80 57.03 31.46 19.95 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 125.059 1.344 . . . . 0.0 113.183 -179.633 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 38.4 m -47.17 123.12 8.16 Favored Pre-proline 0 CA--C 1.543 0.682 0 C-N-CA 126.276 1.83 . . . . 0.0 112.324 -168.959 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_exo -61.35 178.05 0.69 Allowed 'Trans proline' 0 C--N 1.352 0.714 0 C-N-CA 124.754 3.636 . . . . 0.0 115.292 179.216 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 17.3 ptmt -61.61 -15.95 43.94 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 114.956 1.465 . . . . 0.0 114.956 174.801 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 19.0 m -78.68 81.37 4.99 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 126.193 1.797 . . . . 0.0 109.972 -179.531 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 65.3 mttm 59.88 -140.7 0.62 Allowed 'General case' 0 CA--C 1.554 1.124 0 C-N-CA 125.846 1.658 . . . . 0.0 112.465 174.715 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 17.1 ptm180 . . . . . 0 C--O 1.252 1.216 0 C-N-CA 128.331 2.652 . . . . 0.0 111.685 175.744 . . . . . . . . 0 0 . 1 . 036 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.324 0 N-CA-C 110.205 -1.158 . . . . 0.0 110.205 . . . . . . . . . 0 0 . 1 . 036 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 19.1 tt -75.23 -33.32 28.05 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 CA-C-N 118.183 0.992 . . . . 0.0 112.44 174.513 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 72.2 t -56.31 -58.73 4.24 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 123.743 0.817 . . . . 0.0 111.878 -169.289 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.42 ' CD ' ' H ' ' A' ' 4' ' ' GLU . 0.8 OUTLIER -81.47 -20.47 40.18 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 -179.526 . . . . . . . . 3 3 . 1 . 036 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 11.9 tp60 -69.2 -43.95 73.11 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 119.413 1.006 . . . . 0.0 111.338 177.268 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 46.8 m -67.23 -26.7 66.72 Favored 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 172.732 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 77.5 m -71.83 -56.54 5.55 Favored 'General case' 0 CA--C 1.543 0.675 0 O-C-N 121.016 -1.052 . . . . 0.0 111.193 172.985 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 46.6 p -75.16 -22.79 57.85 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 125.264 1.426 . . . . 0.0 113.98 -170.715 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 6.2 t -144.13 178.99 7.49 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 122.641 1.21 . . . . 0.0 112.411 175.586 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 17.6 mm -70.19 129.49 34.38 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.676 0 C-N-CA 125.439 1.496 . . . . 0.0 109.188 174.353 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 10.2 p -128.54 155.87 44.19 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.157 0.983 . . . . 0.0 112.448 174.576 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 75.3 p -103.84 164.04 11.95 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 114.946 1.462 . . . . 0.0 114.946 -169.741 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 10.5 mp -65.39 -27.56 68.65 Favored 'General case' 0 CA--C 1.539 0.551 0 O-C-N 121.185 -0.947 . . . . 0.0 111.651 172.09 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 89.6 t80 -64.52 -34.05 77.32 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 121.653 -0.654 . . . . 0.0 112.568 170.788 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 67.2 mt-30 -72.6 -39.52 67.25 Favored 'General case' 0 N--CA 1.47 0.543 0 O-C-N 121.62 -0.675 . . . . 0.0 111.289 171.581 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 94.5 mt -61.22 -43.73 98.41 Favored 'General case' 0 CA--C 1.545 0.757 0 CA-C-N 119.322 0.965 . . . . 0.0 111.727 174.089 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 40.0 mm-40 -55.5 -40.82 72.22 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 125.538 1.535 . . . . 0.0 112.806 171.551 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 17.0 t-20 -63.46 -23.02 67.22 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 113.419 0.896 . . . . 0.0 113.419 -177.965 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 64.2 m-85 -102.22 3.26 38.11 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 125.455 1.502 . . . . 0.0 114.194 176.785 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 85.2 m -66.64 146.77 54.12 Favored 'General case' 0 CA--C 1.544 0.732 0 O-C-N 121.235 -0.916 . . . . 0.0 110.402 167.934 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 . . . . . 0 C--O 1.255 1.386 0 C-N-CA 124.758 1.223 . . . . 0.0 113.083 -174.511 . . . . . . . . 0 0 . 1 . 036 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 72.1 m-85 . . . . . 0 N--CA 1.484 1.238 0 CA-C-O 119.39 -0.338 . . . . 0.0 110.725 . . . . . . . . . 0 0 . 1 . 036 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 13.4 p -84.36 115.97 27.3 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.012 0 C-N-CA 123.834 0.854 . . . . 0.0 111.08 -178.134 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -174.0 143.68 0.95 Allowed 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.566 1.546 . . . . 0.0 111.978 -171.956 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 29.3 mm-40 -154.58 169.27 24.24 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 125.503 1.521 . . . . 0.0 111.017 -174.307 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 51.5 m-70 -77.91 135.13 37.82 Favored 'General case' 0 CA--C 1.548 0.868 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 166.273 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 86.1 mt -140.54 124.75 17.57 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 125.404 1.482 . . . . 0.0 109.273 -179.485 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 5.2 t -142.21 142.41 32.65 Favored 'General case' 0 N--CA 1.469 0.494 0 O-C-N 121.485 -0.76 . . . . 0.0 112.84 -174.908 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 56.94 -126.61 42.42 Favored Glycine 0 CA--C 1.53 1.005 0 C-N-CA 124.598 1.094 . . . . 0.0 113.148 175.527 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 22.1 p -54.68 -38.07 66.52 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.411 1.085 . . . . 0.0 112.934 176.46 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 20.3 t-160 -68.95 -36.39 77.88 Favored 'General case' 0 CA--C 1.543 0.701 0 O-C-N 120.832 -1.168 . . . . 0.0 111.55 179.235 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 58.9 tp -67.99 -43.18 79.48 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 123.524 0.73 . . . . 0.0 111.361 172.083 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 28.8 t -59.26 -45.82 92.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 C-N-CA 124.31 1.044 . . . . 0.0 110.769 175.517 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -63.57 -44.05 95.23 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 118.621 0.646 . . . . 0.0 112.106 174.385 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.36 -41.71 94.24 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 119.254 0.934 . . . . 0.0 112.096 176.619 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 58.1 mt -63.58 -41.61 98.35 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 123.419 0.687 . . . . 0.0 111.749 174.546 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 14.0 m-85 -59.04 -45.94 89.49 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 119.761 1.164 . . . . 0.0 112.445 171.247 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 9.0 mp -67.55 -43.78 79.86 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.785 0.834 . . . . 0.0 112.35 -179.626 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 52.7 t -70.93 -49.37 50.44 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 CA-C-N 118.549 0.613 . . . . 0.0 111.456 -179.959 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 63.3 m -77.35 -33.23 55.43 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 113.371 0.878 . . . . 0.0 113.371 -174.189 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 65.36 -135.4 36.51 Favored Glycine 0 CA--C 1.529 0.907 0 C-N-CA 124.211 0.91 . . . . 0.0 111.781 178.573 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -64.09 -15.33 59.39 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 114.287 1.218 . . . . 0.0 114.287 -179.398 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 89.3 mtm180 -67.17 -36.6 82.14 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.896 0.878 . . . . 0.0 112.596 177.622 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.99 -177.41 50.23 Favored Glycine 0 CA--C 1.533 1.172 0 C-N-CA 124.391 0.996 . . . . 0.0 112.406 -169.657 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 46.5 p90 -159.85 174.45 14.43 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 125.058 1.343 . . . . 0.0 113.556 -172.039 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 27.9 t80 -142.89 125.03 15.35 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.189 0.996 . . . . 0.0 110.206 168.761 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 48.7 p90 -90.31 132.22 35.67 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 124.989 1.315 . . . . 0.0 112.096 -179.121 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 64.1 m -122.85 122.82 27.0 Favored Pre-proline 0 N--CA 1.479 0.996 0 C-N-CA 123.887 0.875 . . . . 0.0 111.648 -172.585 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_endo -91.46 177.56 1.89 Allowed 'Trans proline' 0 CA--C 1.539 0.767 0 C-N-CA 125.126 3.884 . . . . 0.0 112.263 172.959 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -62.42 -28.24 69.66 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 126.08 1.752 . . . . 0.0 113.805 174.896 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 22.8 p -72.13 -14.58 61.87 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 125.371 1.469 . . . . 0.0 112.828 172.934 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 30.8 ttpt 78.09 157.58 0.18 Allowed 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 128.103 2.561 . . . . 0.0 113.967 169.473 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 74.3 ttt180 . . . . . 0 C--O 1.254 1.313 0 C-N-CA 126.012 1.725 . . . . 0.0 112.007 175.311 . . . . . . . . 0 0 . 1 . 037 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.673 0 N-CA-C 112.526 -0.229 . . . . 0.0 112.526 . . . . . . . . . 0 0 . 1 . 037 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 19.1 tt -61.64 -26.97 41.15 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.082 0 O-C-N 121.457 -1.025 . . . . 0.0 113.629 -174.223 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 55.9 t -57.54 -29.38 33.84 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 172.805 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -89.96 -35.48 15.54 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 118.978 0.808 . . . . 0.0 112.463 169.656 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -69.27 -41.21 77.18 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 121.84 -0.538 . . . . 0.0 112.299 -171.93 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.3 m -74.75 -21.98 59.04 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 113.118 0.784 . . . . 0.0 113.118 172.174 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 17.1 t -89.38 -46.81 8.45 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.427 0.691 . . . . 0.0 112.489 -171.585 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 85.7 m -82.72 -44.35 15.74 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 125.393 1.477 . . . . 0.0 111.326 178.039 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 68.8 m -106.09 172.95 6.53 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 124.4 1.08 . . . . 0.0 111.813 177.53 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 22.6 mm -73.91 144.55 12.41 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 O-C-N 120.89 -1.131 . . . . 0.0 110.108 171.285 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 11.8 p -134.9 -177.03 4.44 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 113.751 1.019 . . . . 0.0 113.751 170.601 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 79.3 p -147.76 164.58 33.17 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 125.382 1.473 . . . . 0.0 112.5 -169.172 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 10.9 mp -61.89 -29.33 70.13 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 121.416 -0.803 . . . . 0.0 112.423 -177.416 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 90.3 t80 -63.01 -37.0 85.45 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 123.44 0.696 . . . . 0.0 112.483 172.773 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 58.6 mt-30 -74.9 -36.56 62.23 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 123.786 0.835 . . . . 0.0 111.052 175.461 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 94.9 mt -61.83 -48.48 80.38 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 118.728 0.695 . . . . 0.0 111.279 172.97 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 19.6 mm-40 -60.97 -34.56 74.95 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.208 1.003 . . . . 0.0 113.268 176.691 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 17.0 t30 -57.76 -28.01 63.56 Favored 'General case' 0 CA--C 1.547 0.85 0 O-C-N 121.013 -1.054 . . . . 0.0 113.028 178.209 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 71.0 m-85 -103.08 6.89 38.88 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.183 1.393 . . . . 0.0 113.906 177.445 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 98.9 m -92.27 160.64 15.05 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.134 0.974 . . . . 0.0 112.994 171.12 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 . . . . . 0 C--O 1.253 1.267 0 N-CA-C 113.55 0.944 . . . . 0.0 113.55 -173.078 . . . . . . . . 0 0 . 1 . 037 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 62.5 t80 . . . . . 0 N--CA 1.488 1.456 0 N-CA-C 110.175 -0.305 . . . . 0.0 110.175 . . . . . . . . . 0 0 . 1 . 037 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 9.4 p -66.23 145.99 13.52 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.2 0 O-C-N 121.344 -0.847 . . . . 0.0 111.891 179.119 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 1.9 t30 61.33 58.63 2.11 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.186 1.394 . . . . 0.0 111.288 177.091 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -150.43 164.17 36.57 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.022 1.329 . . . . 0.0 110.473 -176.088 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 97.7 m-70 -80.08 145.54 32.38 Favored 'General case' 0 CA--C 1.549 0.908 0 O-C-N 121.224 -0.923 . . . . 0.0 111.044 170.658 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 80.8 mt -142.57 139.71 31.47 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.988 1.715 . . . . 0.0 110.069 173.78 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.0 t -151.65 145.77 25.32 Favored 'General case' 0 N--CA 1.471 0.604 0 O-C-N 121.316 -0.865 . . . . 0.0 112.056 -177.345 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 54.42 -124.22 30.5 Favored Glycine 0 CA--C 1.529 0.964 0 C-N-CA 124.549 1.071 . . . . 0.0 113.385 172.829 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 71.8 p -55.09 -35.61 64.77 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 124.892 1.277 . . . . 0.0 113.463 177.458 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 4.2 m80 -75.52 -37.18 60.25 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 121.503 -0.748 . . . . 0.0 111.112 -179.078 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 54.3 tp -64.98 -45.38 85.9 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 123.437 0.695 . . . . 0.0 111.308 171.573 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 22.2 t -59.37 -46.81 92.28 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.913 0 C-N-CA 124.747 1.219 . . . . 0.0 111.275 175.555 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -63.61 -43.52 96.63 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.315 0.646 . . . . 0.0 111.767 177.105 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.17 -44.35 96.81 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.35 0.66 . . . . 0.0 111.837 176.65 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 44.4 mt -58.76 -43.66 90.41 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 123.024 0.53 . . . . 0.0 111.635 175.808 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 20.4 m-85 -63.95 -43.68 95.1 Favored 'General case' 0 CA--C 1.544 0.717 0 O-C-N 121.343 -0.848 . . . . 0.0 112.629 174.2 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 76.5 mt -67.44 -41.28 85.0 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 123.674 0.79 . . . . 0.0 112.641 179.589 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 61.6 t -73.55 -46.96 46.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 124.359 1.064 . . . . 0.0 111.58 -178.159 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 58.8 m -98.9 -16.47 18.8 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 115.389 1.626 . . . . 0.0 115.389 -169.312 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 73.97 -148.5 39.73 Favored Glycine 0 CA--C 1.531 1.061 0 C-N-CA 124.309 0.957 . . . . 0.0 113.431 177.896 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 2.9 pm0 -67.02 -11.42 56.99 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.633 1.573 . . . . 0.0 114.541 -176.35 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 40.2 mtp180 -57.71 -36.03 71.45 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 125.02 1.328 . . . . 0.0 112.789 172.359 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.5 175.48 30.77 Favored Glycine 0 CA--C 1.529 0.928 0 C-N-CA 124.288 0.947 . . . . 0.0 113.663 -176.935 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 37.6 p90 -120.52 153.45 36.67 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.967 1.307 . . . . 0.0 113.064 -176.801 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 57.1 m-85 -127.59 38.55 4.03 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 127.74 2.416 . . . . 0.0 109.327 -179.119 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.84 151.1 43.27 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.899 1.68 . . . . 0.0 115.348 -170.405 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 18.9 p -97.86 134.79 21.92 Favored Pre-proline 0 N--CA 1.473 0.7 0 C-N-CA 124.72 1.208 . . . . 0.0 111.76 -175.215 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -76.55 173.84 13.82 Favored 'Trans proline' 0 C--N 1.351 0.68 0 C-N-CA 124.442 3.428 . . . . 0.0 112.17 -175.093 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -73.76 -38.05 64.84 Favored 'General case' 0 CA--C 1.546 0.794 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 173.619 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 18.8 m -155.78 -66.9 0.12 Allowed 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 125.211 1.404 . . . . 0.0 111.366 -169.21 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 32.1 mmmt -83.19 154.97 23.98 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.333 1.053 . . . . 0.0 113.12 -172.329 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.19 0 C-N-CA 126.777 2.031 . . . . 0.0 111.55 179.638 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.648 0 N-CA-C 112.337 -0.305 . . . . 0.0 112.337 . . . . . . . . . 0 0 . 1 . 038 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 10.8 tp -58.92 -34.17 51.88 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.389 0 O-C-N 121.249 -1.148 . . . . 0.0 113.951 -170.939 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 6.4 t -70.11 -21.11 23.49 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.276 0 C-N-CA 124.593 1.157 . . . . 0.0 112.682 -179.819 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -86.98 -48.03 8.46 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 123.784 0.834 . . . . 0.0 109.227 167.789 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 33.5 tt0 -65.33 -43.47 90.82 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 124.968 1.307 . . . . 0.0 113.87 -167.569 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 67.2 m -73.83 -12.7 60.76 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 113.545 0.942 . . . . 0.0 113.545 173.959 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 15.1 t -104.66 -43.55 5.1 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.955 1.302 . . . . 0.0 113.353 -168.863 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 81.5 p -85.84 -28.36 24.5 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 124.951 1.3 . . . . 0.0 112.279 175.328 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 5.5 t -126.39 -169.55 2.04 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.319 1.447 . . . . 0.0 111.035 170.107 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 6.5 tt -98.37 147.73 6.56 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.513 0 C-N-CA 125.08 1.352 . . . . 0.0 110.719 177.353 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 17.5 p -133.63 150.36 51.58 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 113.889 1.07 . . . . 0.0 113.889 -178.698 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 34.2 t -91.59 160.92 15.15 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 125.826 1.65 . . . . 0.0 112.276 178.195 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 10.0 mp -59.09 -29.18 67.16 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.357 1.063 . . . . 0.0 111.54 171.303 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 94.6 t80 -60.99 -37.72 83.47 Favored 'General case' 0 CA--C 1.54 0.56 0 O-C-N 121.55 -0.719 . . . . 0.0 112.786 171.546 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 37.0 mt-30 -74.73 -38.33 62.3 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 123.413 0.685 . . . . 0.0 110.45 177.618 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 95.5 mt -60.71 -43.77 97.4 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 123.467 0.707 . . . . 0.0 111.795 173.579 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -68.63 -35.28 77.09 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 113.518 0.932 . . . . 0.0 113.518 173.314 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -63.68 -32.18 73.58 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-N 119.535 1.061 . . . . 0.0 113.105 -177.627 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 41.4 m-85 -86.61 -1.97 58.11 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 124.786 1.234 . . . . 0.0 113.89 172.491 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 6.5 t -86.95 172.44 10.03 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 124.27 1.028 . . . . 0.0 112.542 171.47 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 19.8 m120 . . . . . 0 C--O 1.253 1.265 0 C-N-CA 125.68 1.592 . . . . 0.0 112.878 176.564 . . . . . . . . 0 0 . 1 . 038 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 65.2 m-85 . . . . . 0 N--CA 1.489 1.51 0 N-CA-C 111.343 0.127 . . . . 0.0 111.343 . . . . . . . . . 0 0 . 1 . 038 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 32.6 m -76.13 -6.11 8.32 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.388 0 C-N-CA 124.65 1.18 . . . . 0.0 114.08 -179.829 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 4.0 m120 -63.37 146.37 53.67 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.739 1.216 . . . . 0.0 113.036 -174.399 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 44.2 mt-30 -142.4 157.92 44.26 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.159 1.384 . . . . 0.0 111.868 -177.833 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 84.9 m-70 -95.03 126.47 40.39 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 108.166 -1.05 . . . . 0.0 108.166 167.197 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 54.5 mt -144.58 138.68 27.63 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 125.137 1.375 . . . . 0.0 109.862 -172.395 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 1.8 t -154.99 151.99 29.13 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 123.358 0.663 . . . . 0.0 111.664 -179.169 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 57.69 -133.11 52.8 Favored Glycine 0 CA--C 1.532 1.106 0 C-N-CA 124.336 0.969 . . . . 0.0 113.434 175.303 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 23.3 p -54.22 -43.22 70.62 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.734 1.214 . . . . 0.0 112.968 179.03 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 15.7 m-70 -67.15 -32.37 73.42 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 120.848 -1.157 . . . . 0.0 112.912 179.446 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 57.4 tp -68.91 -41.88 77.61 Favored 'General case' 0 N--CA 1.468 0.438 0 O-C-N 121.742 -0.599 . . . . 0.0 111.473 170.343 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 55.6 t -60.39 -44.59 96.4 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 CA-C-N 118.813 0.733 . . . . 0.0 110.864 175.457 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -58.4 -50.67 72.83 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 123.879 0.872 . . . . 0.0 111.354 172.049 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.91 -42.36 99.76 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.705 0.802 . . . . 0.0 112.432 -177.677 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 60.5 mt -57.73 -45.5 85.71 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 119.035 0.834 . . . . 0.0 111.087 175.399 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 25.8 m-85 -66.96 -41.0 87.65 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 118.868 0.758 . . . . 0.0 112.763 176.152 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 75.8 mt -67.42 -43.99 79.84 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 123.808 0.843 . . . . 0.0 112.417 178.793 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 67.7 t -76.68 -38.83 31.06 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 124.417 1.087 . . . . 0.0 111.749 -175.923 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 28.8 t -80.86 -26.22 37.1 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 113.266 0.839 . . . . 0.0 113.266 178.665 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 79.2 -153.85 38.12 Favored Glycine 0 CA--C 1.528 0.881 0 C-N-CA 124.731 1.158 . . . . 0.0 112.78 179.311 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -61.35 -14.29 26.23 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 115.196 1.554 . . . . 0.0 115.196 -174.228 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 49.8 mtp180 -54.22 -48.64 70.85 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 125.159 1.384 . . . . 0.0 112.24 171.192 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.74 145.85 0.9 Allowed Glycine 0 CA--C 1.533 1.21 0 C-N-CA 125.217 1.389 . . . . 0.0 112.604 -174.881 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 14.9 p90 -98.08 166.48 11.4 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 123.924 0.89 . . . . 0.0 112.2 175.797 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 69.9 t80 -151.87 119.36 6.03 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.356 1.462 . . . . 0.0 109.295 170.314 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 54.7 t80 -161.53 148.06 14.27 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 124.142 0.977 . . . . 0.0 112.39 -172.519 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 38.2 m -86.2 117.19 68.28 Favored Pre-proline 0 N--CA 1.474 0.733 0 C-N-CA 125.191 1.397 . . . . 0.0 109.639 178.103 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -74.63 165.58 31.26 Favored 'Trans proline' 0 CA--C 1.537 0.645 0 C-N-CA 123.375 2.717 . . . . 0.0 111.869 -176.84 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 64.4 pttt -59.49 -27.99 66.63 Favored 'General case' 0 N--CA 1.477 0.894 0 N-CA-C 114.23 1.196 . . . . 0.0 114.23 -176.597 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 58.5 m -92.02 88.59 6.62 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 105.545 -2.02 . . . . 0.0 105.545 168.392 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 15.4 ttpp -53.18 127.71 25.28 Favored 'General case' 0 CA--C 1.548 0.888 0 N-CA-C 114.291 1.219 . . . . 0.0 114.291 -167.604 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 34.9 ptt180 . . . . . 0 C--O 1.253 1.271 0 C-N-CA 125.827 1.651 . . . . 0.0 113.07 170.06 . . . . . . . . 0 0 . 1 . 039 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.685 0 N-CA-C 110.816 -0.913 . . . . 0.0 110.816 . . . . . . . . . 0 0 . 1 . 039 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 8.5 tp -46.67 -42.27 5.51 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.269 0 N-CA-C 116.257 1.947 . . . . 0.0 116.257 -166.972 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 67.6 t -68.71 -43.49 82.99 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 CA-C-N 118.619 0.645 . . . . 0.0 112.253 -171.896 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -75.45 -38.22 59.82 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 118.109 0.413 . . . . 0.0 111.505 170.372 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 52.3 tt0 -67.24 -43.53 81.73 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 125.129 1.372 . . . . 0.0 113.587 -171.058 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 41.6 m -70.04 -20.4 63.25 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 173.166 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 23.1 t -99.36 -38.2 8.93 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 118.929 0.786 . . . . 0.0 112.592 -171.972 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 67.5 p -86.74 -20.46 27.64 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 125.496 1.518 . . . . 0.0 113.416 176.412 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.5 t -138.88 -170.68 2.91 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.238 1.415 . . . . 0.0 110.725 174.361 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 78.0 mt -91.58 135.31 27.38 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 C-N-CA 124.884 1.273 . . . . 0.0 108.987 176.229 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 15.2 p -121.97 -176.11 3.26 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.217 1.007 . . . . 0.0 112.016 172.189 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 95.7 p -143.48 165.39 27.68 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 125.046 1.339 . . . . 0.0 112.294 -172.671 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 43.0 mt -58.17 -33.23 69.01 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.238 0.615 . . . . 0.0 112.106 177.731 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 71.9 t80 -65.75 -28.94 69.4 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.139 0.976 . . . . 0.0 113.23 174.25 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 54.2 mt-30 -80.1 -32.7 39.15 Favored 'General case' 0 CA--C 1.538 0.483 0 O-C-N 121.509 -0.744 . . . . 0.0 111.321 173.175 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 91.0 mt -65.94 -44.32 85.43 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 118.888 0.767 . . . . 0.0 111.495 171.763 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.0 mm-40 -52.14 -38.04 56.31 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 125.661 1.584 . . . . 0.0 112.959 172.648 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.9 t30 -62.05 -24.38 67.05 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 113.373 0.879 . . . . 0.0 113.373 -178.64 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 79.0 m-85 -105.6 12.63 30.99 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.441 1.496 . . . . 0.0 113.929 179.456 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 78.3 m -82.14 164.58 21.2 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 123.855 0.862 . . . . 0.0 110.722 167.201 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 13.8 m120 . . . . . 0 C--O 1.254 1.295 0 CA-C-O 118.243 -0.884 . . . . 0.0 112.432 170.917 . . . . . . . . 0 0 . 1 . 039 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 47.9 t80 . . . . . 0 N--CA 1.486 1.351 0 CA-C-O 119.705 -0.188 . . . . 0.0 110.612 . . . . . . . . . 0 0 . 1 . 039 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 27.6 m -64.35 -24.4 35.58 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 N-CA-C 114.513 1.301 . . . . 0.0 114.513 -173.147 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 16.8 m120 -128.19 127.74 43.49 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 126.167 1.787 . . . . 0.0 109.095 169.825 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 3.3 tt0 -169.92 166.35 9.43 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 119.139 0.881 . . . . 0.0 112.948 -170.283 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 99.4 m-70 -85.97 142.74 28.58 Favored 'General case' 0 CA--C 1.549 0.931 0 N-CA-C 108.412 -0.959 . . . . 0.0 108.412 164.198 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 75.9 mt -145.73 126.75 14.6 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 126.092 1.757 . . . . 0.0 109.477 176.098 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 92.4 m -124.92 146.04 49.54 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 125.135 1.374 . . . . 0.0 111.253 179.474 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 45.95 -122.11 5.71 Favored Glycine 0 N--CA 1.473 1.127 0 C-N-CA 125.314 1.435 . . . . 0.0 115.021 168.568 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 67.8 p -52.42 -40.11 61.78 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 125.034 1.334 . . . . 0.0 113.301 -179.931 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 2.2 m80 -70.84 -37.92 73.18 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.217 -0.927 . . . . 0.0 111.019 -177.933 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 60.6 tp -66.11 -45.0 82.66 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.346 0.658 . . . . 0.0 111.49 171.915 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 53.2 t -61.54 -43.42 96.89 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 C-N-CA 123.802 0.841 . . . . 0.0 110.99 178.766 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -65.58 -41.66 92.64 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 118.767 0.712 . . . . 0.0 112.332 173.016 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.76 -41.79 96.14 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 119.667 1.122 . . . . 0.0 112.111 174.938 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 54.8 mt -61.21 -44.24 97.6 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 123.524 0.729 . . . . 0.0 111.317 173.627 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 13.9 m-30 -58.86 -43.41 90.84 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 119.495 1.043 . . . . 0.0 112.025 175.138 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 8.3 mp -67.46 -45.45 75.94 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 124.083 0.953 . . . . 0.0 112.427 177.28 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 45.5 t -69.4 -48.71 65.62 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 C-N-CA 123.351 0.661 . . . . 0.0 111.637 -178.506 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 62.6 m -70.6 -39.0 74.06 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 118.53 0.605 . . . . 0.0 112.281 -176.936 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.58 -137.76 42.38 Favored Glycine 0 CA--C 1.527 0.815 0 C-N-CA 124.281 0.944 . . . . 0.0 112.347 176.863 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -63.94 -15.84 60.09 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 114.549 1.314 . . . . 0.0 114.549 -177.861 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 91.6 mtm180 -67.1 -35.13 79.13 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 123.818 0.847 . . . . 0.0 112.727 175.994 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 94.44 154.2 30.8 Favored Glycine 0 CA--C 1.533 1.212 0 C-N-CA 125.34 1.448 . . . . 0.0 113.322 -172.401 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 53.7 p90 -93.41 153.84 18.28 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 125.946 1.698 . . . . 0.0 111.326 176.962 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 20.4 t80 -144.06 21.12 1.76 Allowed 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 124.302 1.041 . . . . 0.0 112.953 -173.483 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 17.3 p90 -65.89 147.25 53.66 Favored 'General case' 0 CA--C 1.55 0.951 0 O-C-N 120.715 -1.241 . . . . 0.0 113.181 178.067 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' B' B ' 27' ' ' THR . . . . . 0.583 ' H ' ' CD ' ' B' ' 28' ' ' PRO . 74.3 p -139.81 -26.98 0.01 OUTLIER Pre-proline 0 N--CA 1.479 1.009 0 CA-C-O 115.532 -2.175 . . . . 0.0 116.105 178.436 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' B' B ' 28' ' ' PRO . . . . . 0.583 ' CD ' ' H ' ' B' ' 27' ' ' THR . 94.5 Cg_exo -54.72 144.61 64.41 Favored 'Trans proline' 0 C--N 1.361 1.201 0 C-N-CA 122.969 2.446 . . . . 0.0 114.277 -177.207 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 58.0 tttt 53.16 2.22 0.02 OUTLIER 'General case' 0 CA--C 1.557 1.235 0 C-N-CA 127.818 2.447 . . . . 0.0 116.509 178.992 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 20.0 p -127.28 -57.88 1.29 Allowed 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 125.753 1.621 . . . . 0.0 111.411 -171.92 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 29.4 mtpp -105.05 -25.03 12.7 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 124.955 1.302 . . . . 0.0 112.927 179.362 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.134 0 C-N-CA 125.846 1.658 . . . . 0.0 113.147 176.488 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.709 0 N-CA-C 111.92 -0.472 . . . . 0.0 111.92 . . . . . . . . . 0 0 . 1 . 040 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 10.3 tp -80.09 -44.04 22.5 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.109 0 N-CA-C 113.997 1.11 . . . . 0.0 113.997 -172.387 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 9.9 p -64.82 -34.49 70.59 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.295 0 CA-C-N 119.54 1.064 . . . . 0.0 112.587 -176.338 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 26.6 pt-20 -71.57 -3.69 22.82 Favored 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 113.95 1.092 . . . . 0.0 113.95 174.472 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 53.6 tp60 -104.05 -58.62 1.85 Allowed 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.165 0.986 . . . . 0.0 109.042 167.906 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 58.9 m -68.99 -25.99 64.79 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 114.701 1.371 . . . . 0.0 114.701 -169.524 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 11.7 t -80.85 -39.89 25.76 Favored 'General case' 0 N--CA 1.472 0.631 0 O-C-N 121.57 -0.706 . . . . 0.0 112.22 -175.744 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 24.5 p -95.1 -31.09 13.72 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 126.238 1.815 . . . . 0.0 112.686 -177.498 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 10.7 t -129.35 -169.75 2.16 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.975 1.71 . . . . 0.0 110.761 178.27 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 33.2 mm -87.92 146.71 5.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 C-N-CA 125.049 1.34 . . . . 0.0 111.273 -174.381 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 4.1 m -124.27 159.23 30.69 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 122.637 1.208 . . . . 0.0 114.006 170.742 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 17.7 t -130.78 157.23 43.4 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 127.598 2.359 . . . . 0.0 110.533 173.884 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 17.5 mt -59.7 -26.05 65.28 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 114.284 1.216 . . . . 0.0 114.284 -169.552 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 92.7 t80 -59.8 -33.69 72.06 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 121.548 -0.72 . . . . 0.0 112.572 173.227 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 68.3 mt-30 -78.88 -32.48 45.91 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.768 1.227 . . . . 0.0 111.122 179.376 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -63.02 -50.48 70.51 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.755 0.822 . . . . 0.0 109.681 170.489 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -60.33 -33.54 72.54 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 113.499 0.925 . . . . 0.0 113.499 178.308 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 19.1 t-20 -61.16 -24.0 65.97 Favored 'General case' 0 CA--C 1.548 0.889 0 N-CA-C 114.146 1.165 . . . . 0.0 114.146 -177.577 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 58.7 m-85 -106.73 3.84 27.06 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.612 1.565 . . . . 0.0 114.132 179.081 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 89.4 m -84.34 165.75 17.99 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.112 0.965 . . . . 0.0 113.422 173.652 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.252 1.228 0 C-N-CA 125.28 1.432 . . . . 0.0 110.731 -176.342 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 78.4 t80 . . . . . 0 N--CA 1.489 1.495 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 . . . . . . . . . 0 0 . 1 . 040 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 14.3 p -67.93 131.04 33.48 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.246 0 CA-C-N 119.085 0.857 . . . . 0.0 111.796 -176.294 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 19.1 t30 -166.83 102.15 0.56 Allowed 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.142 1.777 . . . . 0.0 108.143 -169.843 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -163.78 167.05 21.39 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 123.483 0.713 . . . . 0.0 111.664 -166.545 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 96.2 m-70 -70.79 146.18 49.91 Favored 'General case' 0 CA--C 1.549 0.916 0 O-C-N 121.06 -1.025 . . . . 0.0 111.489 168.918 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 74.5 mt -145.2 134.27 22.67 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 125.768 1.627 . . . . 0.0 109.848 174.113 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 5.5 t -148.08 153.11 38.47 Favored 'General case' 0 N--CA 1.47 0.553 0 O-C-N 121.198 -0.938 . . . . 0.0 112.76 179.366 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 54.18 -128.18 40.54 Favored Glycine 0 N--CA 1.471 0.99 0 C-N-CA 124.635 1.112 . . . . 0.0 113.54 172.68 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 76.4 p -53.13 -37.08 61.49 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 125.036 1.335 . . . . 0.0 113.065 177.436 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 5.3 m80 -74.88 -36.41 62.27 Favored 'General case' 0 CA--C 1.54 0.581 0 O-C-N 121.486 -0.759 . . . . 0.0 111.24 -178.851 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 56.1 tp -67.61 -43.99 79.11 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 123.304 0.642 . . . . 0.0 111.48 172.646 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 46.8 t -59.85 -46.65 93.54 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 C-N-CA 124.351 1.06 . . . . 0.0 110.659 175.437 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -63.3 -42.97 99.08 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.154 0.582 . . . . 0.0 111.462 175.561 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.15 -42.13 98.0 Favored 'General case' 0 CA--C 1.536 0.415 0 O-C-N 121.255 -0.903 . . . . 0.0 112.166 176.999 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 43.5 mt -59.08 -42.67 90.97 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 118.796 0.725 . . . . 0.0 111.219 175.736 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 36.9 m-85 -68.64 -37.4 79.66 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 113.554 0.946 . . . . 0.0 113.554 173.796 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 65.2 mt -67.77 -42.75 81.24 Favored 'General case' 0 N--CA 1.473 0.715 0 O-C-N 121.066 -1.021 . . . . 0.0 112.178 176.663 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 74.6 t -72.26 -48.92 46.3 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 124.484 1.114 . . . . 0.0 111.27 -179.271 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 61.9 m -97.82 -7.99 29.33 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 114.702 1.371 . . . . 0.0 114.702 -169.777 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 83.37 -161.32 38.99 Favored Glycine 0 N--CA 1.469 0.864 0 C-N-CA 125.451 1.501 . . . . 0.0 113.179 179.627 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 2.9 pm0 -63.92 -12.39 36.67 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.445 1.498 . . . . 0.0 114.167 -178.879 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 57.8 mtm180 -57.4 -38.16 73.84 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 124.923 1.289 . . . . 0.0 112.675 171.607 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 69.83 -150.47 49.27 Favored Glycine 0 CA--C 1.532 1.095 0 C-N-CA 124.171 0.891 . . . . 0.0 112.326 -172.302 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 53.5 p90 -141.42 155.81 45.84 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.988 1.315 . . . . 0.0 113.226 -170.206 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 74.2 t80 -90.03 -25.71 20.68 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.649 1.18 . . . . 0.0 113.12 -175.989 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 63.2 t80 -65.71 148.77 51.22 Favored 'General case' 0 CA--C 1.543 0.676 0 N-CA-C 114.765 1.395 . . . . 0.0 114.765 -173.034 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 20.8 p -115.66 114.92 42.0 Favored Pre-proline 0 N--CA 1.476 0.85 0 C-N-CA 126.042 1.737 . . . . 0.0 109.511 171.962 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -57.25 136.25 75.18 Favored 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 123.632 2.888 . . . . 0.0 112.719 178.279 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 19.9 ptmt -66.37 -15.7 63.49 Favored 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 114.004 1.112 . . . . 0.0 114.004 -178.478 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 22.8 p -81.58 -32.47 32.09 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 127.216 2.207 . . . . 0.0 112.238 172.614 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 16.5 tppt? -90.59 -37.89 13.51 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.267 1.427 . . . . 0.0 113.232 -178.241 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 76.6 ttt-85 . . . . . 0 C--O 1.252 1.198 0 C-N-CA 126.106 1.762 . . . . 0.0 112.445 -179.196 . . . . . . . . 0 0 . 1 . 041 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.555 0 N-CA-C 111.532 -0.627 . . . . 0.0 111.532 . . . . . . . . . 0 0 . 1 . 041 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 18.1 tt -54.93 -33.91 29.88 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.074 0 C-N-CA 125.434 1.493 . . . . 0.0 114.675 -170.171 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 4.9 p -61.68 -26.91 41.02 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 C-N-CA 123.747 0.819 . . . . 0.0 112.411 178.827 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -73.0 -5.08 36.43 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.17 0.988 . . . . 0.0 112.649 177.099 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 24.2 tt0 -113.78 -56.64 2.38 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.265 1.026 . . . . 0.0 110.06 170.441 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 12.4 m -67.36 -24.1 65.67 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 115.393 1.627 . . . . 0.0 115.393 -173.361 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 34.5 t -91.73 -47.95 7.08 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 119.608 1.095 . . . . 0.0 112.214 -178.977 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 5.3 t -71.19 -29.95 65.8 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.429 1.092 . . . . 0.0 113.131 -178.946 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.2 t -131.76 -173.36 3.11 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.855 1.262 . . . . 0.0 111.231 175.758 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 61.8 mt -84.03 140.56 15.98 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 C-N-CA 124.639 1.176 . . . . 0.0 109.885 177.209 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 12.9 p -136.38 154.89 50.68 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 122.207 1.003 . . . . 0.0 113.165 170.136 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 8.4 t -119.04 173.09 7.11 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 126.047 1.739 . . . . 0.0 111.776 178.823 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 62.9 mt -56.46 -33.81 66.28 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.255 1.422 . . . . 0.0 112.946 -171.13 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 90.5 t80 -60.89 -34.61 74.9 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 123.817 0.847 . . . . 0.0 112.784 175.121 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -79.09 -28.84 43.08 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 124.527 1.131 . . . . 0.0 111.036 177.927 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 58.8 mt -67.29 -50.16 61.43 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 123.356 0.662 . . . . 0.0 110.404 170.466 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -63.9 -27.04 68.88 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.067 0.947 . . . . 0.0 113.147 178.129 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 17.6 t30 -61.35 -35.23 76.87 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 124.319 1.048 . . . . 0.0 113.292 -179.376 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 26.0 m-85 -81.21 -24.64 37.31 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 113.652 0.982 . . . . 0.0 113.652 177.479 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 69.2 m -71.83 149.34 45.33 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.051 1.34 . . . . 0.0 112.502 -178.689 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.251 1.165 0 C-N-CA 128.112 2.565 . . . . 0.0 112.439 -172.309 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 80.2 m-85 . . . . . 0 N--CA 1.487 1.4 0 CA-C-O 119.599 -0.238 . . . . 0.0 111.142 . . . . . . . . . 0 0 . 1 . 041 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 22.7 t 86.82 -58.6 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.287 0 C-N-CA 129.077 2.951 . . . . 0.0 110.264 177.064 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 16.1 p-10 -86.03 104.06 15.29 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 123.317 0.647 . . . . 0.0 109.402 168.828 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -146.06 171.08 15.42 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.136 1.374 . . . . 0.0 111.412 -169.099 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 48.2 m-70 -80.82 138.64 36.23 Favored 'General case' 0 CA--C 1.549 0.912 0 O-C-N 121.044 -1.035 . . . . 0.0 108.923 167.113 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 30.8 mt -138.9 135.61 34.63 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 125.778 1.631 . . . . 0.0 109.335 175.305 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 1.8 t -141.63 148.82 39.8 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 -174.65 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 53.95 -135.37 43.2 Favored Glycine 0 N--CA 1.47 0.94 0 C-N-CA 124.765 1.174 . . . . 0.0 114.127 169.94 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 5.6 m -59.12 -26.3 64.58 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 177.008 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -70.24 -36.89 74.79 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 120.239 1.381 . . . . 0.0 111.77 174.123 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 53.1 tp -70.33 -42.11 72.34 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.058 0.943 . . . . 0.0 111.675 172.763 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 78.2 t -60.65 -42.52 92.13 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.888 0 C-N-CA 123.096 0.558 . . . . 0.0 110.628 174.381 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -67.77 -39.17 84.16 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.855 0.862 . . . . 0.0 112.301 175.239 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -57.96 -42.27 84.66 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 121.359 -0.838 . . . . 0.0 111.234 171.633 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 6.7 mp -65.36 -39.07 91.87 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 118.815 0.734 . . . . 0.0 112.137 173.787 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 22.0 m-30 -59.66 -39.91 86.02 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-N 119.71 1.141 . . . . 0.0 112.08 174.372 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 88.4 mt -74.34 -51.27 15.63 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.58 1.152 . . . . 0.0 111.961 178.145 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 76.2 t -75.79 -37.07 34.71 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 C-N-CA 124.221 1.008 . . . . 0.0 112.133 -171.43 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 72.2 m -105.89 19.41 20.58 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.496 1.119 . . . . 0.0 113.695 -176.2 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -58.06 -29.05 61.88 Favored Glycine 0 CA--C 1.535 1.296 0 CA-C-N 119.149 0.886 . . . . 0.0 113.97 -179.268 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -94.38 -33.36 13.19 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.93 1.292 . . . . 0.0 112.979 172.475 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 35.6 mmt180 -68.93 -28.62 66.82 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 124.156 0.982 . . . . 0.0 113.284 178.948 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 86.08 107.25 0.75 Allowed Glycine 0 CA--C 1.529 0.957 0 N-CA-C 108.81 -1.716 . . . . 0.0 108.81 -167.293 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 13.4 p90 -74.23 152.92 39.64 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 -177.466 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 86.6 t80 -151.34 80.12 1.3 Allowed 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 125.142 1.377 . . . . 0.0 108.702 177.452 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 43.4 p90 -79.89 141.69 35.88 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.285 1.434 . . . . 0.0 112.859 -176.443 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 27.9 p -134.61 66.87 70.69 Favored Pre-proline 0 N--CA 1.477 0.9 0 C-N-CA 125.179 1.391 . . . . 0.0 113.142 -176.406 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -73.34 139.08 28.46 Favored 'Trans proline' 0 C--N 1.351 0.701 0 C-N-CA 123.06 2.507 . . . . 0.0 109.461 168.487 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 78.2 tttt -74.47 -46.15 41.51 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 113.26 0.837 . . . . 0.0 113.26 -170.24 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 38.7 m -150.31 -61.16 0.2 Allowed 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 125.915 1.686 . . . . 0.0 110.236 -175.507 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 29.4 tptp -81.61 141.7 33.47 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.471 1.108 . . . . 0.0 112.761 -176.203 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 31.3 mtp180 . . . . . 0 C--O 1.252 1.194 0 C-N-CA 126.535 1.934 . . . . 0.0 111.269 168.741 . . . . . . . . 0 0 . 1 . 042 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.585 0 N-CA-C 111.589 -0.604 . . . . 0.0 111.589 . . . . . . . . . 0 0 . 1 . 042 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 3.8 tt -105.61 -20.7 5.78 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.069 0 N-CA-C 115.051 1.5 . . . . 0.0 115.051 -176.882 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 3.9 p -62.03 -29.05 45.61 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.349 0 CA-C-N 121.325 1.875 . . . . 0.0 110.968 179.249 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -65.6 -10.37 34.97 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 126.254 1.822 . . . . 0.0 113.519 174.592 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 36.9 tt0 -111.29 -53.01 2.75 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.334 1.454 . . . . 0.0 109.9 169.152 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 85.2 m -60.73 -31.52 70.82 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 114.265 1.209 . . . . 0.0 114.265 -173.267 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 8.7 t -91.24 -20.82 21.51 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 113.253 0.835 . . . . 0.0 113.253 -173.894 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 30.0 p -104.14 -27.44 12.07 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 126.368 1.867 . . . . 0.0 112.715 179.988 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 10.3 t -144.01 -165.94 2.24 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.895 2.078 . . . . 0.0 110.163 -177.943 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 29.2 mm -87.65 144.23 9.66 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 C-N-CA 124.963 1.305 . . . . 0.0 110.804 178.082 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.8 p -138.44 179.07 6.68 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.518 1.527 . . . . 0.0 110.65 168.966 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 7.4 t -152.49 166.96 30.35 Favored 'General case' 0 N--CA 1.474 0.755 0 O-C-N 120.733 -1.23 . . . . 0.0 113.925 -174.045 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 26.9 mt -61.11 -34.48 75.02 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.647 1.579 . . . . 0.0 112.286 -170.625 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 87.1 t80 -60.74 -28.08 68.42 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.454 1.102 . . . . 0.0 112.993 175.553 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 41.8 mt-30 -82.96 -38.35 22.84 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 123.748 0.819 . . . . 0.0 111.23 173.276 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 84.9 mt -61.31 -34.5 75.34 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.908 0.883 . . . . 0.0 112.608 177.017 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -54.72 -32.21 59.33 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 113.423 0.898 . . . . 0.0 113.423 171.857 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 16.5 t-20 -68.18 -19.1 64.75 Favored 'General case' 0 CA--C 1.547 0.834 0 CA-C-N 118.92 0.782 . . . . 0.0 113.073 179.469 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 97.4 m-85 -98.1 4.55 49.13 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.568 1.547 . . . . 0.0 113.659 178.347 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 17.5 t -77.41 173.9 11.43 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 124.903 1.281 . . . . 0.0 111.312 168.481 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.049 0 C-N-CA 125.105 1.362 . . . . 0.0 111.531 169.634 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 75.8 m-85 . . . . . 0 N--CA 1.487 1.392 0 N-CA-C 107.757 -1.201 . . . . 0.0 107.757 . . . . . . . . . 0 0 . 1 . 042 nuclear build full ' B' B ' 2' ' ' VAL . . . . . 0.47 HG12 ' H ' ' B' ' 3' ' ' ASN . 4.2 t 69.28 176.9 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.706 0 C-N-CA 125.42 1.488 . . . . 0.0 108.934 -168.167 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' B' B ' 3' ' ' ASN . . . . . 0.47 ' H ' HG12 ' B' ' 2' ' ' VAL . 7.2 p30 -62.24 131.9 50.94 Favored 'General case' 0 CA--C 1.546 0.811 0 O-C-N 120.357 -1.464 . . . . 0.0 111.533 174.523 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 70.4 mt-30 -160.75 173.42 15.44 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.968 1.307 . . . . 0.0 111.032 -169.345 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 99.3 m-70 -87.49 139.24 30.75 Favored 'General case' 0 CA--C 1.549 0.915 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 165.093 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 5.0 mp -143.03 145.48 32.95 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 124.969 1.308 . . . . 0.0 111.116 177.717 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 1.8 t -156.35 151.3 26.2 Favored 'General case' 0 N--CA 1.468 0.445 0 O-C-N 121.212 -0.93 . . . . 0.0 112.022 178.935 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 53.52 -129.49 40.9 Favored Glycine 0 N--CA 1.472 1.053 0 C-N-CA 124.326 0.965 . . . . 0.0 114.044 172.625 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.5 m -57.16 -31.99 65.95 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 124.481 1.113 . . . . 0.0 113.79 178.854 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -71.42 -38.08 71.42 Favored 'General case' 0 CA--C 1.544 0.737 0 O-C-N 120.983 -1.073 . . . . 0.0 111.492 176.164 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 42.4 tp -67.85 -41.29 83.14 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 123.485 0.714 . . . . 0.0 110.844 174.183 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 40.4 t -59.31 -45.86 92.88 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.975 0 C-N-CA 124.542 1.137 . . . . 0.0 111.306 172.599 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -63.09 -43.51 98.31 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.456 0.702 . . . . 0.0 111.447 177.033 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -65.13 -39.85 93.62 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 121.35 -0.844 . . . . 0.0 112.406 177.075 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 48.7 mt -61.18 -42.54 98.75 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 118.521 0.6 . . . . 0.0 111.351 174.098 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 17.0 m-85 -62.26 -41.54 98.54 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 119.079 0.854 . . . . 0.0 112.613 172.291 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 73.3 mt -67.25 -43.12 82.7 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 123.668 0.787 . . . . 0.0 112.193 178.498 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 55.1 t -72.53 -44.55 61.17 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 C-N-CA 123.896 0.878 . . . . 0.0 112.384 -179.149 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 35.5 t -82.86 -24.98 32.99 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 113.397 0.888 . . . . 0.0 113.397 -177.914 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 74.35 -155.23 48.59 Favored Glycine 0 CA--C 1.529 0.962 0 C-N-CA 124.65 1.119 . . . . 0.0 112.422 -178.334 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -62.69 -12.16 21.87 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 114.455 1.279 . . . . 0.0 114.455 179.471 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 56.1 mtp85 -61.3 -31.04 70.87 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.939 1.296 . . . . 0.0 112.683 175.007 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.39 139.48 1.5 Allowed Glycine 0 CA--C 1.533 1.218 0 C-N-CA 125.56 1.552 . . . . 0.0 112.945 -178.706 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 7.1 p90 -74.7 160.61 30.55 Favored 'General case' 0 CA--C 1.541 0.626 0 O-C-N 121.933 -0.745 . . . . 0.0 112.97 177.48 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 76.8 t80 -91.24 -27.67 18.3 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 125.21 1.404 . . . . 0.0 112.79 175.352 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 18.3 t80 -117.44 139.8 50.42 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 126.196 1.799 . . . . 0.0 113.069 -170.99 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 26.2 p -110.57 155.28 42.39 Favored Pre-proline 0 N--CA 1.478 0.926 0 C-N-CA 125.149 1.38 . . . . 0.0 108.54 167.509 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_exo -50.82 129.16 26.64 Favored 'Trans proline' 0 C--N 1.351 0.696 0 C-N-CA 123.558 2.839 . . . . 0.0 112.636 -177.06 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 7.0 mtmp? 82.03 -3.81 1.5 Allowed 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 128.272 2.629 . . . . 0.0 113.452 179.946 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 39.4 p 98.05 -18.65 0.05 OUTLIER 'General case' 0 N--CA 1.493 1.725 1 C-N-CA 133.044 4.538 . . . . 0.0 111.907 -173.413 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -147.68 123.19 10.4 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 126.109 1.763 . . . . 0.0 109.926 172.357 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.215 0 C-N-CA 125.909 1.684 . . . . 0.0 114.387 -173.728 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.83 0 N-CA-C 111.763 -0.535 . . . . 0.0 111.763 . . . . . . . . . 0 0 . 1 . 043 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 11.7 pt -68.36 -18.64 23.59 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.392 0 N-CA-C 114.347 1.24 . . . . 0.0 114.347 -169.297 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 7.1 p -57.84 -34.14 47.45 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 C-N-CA 124.973 1.309 . . . . 0.0 112.695 -174.977 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -70.38 -47.82 59.1 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 118.252 0.478 . . . . 0.0 110.863 172.172 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -71.2 -43.9 66.47 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.674 0.789 . . . . 0.0 111.837 -171.414 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 67.8 m -58.92 -28.34 66.12 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 123.991 0.916 . . . . 0.0 112.415 172.932 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 8.7 t -83.09 -54.33 5.12 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.706 0.803 . . . . 0.0 111.466 -178.86 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 81.3 p -77.66 -21.66 51.82 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 124.517 1.127 . . . . 0.0 113.739 -177.03 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.7 t -143.49 -165.39 2.08 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.386 1.474 . . . . 0.0 111.126 -178.508 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 37.6 mt -99.39 132.82 44.09 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 C-N-CA 125.295 1.438 . . . . 0.0 109.887 -174.531 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 7.8 p -132.8 159.19 40.48 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.247 1.019 . . . . 0.0 112.858 178.962 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 77.3 p -108.94 163.39 13.34 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 114.661 1.356 . . . . 0.0 114.661 -169.687 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 75.2 mt -59.55 -30.26 68.5 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 121.398 -0.814 . . . . 0.0 112.567 174.781 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 94.0 t80 -63.79 -33.43 75.64 Favored 'General case' 0 N--CA 1.473 0.688 0 O-C-N 121.383 -0.823 . . . . 0.0 112.603 173.802 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 58.3 mt-30 -74.1 -37.5 64.12 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 123.414 0.685 . . . . 0.0 110.868 173.617 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 41.2 mt -60.8 -43.74 97.76 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 118.336 0.516 . . . . 0.0 112.156 171.465 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -59.07 -38.91 80.55 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.033 0.933 . . . . 0.0 112.538 172.465 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 -65.1 -22.68 66.98 Favored 'General case' 0 CA--C 1.552 1.048 0 O-C-N 121.436 -0.79 . . . . 0.0 112.981 174.368 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -90.58 -1.81 57.88 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 125.953 1.701 . . . . 0.0 114.271 173.482 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 78.2 m -71.95 158.84 35.27 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 119.973 1.26 . . . . 0.0 112.112 171.418 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 . . . . . 0 C--O 1.255 1.35 0 C-N-CA 125.155 1.382 . . . . 0.0 113.497 179.669 . . . . . . . . 0 0 . 1 . 043 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . 0.25 48.7 p90 . . . . . 0 N--CA 1.481 1.12 0 CA-C-O 117.107 -1.425 . . . . 0.0 113.267 . . . . . . . . . 1 1 . 1 . 043 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 3.5 p -176.29 -51.47 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 CA-C-N 121.228 1.831 . . . . 0.0 113.512 178.066 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 63.7 t30 -120.48 99.76 6.75 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 123.945 0.898 . . . . 0.0 110.158 -169.84 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 8.5 mt-30 -143.45 168.38 19.98 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 124.795 1.238 . . . . 0.0 113.056 -166.255 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 26.2 m-70 -77.54 135.34 38.19 Favored 'General case' 0 CA--C 1.549 0.926 0 N-CA-C 108.339 -0.985 . . . . 0.0 108.339 166.159 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 87.8 mt -144.1 128.51 17.93 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 125.961 1.704 . . . . 0.0 109.343 177.874 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 5.6 t -145.8 145.29 30.74 Favored 'General case' 0 N--CA 1.469 0.504 0 O-C-N 121.335 -0.853 . . . . 0.0 112.174 -179.495 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.08 -125.85 36.99 Favored Glycine 0 N--CA 1.469 0.842 0 C-N-CA 124.395 0.998 . . . . 0.0 113.354 175.926 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 28.9 p -56.4 -35.79 68.16 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.763 1.225 . . . . 0.0 113.448 178.487 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 94.8 m-70 -68.26 -39.71 82.11 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 120.78 -1.2 . . . . 0.0 111.945 176.872 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 38.4 tp -68.13 -42.7 79.8 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 123.734 0.813 . . . . 0.0 111.308 174.41 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 40.9 t -61.37 -42.21 92.82 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.973 0 C-N-CA 124.095 0.958 . . . . 0.0 111.315 174.878 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -63.93 -44.9 91.47 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 123.829 0.852 . . . . 0.0 111.528 174.537 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.79 -39.33 91.31 Favored 'General case' 0 CA--C 1.541 0.599 0 O-C-N 121.466 -0.771 . . . . 0.0 112.117 175.988 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 70.1 mt -66.08 -40.05 90.54 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 118.526 -0.749 . . . . 0.0 112.194 174.039 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 19.4 m-85 -60.18 -40.42 89.94 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 120.363 1.438 . . . . 0.0 112.236 170.943 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 81.0 mt -68.07 -44.69 75.73 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.632 0.773 . . . . 0.0 112.47 177.336 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 53.0 t -73.46 -47.82 44.03 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 123.725 0.81 . . . . 0.0 112.181 -179.258 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 56.7 m -80.84 -32.07 35.26 Favored 'General case' 0 N--CA 1.47 0.544 0 N-CA-C 113.227 0.825 . . . . 0.0 113.227 -174.205 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 66.75 -138.34 35.33 Favored Glycine 0 CA--C 1.53 1.0 0 C-N-CA 124.137 0.875 . . . . 0.0 111.999 -177.934 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -62.26 -21.39 65.15 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 124.775 1.23 . . . . 0.0 113.258 -178.684 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 89.4 mtm180 -61.79 -35.75 79.08 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.151 0.981 . . . . 0.0 112.939 178.326 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.68 -175.73 49.39 Favored Glycine 0 CA--C 1.533 1.21 0 C-N-CA 124.131 0.872 . . . . 0.0 113.033 -171.232 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 2.0 p90 -130.03 167.68 17.91 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.146 1.378 . . . . 0.0 114.48 -170.442 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 58.1 t80 -93.38 1.53 56.87 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 127.303 2.241 . . . . 0.0 113.125 176.837 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 76.7 t80 -52.05 141.46 18.2 Favored 'General case' 0 CA--C 1.546 0.798 0 N-CA-C 115.753 1.761 . . . . 0.0 115.753 -171.902 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -162.97 127.37 1.96 Allowed Pre-proline 0 N--CA 1.47 0.573 0 C-N-CA 127.347 2.259 . . . . 0.0 108.0 170.463 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -70.5 145.66 53.47 Favored 'Trans proline' 0 C--N 1.35 0.641 0 C-N-CA 123.2 2.6 . . . . 0.0 113.434 -169.033 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 35.9 mmtm -128.91 1.41 5.34 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 125.579 1.552 . . . . 0.0 113.056 173.481 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 12.7 p -97.27 -60.93 1.48 Allowed 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 127.52 2.328 . . . . 0.0 110.156 -178.483 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 23.0 ptmt -82.81 -3.61 56.93 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 125.662 1.585 . . . . 0.0 114.43 176.447 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 79.1 ttt180 . . . . . 0 C--O 1.252 1.203 0 C-N-CA 127.278 2.231 . . . . 0.0 110.867 -175.93 . . . . . . . . 0 0 . 1 . 044 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.353 0 N-CA-C 112.216 -0.353 . . . . 0.0 112.216 . . . . . . . . . 0 0 . 1 . 044 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 9.6 tp -92.62 -36.52 7.71 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 C-N-CA 124.33 1.052 . . . . 0.0 113.647 -175.488 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 41.5 t -68.49 -35.33 70.03 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.107 0 CA-C-N 120.02 1.282 . . . . 0.0 111.092 -172.625 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.3 pm0 -69.97 -9.9 56.74 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 113.64 0.978 . . . . 0.0 113.64 174.884 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 60.5 mt-30 -93.96 -58.48 2.23 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 118.706 0.684 . . . . 0.0 109.199 169.716 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 86.7 m -76.42 -27.93 56.44 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 115.689 1.736 . . . . 0.0 115.689 -169.395 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 16.3 t -85.41 -49.51 8.05 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 118.404 0.547 . . . . 0.0 110.726 179.65 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 15.3 m -64.75 -38.23 90.29 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 126.248 1.819 . . . . 0.0 111.924 -178.197 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 65.8 m -142.92 -176.0 4.73 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 125.592 1.557 . . . . 0.0 111.405 -173.898 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 95.6 mt -79.38 122.77 35.27 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 O-C-N 120.252 -1.53 . . . . 0.0 108.174 168.057 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 20.8 p -100.77 157.08 16.97 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.934 0.893 . . . . 0.0 111.407 170.627 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 37.5 t -79.97 152.9 29.25 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 120.948 -1.095 . . . . 0.0 112.067 175.51 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.432 HD22 ' H ' ' A' ' 13' ' ' LEU . 2.6 mm? -62.11 -28.43 69.62 Favored 'General case' 0 CA--C 1.543 0.709 0 O-C-N 121.038 -1.039 . . . . 0.0 110.721 170.77 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.7 t80 -66.8 -30.96 71.28 Favored 'General case' 0 CA--C 1.542 0.654 0 O-C-N 121.324 -0.86 . . . . 0.0 112.996 170.435 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 94.7 mt-30 -76.16 -33.96 59.37 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 121.453 -0.779 . . . . 0.0 110.879 175.361 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 93.9 mt -59.2 -49.87 76.19 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 119.192 0.906 . . . . 0.0 110.19 168.479 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -62.79 -29.5 70.75 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 114.249 1.203 . . . . 0.0 114.249 176.48 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -63.01 -24.83 68.1 Favored 'General case' 0 CA--C 1.548 0.868 0 CA-C-N 119.527 1.058 . . . . 0.0 113.012 -179.306 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 52.9 m-85 -95.15 2.95 55.16 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.427 1.491 . . . . 0.0 113.624 173.732 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 95.4 m -103.76 124.72 49.41 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 121.218 -0.926 . . . . 0.0 112.966 179.753 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.252 1.225 0 C-N-CA 127.254 2.221 . . . . 0.0 112.843 -169.262 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 45.6 p90 . . . . . 0 N--CA 1.485 1.294 0 CA-C-O 119.745 -0.169 . . . . 0.0 110.887 . . . . . . . . . 0 0 . 1 . 044 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 22.4 m -138.03 151.14 25.08 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 C-N-CA 124.983 1.313 . . . . 0.0 111.093 171.638 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 60.8 t30 -77.92 179.69 6.58 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 124.233 1.013 . . . . 0.0 111.61 170.447 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 15.8 mp0 -107.68 169.89 8.32 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.828 1.651 . . . . 0.0 110.914 177.838 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 15.1 m-70 -71.28 139.62 50.05 Favored 'General case' 0 CA--C 1.545 0.763 0 O-C-N 121.376 -0.827 . . . . 0.0 109.013 167.481 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 73.7 mt -135.03 126.23 28.09 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 125.478 1.511 . . . . 0.0 108.875 179.699 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.6 t -144.36 150.02 37.1 Favored 'General case' 0 N--CA 1.47 0.538 0 O-C-N 121.691 -0.63 . . . . 0.0 112.02 -176.903 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 56.83 -128.79 47.94 Favored Glycine 0 CA--C 1.529 0.908 0 C-N-CA 124.344 0.973 . . . . 0.0 113.588 174.244 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 26.5 p -56.43 -37.48 70.27 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.853 1.261 . . . . 0.0 113.044 177.516 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 68.4 m-70 -73.51 -29.26 62.37 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 119.615 1.098 . . . . 0.0 112.689 177.452 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 39.5 tp -71.93 -42.42 66.7 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 121.144 -0.973 . . . . 0.0 111.402 170.654 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 21.7 t -57.64 -47.91 84.48 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 C-N-CA 124.285 1.034 . . . . 0.0 110.896 171.286 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -58.37 -47.56 83.42 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.542 1.537 . . . . 0.0 111.677 174.589 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.86 -43.68 98.14 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 118.671 0.669 . . . . 0.0 112.21 177.778 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 44.8 mt -61.04 -42.75 99.06 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 118.619 0.645 . . . . 0.0 111.454 176.384 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 16.8 m-85 -61.22 -45.28 95.22 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.046 0.839 . . . . 0.0 112.491 172.776 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 78.2 mt -68.06 -42.6 80.21 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.788 0.835 . . . . 0.0 112.966 -179.5 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 54.6 t -73.99 -44.69 50.44 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 124.524 1.13 . . . . 0.0 111.606 -178.079 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 65.9 m -99.71 -18.93 17.01 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 114.984 1.475 . . . . 0.0 114.984 -169.896 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 61.72 -133.07 47.11 Favored Glycine 0 CA--C 1.533 1.158 0 CA-C-N 118.973 0.806 . . . . 0.0 112.633 177.571 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 5.3 pm0 -66.93 -11.97 58.05 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.7 1.6 . . . . 0.0 115.223 -176.799 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 69.8 mtp180 -60.22 -38.01 82.05 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.859 0.863 . . . . 0.0 112.478 176.134 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.62 166.62 9.6 Favored Glycine 0 CA--C 1.536 1.362 0 C-N-CA 124.087 0.851 . . . . 0.0 112.364 -170.393 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 47.6 p90 -130.83 147.79 52.53 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.019 1.328 . . . . 0.0 112.98 -174.479 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 39.4 t80 -94.37 91.43 6.68 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 125.789 1.636 . . . . 0.0 109.457 172.424 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 15.9 t80 -71.36 127.81 33.82 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 121.718 -0.614 . . . . 0.0 111.597 -177.156 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 3.9 p -136.83 108.02 9.06 Favored Pre-proline 0 N--CA 1.477 0.908 0 C-N-CA 124.974 1.31 . . . . 0.0 110.394 -172.934 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -81.87 170.96 13.51 Favored 'Trans proline' 0 C--N 1.355 0.881 0 C-N-CA 124.481 3.454 . . . . 0.0 113.654 -170.355 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 27.4 mtpp -61.79 -23.5 66.24 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 124.529 1.132 . . . . 0.0 113.917 176.064 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 2.2 t -88.0 -2.93 58.91 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 126.424 1.89 . . . . 0.0 113.243 174.413 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 82.3 tttt 76.64 -49.97 0.57 Allowed 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 128.926 2.891 . . . . 0.0 113.354 177.479 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 72.9 ttp85 . . . . . 0 C--O 1.252 1.233 0 C-N-CA 126.793 2.037 . . . . 0.0 111.667 -179.998 . . . . . . . . 0 0 . 1 . 045 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.44 0 N-CA-C 110.512 -1.035 . . . . 0.0 110.512 . . . . . . . . . 0 0 . 1 . 045 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 20.1 tt -165.35 -47.17 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.219 0 C-N-CA 124.493 1.117 . . . . 0.0 112.474 -177.292 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 3' ' ' VAL . . . . . 0.562 HG21 ' HA ' ' B' ' 28' ' ' PRO . 58.0 t -58.74 -44.92 91.18 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.058 0 C-N-CA 124.367 1.067 . . . . 0.0 110.408 -177.003 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.0 pm0 -66.63 -11.31 53.08 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.633 1.573 . . . . 0.0 113.819 177.671 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 26.3 mm100 -95.27 -53.11 3.9 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.457 1.103 . . . . 0.0 109.561 168.833 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 84.8 m -61.06 -34.91 75.64 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.939 1.296 . . . . 0.0 114.153 -174.749 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 72.7 m -72.79 -46.08 55.17 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 121.244 -0.91 . . . . 0.0 111.147 174.995 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 21.7 m -77.15 -32.33 56.23 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 126.723 2.009 . . . . 0.0 112.849 -170.442 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.4 t -150.91 -168.96 3.25 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 126.069 1.748 . . . . 0.0 110.865 -176.167 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 62.5 mt -79.45 136.08 24.35 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 O-C-N 120.681 -1.262 . . . . 0.0 110.322 175.658 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.6 p -127.28 160.69 30.56 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.311 1.044 . . . . 0.0 112.402 173.731 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 33.5 t -101.26 154.02 19.12 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 114.194 1.183 . . . . 0.0 114.194 -168.848 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 32.2 mt -62.21 -30.64 71.23 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.139 0.976 . . . . 0.0 111.702 174.121 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 87.5 t80 -61.6 -34.72 76.12 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 123.695 0.798 . . . . 0.0 112.716 171.985 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 58.8 mt-30 -72.1 -43.74 64.31 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.423 0.689 . . . . 0.0 109.797 176.363 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 95.3 mt -57.23 -49.45 76.0 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 122.979 0.512 . . . . 0.0 111.734 174.411 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -62.77 -28.35 69.92 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 113.243 0.831 . . . . 0.0 113.243 178.166 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -81.19 -38.94 26.24 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 124.221 1.008 . . . . 0.0 112.942 179.039 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 20.7 m-85 -84.58 -6.46 59.37 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 114.55 1.315 . . . . 0.0 114.55 179.64 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 39.4 t -70.72 174.38 6.05 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 124.45 1.1 . . . . 0.0 112.07 168.076 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 14.6 t-20 . . . . . 0 C--O 1.251 1.178 0 C-N-CA 125.304 1.442 . . . . 0.0 113.313 -176.645 . . . . . . . . 0 0 . 1 . 045 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 34.1 t80 . . . . . 0 N--CA 1.487 1.381 0 CA-C-O 119.884 -0.103 . . . . 0.0 111.017 . . . . . . . . . 0 0 . 1 . 045 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 19.1 t -79.37 -19.92 12.6 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.362 0 O-C-N 120.784 -1.198 . . . . 0.0 113.049 -169.75 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 24.2 t30 -60.92 94.85 0.03 OUTLIER 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 125.586 1.554 . . . . 0.0 111.424 174.955 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -153.03 -170.69 3.7 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 126.415 1.886 . . . . 0.0 110.516 -168.804 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 19.9 m-70 -75.3 146.26 41.14 Favored 'General case' 0 CA--C 1.546 0.814 0 O-C-N 120.846 -1.159 . . . . 0.0 109.54 167.442 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 61.2 mt -146.5 133.02 19.73 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 126.535 1.934 . . . . 0.0 109.201 174.874 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.1 t -145.46 150.47 36.56 Favored 'General case' 0 N--CA 1.468 0.438 0 O-C-N 121.189 -0.944 . . . . 0.0 113.013 179.928 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 57.04 -129.99 50.29 Favored Glycine 0 N--CA 1.469 0.884 0 C-N-CA 124.929 1.252 . . . . 0.0 113.864 172.4 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 17.4 p -54.72 -43.28 72.46 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 124.348 1.059 . . . . 0.0 112.409 175.566 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -65.48 -34.83 79.19 Favored 'General case' 0 CA--C 1.542 0.666 0 O-C-N 121.117 -0.989 . . . . 0.0 112.256 178.919 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 62.2 tp -67.34 -44.87 78.03 Favored 'General case' 0 C--O 1.222 -0.371 0 CA-C-O 118.033 -0.984 . . . . 0.0 111.259 171.203 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 54.3 t -62.24 -43.41 97.93 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.078 0 CA-C-N 119.643 1.111 . . . . 0.0 111.25 178.975 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.1 mm-40 -60.79 -51.28 70.01 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 123.689 0.795 . . . . 0.0 111.224 173.8 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.89 -43.44 92.9 Favored 'General case' 0 CA--C 1.534 0.339 0 O-C-N 121.551 -0.718 . . . . 0.0 111.934 -177.5 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 62.0 tp -55.25 -47.14 75.85 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 125.339 1.456 . . . . 0.0 111.184 177.697 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -72.69 -39.34 67.12 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 119.134 0.879 . . . . 0.0 112.365 177.996 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 74.9 mt -66.92 -41.21 87.44 Favored 'General case' 0 N--CA 1.474 0.754 0 CA-C-N 118.95 0.796 . . . . 0.0 112.816 179.845 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 54.7 t -68.39 -34.86 68.17 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 C-N-CA 124.992 1.317 . . . . 0.0 111.566 176.33 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 42.7 t -80.97 -34.07 33.38 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 114.261 1.208 . . . . 0.0 114.261 -179.15 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 86.03 -145.34 20.64 Favored Glycine 0 CA--C 1.533 1.182 0 C-N-CA 125.197 1.38 . . . . 0.0 113.42 179.786 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -59.27 -22.75 61.63 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 126.232 1.813 . . . . 0.0 114.593 -169.593 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 71.3 mtp180 -52.33 -38.33 58.36 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 125.419 1.487 . . . . 0.0 113.176 175.496 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.04 148.84 3.02 Favored Glycine 0 CA--C 1.533 1.186 0 C-N-CA 125.101 1.334 . . . . 0.0 112.263 -174.085 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 27.2 p90 -71.56 168.29 17.92 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 113.993 1.108 . . . . 0.0 113.993 -175.079 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 73.5 t80 -136.96 -60.34 0.69 Allowed 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.854 1.262 . . . . 0.0 111.96 -177.486 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 15.6 t80 -74.16 114.15 12.17 Favored 'General case' 0 CA--C 1.546 0.814 0 O-C-N 121.75 -0.594 . . . . 0.0 112.373 -172.672 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 23.3 p -78.29 155.43 79.37 Favored Pre-proline 0 N--CA 1.48 1.029 0 C-N-CA 125.85 1.66 . . . . 0.0 112.167 -178.686 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' B' B ' 28' ' ' PRO . . . . . 0.562 ' HA ' HG21 ' A' ' 3' ' ' VAL . 60.1 Cg_endo -73.27 108.04 2.52 Favored 'Trans proline' 0 C--N 1.352 0.723 0 C-N-CA 123.537 2.825 . . . . 0.0 111.47 -176.88 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt -76.56 -24.83 53.56 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 114.223 1.194 . . . . 0.0 114.223 -169.69 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 6.2 t -92.54 -30.57 15.6 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 125.119 1.368 . . . . 0.0 113.027 -177.077 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm -91.02 -19.85 22.75 Favored 'General case' 0 CA--C 1.547 0.857 0 N-CA-C 114.461 1.282 . . . . 0.0 114.461 -178.226 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 32.0 tpt180 . . . . . 0 C--O 1.252 1.221 0 C-N-CA 124.751 1.22 . . . . 0.0 112.133 176.566 . . . . . . . . 0 0 . 1 . 046 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.296 0 N-CA-C 111.239 -0.744 . . . . 0.0 111.239 . . . . . . . . . 0 0 . 1 . 046 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 11.3 tt -72.32 -41.54 65.62 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.988 0 N-CA-C 113.042 0.756 . . . . 0.0 113.042 -173.379 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 9.8 p -68.78 -28.12 38.58 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 O-C-N 121.64 -0.662 . . . . 0.0 111.827 -176.596 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 37.2 mp0 -68.75 -12.9 61.99 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 123.853 0.861 . . . . 0.0 113.045 173.018 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 5.5 tp60 -97.99 -58.35 2.0 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.022 0.929 . . . . 0.0 110.347 169.199 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 34.7 m -70.77 -27.13 63.69 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 114.675 1.361 . . . . 0.0 114.675 -170.095 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 10.6 t -81.28 -38.8 26.24 Favored 'General case' 0 N--CA 1.472 0.646 0 O-C-N 120.868 -1.145 . . . . 0.0 111.105 175.288 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 28.7 m -69.61 -38.99 77.49 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 126.881 2.072 . . . . 0.0 112.586 -177.614 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 21.5 m -143.52 166.41 24.88 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 124.711 1.205 . . . . 0.0 111.304 -178.035 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 70.0 mt -58.93 128.78 20.2 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 O-C-N 121.129 -0.982 . . . . 0.0 109.326 169.447 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 15.1 p -120.37 154.6 34.86 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 122.066 0.936 . . . . 0.0 112.29 175.926 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 47.4 t -98.01 153.85 18.1 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 124.497 1.119 . . . . 0.0 112.621 -174.103 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 10.7 mp -61.61 -26.94 68.3 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.861 0.864 . . . . 0.0 111.503 174.21 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 93.5 t80 -59.31 -37.92 78.95 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 123.574 0.75 . . . . 0.0 112.669 169.582 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 68.9 mt-30 -75.62 -39.81 57.3 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 124.155 0.982 . . . . 0.0 110.567 178.418 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 78.6 mt -58.68 -53.76 54.71 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.128 0.971 . . . . 0.0 111.201 172.702 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -66.13 -30.34 70.82 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 -179.98 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 20.1 t30 -66.15 -33.03 74.84 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 118.927 0.785 . . . . 0.0 112.326 172.678 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -73.96 -33.23 63.8 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.03 0.932 . . . . 0.0 112.652 172.856 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 87.5 m -71.17 177.15 3.97 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 125.451 1.5 . . . . 0.0 114.655 176.866 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 31.2 m120 . . . . . 0 C--O 1.256 1.431 0 C-N-CA 125.549 1.54 . . . . 0.0 112.021 170.44 . . . . . . . . 0 0 . 1 . 046 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 41.2 t80 . . . . . 0 N--CA 1.487 1.41 0 CA-C-O 119.549 -0.262 . . . . 0.0 111.044 . . . . . . . . . 0 0 . 1 . 046 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 27.4 m -75.32 -36.37 36.08 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.42 0 O-C-N 121.209 -0.932 . . . . 0.0 113.366 -174.785 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -84.02 104.63 14.24 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.673 1.189 . . . . 0.0 108.022 169.268 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -169.73 -177.11 2.58 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.712 1.205 . . . . 0.0 110.336 -167.905 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 26.2 m-70 -71.83 136.74 47.14 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 164.472 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 84.4 mt -138.84 128.83 25.21 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 126.142 1.777 . . . . 0.0 109.176 -179.831 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.3 t -141.48 133.67 27.89 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 112.77 0.656 . . . . 0.0 112.77 -171.407 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 60.05 -126.88 42.81 Favored Glycine 0 CA--C 1.528 0.845 0 C-N-CA 124.361 0.982 . . . . 0.0 113.241 175.059 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 18.8 m -55.21 -32.81 62.53 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.281 1.032 . . . . 0.0 113.069 177.769 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 32.4 m80 -68.46 -39.0 81.58 Favored 'General case' 0 CA--C 1.542 0.662 0 O-C-N 121.043 -1.036 . . . . 0.0 111.732 177.465 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 32.1 tp -71.38 -41.26 69.87 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 124.255 1.022 . . . . 0.0 111.086 175.618 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 64.5 t -60.74 -43.29 94.86 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 123.597 0.759 . . . . 0.0 110.953 173.004 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -64.66 -41.77 95.86 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 123.643 0.777 . . . . 0.0 111.922 174.305 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.37 -45.26 94.14 Favored 'General case' 0 CA--C 1.535 0.399 0 O-C-N 121.568 -0.708 . . . . 0.0 111.483 174.396 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 51.6 mt -58.69 -44.1 90.19 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 123.627 0.771 . . . . 0.0 111.838 174.893 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 4.6 m-85 -56.01 -50.77 69.96 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.514 0.726 . . . . 0.0 112.126 172.593 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 8.4 mp -71.03 -42.23 69.79 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 123.522 0.729 . . . . 0.0 112.649 -176.573 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 69.2 t -76.02 -40.19 37.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 C-N-CA 124.624 1.17 . . . . 0.0 111.886 -174.224 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 58.5 m -95.61 -18.21 20.74 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 113.697 0.999 . . . . 0.0 113.697 -174.828 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 62.45 -140.32 46.19 Favored Glycine 0 CA--C 1.532 1.136 0 C-N-CA 124.761 1.172 . . . . 0.0 114.073 168.928 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -68.22 -13.95 62.62 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 124.951 1.3 . . . . 0.0 114.153 -174.111 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 57.0 mtm-85 -67.68 -26.08 66.01 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 123.867 0.867 . . . . 0.0 112.663 176.662 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.2 168.38 44.21 Favored Glycine 0 CA--C 1.531 1.051 0 C-N-CA 125.059 1.314 . . . . 0.0 112.908 -171.458 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 39.9 p90 -135.02 170.6 15.66 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.267 1.427 . . . . 0.0 112.437 -179.199 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 65.6 t80 -129.52 148.87 51.46 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.344 1.458 . . . . 0.0 110.169 172.021 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 63.2 t80 -156.8 125.21 5.7 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.743 1.217 . . . . 0.0 110.956 -174.437 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 50.3 m -152.17 124.41 3.92 Favored Pre-proline 0 N--CA 1.474 0.753 0 C-N-CA 124.869 1.268 . . . . 0.0 109.782 177.534 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -84.39 161.44 12.97 Favored 'Trans proline' 0 CA--C 1.536 0.618 0 C-N-CA 123.937 3.091 . . . . 0.0 111.056 169.401 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 58.2 tptt -59.16 -26.34 64.68 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.308 1.043 . . . . 0.0 113.245 177.522 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 31.2 p -72.02 -26.99 62.43 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 125.85 1.66 . . . . 0.0 113.624 178.001 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -109.36 -11.33 14.86 Favored 'General case' 0 N--CA 1.477 0.894 0 N-CA-C 114.563 1.32 . . . . 0.0 114.563 -176.848 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 75.6 ttt180 . . . . . 0 C--O 1.252 1.223 0 C-N-CA 124.859 1.263 . . . . 0.0 112.19 177.135 . . . . . . . . 0 0 . 1 . 047 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.42 0 N-CA-C 110.467 -1.053 . . . . 0.0 110.467 . . . . . . . . . 0 0 . 1 . 047 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 19.4 tt -166.21 -53.94 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 C-N-CA 125.687 1.595 . . . . 0.0 112.756 178.919 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 13.4 p -63.07 -31.91 54.31 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.129 0 CA-C-N 119.156 0.889 . . . . 0.0 112.523 -176.177 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 6.0 pm0 -72.46 -5.09 34.29 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.854 1.261 . . . . 0.0 113.618 175.768 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 47.2 tp60 -107.82 -52.83 2.71 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.257 1.423 . . . . 0.0 109.211 168.183 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 95.3 m -59.59 -35.1 73.63 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 114.238 1.199 . . . . 0.0 114.238 -175.423 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 19.0 t -82.74 -33.11 27.56 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 113.14 0.793 . . . . 0.0 113.14 -172.689 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 27.5 p -100.48 -26.85 13.71 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 126.388 1.875 . . . . 0.0 112.875 -175.701 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.7 t -138.98 -160.74 1.1 Allowed 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 126.114 1.766 . . . . 0.0 110.137 179.632 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 72.1 mt -97.81 140.03 18.8 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.71 0 O-C-N 120.546 -1.347 . . . . 0.0 110.109 -177.535 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 15.1 p -134.51 161.85 33.91 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 124.595 1.158 . . . . 0.0 112.66 173.983 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 60.1 p -109.16 165.64 11.45 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 115.174 1.546 . . . . 0.0 115.174 -170.647 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 11.0 mp -65.3 -30.25 71.09 Favored 'General case' 0 N--CA 1.47 0.549 0 O-C-N 121.454 -0.779 . . . . 0.0 111.726 171.831 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 80.1 t80 -63.63 -31.73 72.99 Favored 'General case' 0 CA--C 1.543 0.698 0 O-C-N 121.462 -0.774 . . . . 0.0 112.717 172.54 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 84.9 mt-30 -75.4 -36.34 60.86 Favored 'General case' 0 CA--C 1.537 0.46 0 O-C-N 121.483 -0.761 . . . . 0.0 111.495 172.593 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 86.7 mt -62.11 -42.11 98.9 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 119.374 0.988 . . . . 0.0 111.866 171.778 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -58.61 -27.11 64.37 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.748 1.219 . . . . 0.0 113.807 176.856 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.8 t30 -59.24 -28.01 66.3 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-N 119.125 0.875 . . . . 0.0 113.27 179.155 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 82.2 m-85 -100.55 6.98 44.33 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.508 1.523 . . . . 0.0 113.959 -178.522 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 54.2 m -89.39 153.42 20.86 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.194 0.998 . . . . 0.0 112.573 172.814 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.254 1.313 0 C-N-CA 126.589 1.956 . . . . 0.0 112.349 178.679 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . 0.263 12.0 p90 . . . . . 0 N--CA 1.486 1.352 0 CA-C-O 118.45 -0.786 . . . . 0.0 110.591 . . . . . . . . . 1 1 . 1 . 047 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 73.1 t -82.36 142.58 13.45 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.287 0 CA-C-N 120.203 1.365 . . . . 0.0 110.079 171.541 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -158.14 147.5 19.57 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 126.039 1.736 . . . . 0.0 112.551 177.57 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -162.54 170.62 18.32 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.825 1.25 . . . . 0.0 111.644 -170.304 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 96.6 m-70 -80.01 139.3 37.04 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 108.334 -0.988 . . . . 0.0 108.334 165.389 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 83.1 mt -148.76 133.81 18.19 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 125.24 1.416 . . . . 0.0 110.367 -179.581 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.6 t -152.36 147.64 26.54 Favored 'General case' 0 N--CA 1.473 0.693 0 O-C-N 121.112 -0.993 . . . . 0.0 113.078 178.183 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 57.88 -129.97 50.32 Favored Glycine 0 CA--C 1.528 0.861 0 C-N-CA 124.517 1.056 . . . . 0.0 112.79 176.174 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.4 m -54.29 -32.36 56.18 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 124.784 1.233 . . . . 0.0 113.335 177.46 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 24.0 m80 -70.81 -41.06 72.09 Favored 'General case' 0 CA--C 1.539 0.52 0 O-C-N 121.33 -0.857 . . . . 0.0 111.628 178.24 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 52.2 tp -67.84 -44.84 76.25 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 123.796 0.839 . . . . 0.0 110.52 174.395 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 25.6 t -56.37 -44.94 81.29 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.99 0 C-N-CA 124.499 1.12 . . . . 0.0 111.22 173.804 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -63.99 -41.77 97.41 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.174 0.59 . . . . 0.0 111.903 174.376 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.34 -41.0 98.21 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 118.881 0.764 . . . . 0.0 112.495 176.05 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -60.6 -46.26 90.93 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 119.234 0.925 . . . . 0.0 111.047 171.084 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 21.5 m-85 -61.81 -34.86 76.68 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 119.978 1.263 . . . . 0.0 113.137 176.117 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 71.9 mt -70.71 -43.99 67.84 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 123.783 0.833 . . . . 0.0 112.195 175.359 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 72.0 t -75.86 -40.9 39.31 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 CA-C-N 118.634 0.652 . . . . 0.0 112.021 -178.057 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 50.8 m -85.2 -23.31 28.35 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 114.011 1.115 . . . . 0.0 114.011 -179.104 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 79.53 -162.47 47.47 Favored Glycine 0 CA--C 1.53 0.999 0 C-N-CA 124.85 1.214 . . . . 0.0 112.673 -173.801 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -61.98 -11.84 15.44 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 125.053 1.341 . . . . 0.0 114.513 -178.58 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 87.9 mtm180 -60.02 -27.54 66.99 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 125.04 1.336 . . . . 0.0 113.537 173.786 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.05 -167.01 54.2 Favored Glycine 0 CA--C 1.533 1.182 0 C-N-CA 124.224 0.916 . . . . 0.0 112.05 -169.727 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 22.9 p90 -138.94 157.65 45.64 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.713 1.205 . . . . 0.0 113.969 -169.871 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 59.4 t80 -87.66 -14.46 39.91 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 126.265 1.826 . . . . 0.0 113.098 174.029 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 18.4 t80 -54.2 143.97 21.31 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 125.285 1.434 . . . . 0.0 113.562 178.27 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 15.3 t -153.89 141.21 13.46 Favored Pre-proline 0 CA--C 1.541 0.632 0 C-N-CA 127.382 2.273 . . . . 0.0 108.335 172.717 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -68.65 152.95 74.27 Favored 'Trans proline' 0 C--N 1.35 0.631 0 C-N-CA 122.637 2.225 . . . . 0.0 112.708 -171.923 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.15 -16.67 62.37 Favored 'General case' 0 CA--C 1.549 0.942 0 N-CA-C 114.691 1.367 . . . . 0.0 114.691 -174.432 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 12.9 m -67.53 -41.99 83.47 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 127.178 2.191 . . . . 0.0 111.645 -173.31 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 2.2 mtmm 172.86 150.46 0.07 Allowed 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 128.754 2.822 . . . . 0.0 111.485 178.175 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 40.7 ptt180 . . . . . 0 C--O 1.253 1.286 0 C-N-CA 125.382 1.473 . . . . 0.0 113.335 175.744 . . . . . . . . 0 0 . 1 . 048 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.647 0 N-CA-C 112.436 -0.265 . . . . 0.0 112.436 . . . . . . . . . 0 0 . 1 . 048 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 11.0 tp -74.44 -43.55 49.0 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.297 0 N-CA-C 114.031 1.123 . . . . 0.0 114.031 -170.581 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 70.3 t -57.53 -52.87 51.73 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.331 0 C-N-CA 124.622 1.169 . . . . 0.0 110.096 -177.876 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 25.6 pt-20 -66.55 0.76 2.05 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 125.468 1.507 . . . . 0.0 114.968 -179.098 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 17.9 tt0 -115.9 -50.81 2.67 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 119.097 0.862 . . . . 0.0 111.365 168.725 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 58.8 m -60.97 -28.41 68.98 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 114.283 1.216 . . . . 0.0 114.283 -177.565 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 87.8 m -73.1 -31.02 64.08 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 179.331 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 29.4 p -112.05 -44.83 3.37 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 125.579 1.552 . . . . 0.0 112.527 -169.055 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 63.2 m -101.99 168.15 9.59 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 125.908 1.683 . . . . 0.0 111.054 172.854 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 7.0 tt -81.57 132.31 31.82 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 O-C-N 120.822 -1.174 . . . . 0.0 109.151 170.865 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 17.0 p -121.61 158.65 28.14 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.447 1.099 . . . . 0.0 112.441 -176.133 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 34.1 t -98.08 151.93 19.85 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 124.322 1.049 . . . . 0.0 112.763 -173.923 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 39.8 mt -59.68 -29.7 68.26 Favored 'General case' 0 N--CA 1.471 0.585 0 O-C-N 121.632 -0.668 . . . . 0.0 111.46 171.597 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.6 t80 -62.23 -32.36 73.02 Favored 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 113.147 0.795 . . . . 0.0 113.147 172.231 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 64.9 mt-30 -78.08 -34.0 50.48 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 123.617 0.767 . . . . 0.0 111.084 175.558 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 81.5 mt -60.38 -47.88 84.17 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 118.639 0.654 . . . . 0.0 110.753 169.876 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -62.0 -32.32 72.78 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 175.191 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 15.5 t30 -59.23 -33.01 70.49 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 119.464 1.029 . . . . 0.0 113.03 179.446 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 67.6 m-85 -92.99 -0.63 57.16 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.708 1.203 . . . . 0.0 113.925 177.283 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 92.9 m -82.9 154.25 24.69 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 121.249 -0.907 . . . . 0.0 112.907 173.131 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.25 1.082 0 C-N-CA 125.819 1.648 . . . . 0.0 112.908 -176.646 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 65.8 m-85 . . . . . 0 N--CA 1.488 1.447 0 CA-C-O 118.617 -0.706 . . . . 0.0 109.403 . . . . . . . . . 0 0 . 1 . 048 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 5.9 m -82.58 83.81 1.69 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 CA-C-N 120.149 1.34 . . . . 0.0 110.079 175.127 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 27.9 m120 -124.88 140.71 52.68 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.092 1.357 . . . . 0.0 112.462 -170.869 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -148.06 160.78 42.51 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.45 1.5 . . . . 0.0 111.99 -178.804 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 90.7 m-70 -99.49 130.05 45.71 Favored 'General case' 0 CA--C 1.543 0.673 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 166.506 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 54.3 mt -148.16 136.54 21.41 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 124.89 1.276 . . . . 0.0 110.077 -171.682 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.3 t -147.34 150.8 35.45 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 113.035 0.754 . . . . 0.0 113.035 -178.376 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 53.55 -130.4 42.14 Favored Glycine 0 N--CA 1.469 0.853 0 C-N-CA 124.523 1.059 . . . . 0.0 113.181 173.167 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 39.0 m -59.11 -34.14 71.68 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 123.556 0.742 . . . . 0.0 112.931 -179.365 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 18.1 m-70 -70.41 -32.17 69.69 Favored 'General case' 0 CA--C 1.538 0.483 0 O-C-N 120.621 -1.299 . . . . 0.0 113.172 175.446 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 42.9 tp -69.6 -40.07 76.88 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 118.688 0.676 . . . . 0.0 111.24 171.16 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 78.5 t -60.83 -45.8 97.38 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.078 0 C-N-CA 123.947 0.899 . . . . 0.0 110.911 172.739 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -58.42 -48.17 81.55 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 123.558 0.743 . . . . 0.0 111.4 172.757 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.7 -41.81 99.32 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 123.631 0.772 . . . . 0.0 112.229 -178.655 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 31.0 mt -58.45 -43.97 89.02 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 118.558 0.617 . . . . 0.0 111.412 174.929 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 9.4 m-85 -70.88 -31.9 68.71 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 113.764 1.024 . . . . 0.0 113.764 174.898 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 64.4 mt -71.62 -41.41 68.89 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 119.382 0.992 . . . . 0.0 112.017 175.478 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 54.5 t -73.15 -47.8 45.9 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 C-N-CA 124.527 1.131 . . . . 0.0 111.501 179.97 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 66.8 m -94.73 -10.58 31.19 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 114.815 1.413 . . . . 0.0 114.815 -172.996 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 82.03 -164.53 44.48 Favored Glycine 0 CA--C 1.53 1.001 0 C-N-CA 124.867 1.222 . . . . 0.0 112.836 -177.372 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -61.68 -11.32 11.31 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 114.801 1.408 . . . . 0.0 114.801 -178.601 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 53.6 mtm180 -56.34 -33.49 65.69 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 125.056 1.342 . . . . 0.0 112.878 171.811 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 66.04 -154.51 51.3 Favored Glycine 0 CA--C 1.535 1.299 0 C-N-CA 123.692 0.663 . . . . 0.0 112.07 -172.422 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 54.5 p90 -141.69 155.41 45.67 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.802 1.241 . . . . 0.0 113.276 -172.159 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 75.1 t80 -87.47 -28.53 22.01 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.831 1.252 . . . . 0.0 113.185 -172.939 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 50.7 t80 -62.36 149.45 42.31 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.808 1.243 . . . . 0.0 113.14 179.841 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 13.5 t -111.61 126.12 29.14 Favored Pre-proline 0 N--CA 1.474 0.727 0 C-N-CA 124.216 1.007 . . . . 0.0 109.363 171.359 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -75.47 138.52 22.03 Favored 'Trans proline' 0 N--CA 1.455 -0.753 0 C-N-CA 122.674 2.249 . . . . 0.0 111.31 -171.118 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 18.9 ptmt -69.18 -15.7 63.46 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 113.362 0.875 . . . . 0.0 113.362 176.009 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 5.5 t -101.8 90.61 4.07 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 126.375 1.87 . . . . 0.0 107.831 168.182 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -83.56 132.82 34.89 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 123.601 0.76 . . . . 0.0 111.09 178.444 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 13.8 mtm105 . . . . . 0 N--CA 1.483 1.212 0 C-N-CA 126.488 1.915 . . . . 0.0 111.245 -173.098 . . . . . . . . 0 0 . 1 . 049 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.698 0 N-CA-C 110.71 -0.956 . . . . 0.0 110.71 . . . . . . . . . 0 0 . 1 . 049 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 20.7 tt -56.16 -34.86 40.3 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.13 0 N-CA-C 114.783 1.401 . . . . 0.0 114.783 -170.287 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 74.1 t -59.94 -40.86 84.15 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.028 0 C-N-CA 123.253 0.621 . . . . 0.0 111.166 -175.638 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -81.86 -2.75 52.16 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 113.149 0.796 . . . . 0.0 113.149 -179.509 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 20.8 tt0 -94.55 -58.72 2.11 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 123.56 0.744 . . . . 0.0 109.706 169.351 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 85.8 m -72.19 -30.37 64.9 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 113.962 1.097 . . . . 0.0 113.962 -170.054 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 71.2 m -69.93 -46.45 65.31 Favored 'General case' 0 N--CA 1.473 0.701 0 O-C-N 120.752 -1.218 . . . . 0.0 110.706 173.371 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 21.0 m -76.86 -37.95 54.62 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 126.756 2.023 . . . . 0.0 112.871 -170.084 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.7 t -144.19 -169.19 3.06 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.963 1.305 . . . . 0.0 111.77 -174.897 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 61.2 mt -79.91 127.27 39.37 Favored 'Isoleucine or valine' 0 C--O 1.238 0.448 0 O-C-N 120.818 -1.176 . . . . 0.0 111.707 -172.719 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 4.2 m -112.5 171.33 7.58 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 127.013 2.125 . . . . 0.0 110.832 168.166 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 35.4 t -163.34 163.26 25.22 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 126.422 1.889 . . . . 0.0 108.21 -170.715 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 9.8 mp -56.98 -33.71 67.35 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 119.231 0.923 . . . . 0.0 111.976 -176.092 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 73.2 t80 -61.11 -33.09 72.82 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 124.294 1.038 . . . . 0.0 113.572 173.4 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 36.9 mt-30 -86.8 -32.25 20.44 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 125.196 1.398 . . . . 0.0 111.333 177.682 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 96.1 mt -65.46 -50.56 64.88 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.624 1.17 . . . . 0.0 110.679 173.567 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -66.48 -23.23 66.23 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 113.35 0.87 . . . . 0.0 113.35 179.416 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 19.4 t30 -59.93 -29.74 68.59 Favored 'General case' 0 CA--C 1.545 0.788 0 O-C-N 121.118 -0.989 . . . . 0.0 113.031 177.427 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 51.9 m-85 -94.47 5.5 51.62 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.565 1.546 . . . . 0.0 113.717 176.946 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 75.0 m -101.09 129.1 46.92 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.016 0.927 . . . . 0.0 112.7 -179.646 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.252 1.211 0 C-N-CA 128.086 2.554 . . . . 0.0 112.393 -169.495 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 . . . . . 0 N--CA 1.486 1.338 0 CA-C-O 119.75 -0.167 . . . . 0.0 111.109 . . . . . . . . . 0 0 . 1 . 049 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 88.1 t -78.01 141.12 15.94 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.207 0 C-N-CA 124.721 1.208 . . . . 0.0 109.583 172.437 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 5.8 p-10 -134.0 158.36 43.71 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 124.919 1.288 . . . . 0.0 113.614 -174.427 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 2.6 mm-40 -176.2 -172.7 0.5 Allowed 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 127.417 2.287 . . . . 0.0 108.779 -173.052 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 5.9 m-70 -83.44 -105.37 0.04 OUTLIER 'General case' 0 CA--C 1.549 0.923 0 O-C-N 120.457 -1.402 . . . . 0.0 107.912 166.497 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 57.2 mt 113.17 124.48 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.946 1 C-N-CA 131.879 4.072 . . . . 0.0 109.425 171.478 . . . . . . . . 2 2 . 1 . 049 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 5.8 t -146.31 154.12 41.32 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.194 0.598 . . . . 0.0 112.431 -175.285 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 59.58 -136.29 50.58 Favored Glycine 0 N--CA 1.471 0.99 0 C-N-CA 123.801 0.715 . . . . 0.0 113.278 172.557 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 14.4 p -54.08 -36.99 63.75 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 124.541 1.136 . . . . 0.0 112.988 173.49 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 -69.67 -33.28 72.34 Favored 'General case' 0 CA--C 1.544 0.731 0 O-C-N 121.139 -0.975 . . . . 0.0 112.384 -179.751 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 53.7 tp -68.88 -42.48 76.92 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 118.562 0.619 . . . . 0.0 110.945 171.197 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 60.3 t -59.15 -46.77 91.79 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 C-N-CA 124.053 0.941 . . . . 0.0 111.064 174.488 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -65.69 -41.54 92.29 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 123.703 0.801 . . . . 0.0 112.137 176.679 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.75 -43.74 97.59 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 119.279 0.945 . . . . 0.0 111.529 174.823 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 62.5 mt -64.25 -40.22 95.55 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 118.299 0.499 . . . . 0.0 112.155 177.035 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 7.2 m-85 -58.14 -47.88 81.98 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.107 0.867 . . . . 0.0 111.86 170.744 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 78.5 mt -69.8 -41.63 74.78 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 124.146 0.979 . . . . 0.0 112.661 -177.156 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 60.6 t -76.82 -44.1 32.92 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 C-N-CA 123.754 0.822 . . . . 0.0 111.892 -177.268 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 73.7 m -95.9 -27.56 15.11 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 114.73 1.381 . . . . 0.0 114.73 -172.654 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 66.16 -134.76 34.14 Favored Glycine 0 N--CA 1.469 0.866 0 C-N-CA 124.216 0.913 . . . . 0.0 112.676 176.318 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -63.96 -17.92 63.76 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.248 1.419 . . . . 0.0 113.636 -177.847 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 84.9 mtm180 -61.66 -29.25 69.95 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 179.286 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.59 157.98 9.66 Favored Glycine 0 CA--C 1.534 1.234 0 C-N-CA 124.662 1.125 . . . . 0.0 113.144 -177.862 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 51.6 p90 -137.37 152.55 49.8 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.246 1.418 . . . . 0.0 113.334 -172.078 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 24.7 t80 -105.69 68.94 0.81 Allowed 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.748 1.619 . . . . 0.0 111.282 -179.749 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 50.5 t80 -67.34 117.71 9.7 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.469 1.108 . . . . 0.0 110.975 173.331 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 6.9 t -173.96 151.07 1.72 Allowed Pre-proline 0 N--CA 1.48 1.049 0 C-N-CA 125.637 1.575 . . . . 0.0 112.75 -175.656 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -89.5 -174.39 0.9 Allowed 'Trans proline' 0 CA--C 1.547 1.173 0 C-N-CA 124.493 3.462 . . . . 0.0 109.565 166.661 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 32.1 mtmm -76.85 -25.92 53.71 Favored 'General case' 0 N--CA 1.481 1.075 0 O-C-N 120.282 -1.511 . . . . 0.0 112.43 170.007 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 38.2 p -78.7 -24.41 45.02 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 126.604 1.962 . . . . 0.0 114.292 -170.305 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 60.6 tptt -74.76 112.89 11.43 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 123.633 0.773 . . . . 0.0 111.02 179.024 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 51.1 tpt85 . . . . . 0 C--O 1.252 1.209 0 C-N-CA 126.815 2.046 . . . . 0.0 111.678 -174.169 . . . . . . . . 0 0 . 1 . 050 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.69 0 N-CA-C 110.82 -0.912 . . . . 0.0 110.82 . . . . . . . . . 0 0 . 1 . 050 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 8.1 tp -57.12 -34.28 44.89 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 N-CA-C 114.243 1.201 . . . . 0.0 114.243 -170.196 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 40.1 t -65.22 -47.35 87.77 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 CA-C-N 118.452 0.569 . . . . 0.0 110.845 -179.14 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -64.34 -41.0 97.0 Favored 'General case' 0 CA--C 1.539 0.542 0 O-C-N 121.449 -0.782 . . . . 0.0 111.591 174.098 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 34.6 mt-30 -66.09 -35.74 81.31 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 118.374 -0.822 . . . . 0.0 112.955 -177.472 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 99.7 m -93.4 -31.18 14.73 Favored 'General case' 0 N--CA 1.47 0.525 0 N-CA-C 114.63 1.344 . . . . 0.0 114.63 179.281 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 78.2 m -86.76 -52.75 5.32 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 119.457 1.026 . . . . 0.0 111.602 -177.004 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 27.3 m -83.07 -40.8 19.4 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.731 1.212 . . . . 0.0 110.578 -174.067 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 7.9 t -112.5 -171.85 1.94 Allowed 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.398 1.079 . . . . 0.0 112.039 170.827 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 90.4 mt -96.24 128.68 47.22 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 C-N-CA 126.029 1.732 . . . . 0.0 108.522 175.596 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 21.1 p -107.9 -157.96 0.63 Allowed 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.987 0.915 . . . . 0.0 112.1 178.025 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 92.8 p -155.1 164.53 38.73 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 125.776 1.63 . . . . 0.0 111.387 -179.153 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 44.9 mt -62.01 -33.32 74.13 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 122.957 0.503 . . . . 0.0 111.601 174.381 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 93.2 t80 -63.29 -36.93 85.3 Favored 'General case' 0 CA--C 1.539 0.551 0 O-C-N 121.532 -0.73 . . . . 0.0 112.727 171.409 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -71.86 -34.58 69.34 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 118.757 -0.64 . . . . 0.0 111.739 174.687 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 95.5 mt -59.29 -49.57 77.32 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 119.503 1.047 . . . . 0.0 110.703 169.829 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -61.88 -34.37 75.91 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 113.562 0.949 . . . . 0.0 113.562 176.316 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 15.3 t30 -61.78 -27.78 68.99 Favored 'General case' 0 CA--C 1.546 0.821 0 O-C-N 121.129 -0.982 . . . . 0.0 112.79 177.92 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 66.3 m-85 -104.7 29.34 6.27 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.78 1.632 . . . . 0.0 112.814 176.008 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 93.7 m -125.59 172.97 9.3 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 126.681 1.992 . . . . 0.0 112.635 168.869 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 . . . . . 0 C--O 1.251 1.137 0 C-N-CA 124.551 1.141 . . . . 0.0 112.407 175.97 . . . . . . . . 0 0 . 1 . 050 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 66.3 m-85 . . . . . 0 N--CA 1.488 1.46 0 CA-C-O 118.896 -0.573 . . . . 0.0 109.999 . . . . . . . . . 0 0 . 1 . 050 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 9.1 p -62.28 -28.89 45.45 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.345 0 CA-C-N 120.145 1.338 . . . . 0.0 112.435 174.439 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 28.9 m120 -92.46 144.67 25.13 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.068 1.347 . . . . 0.0 111.94 171.54 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -175.22 167.77 3.4 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 125.699 1.599 . . . . 0.0 111.723 178.326 . . . . . . . . 2 2 . 1 . 050 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 83.8 m-70 -87.51 143.15 27.36 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 124.628 1.171 . . . . 0.0 108.967 166.049 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 73.9 mt -146.63 138.07 24.4 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 125.636 1.574 . . . . 0.0 109.346 174.825 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 1.8 t -150.09 157.6 43.3 Favored 'General case' 0 N--CA 1.469 0.491 0 O-C-N 121.291 -0.881 . . . . 0.0 113.214 176.337 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.99 -136.44 48.07 Favored Glycine 0 CA--C 1.531 1.037 0 C-N-CA 124.741 1.163 . . . . 0.0 113.388 175.038 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 21.0 m -53.58 -37.4 62.92 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.99 0.916 . . . . 0.0 112.69 177.049 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -69.7 -36.13 75.68 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 120.793 -1.192 . . . . 0.0 112.104 179.401 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 65.6 tp -64.59 -47.16 79.71 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 118.684 0.675 . . . . 0.0 110.721 170.579 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 59.0 t -61.78 -44.3 98.57 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 C-N-CA 123.91 0.884 . . . . 0.0 110.942 -179.221 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -64.12 -45.67 87.54 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 118.589 0.631 . . . . 0.0 112.18 174.408 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.94 -44.87 94.89 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 119.39 0.995 . . . . 0.0 111.747 178.388 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 28.0 tp -58.07 -47.01 84.46 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.009 1.324 . . . . 0.0 110.885 177.089 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 8.2 m-30 -63.54 -43.43 97.1 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 123.6 0.76 . . . . 0.0 112.312 176.721 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 73.9 mt -67.95 -39.37 83.41 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 123.719 0.807 . . . . 0.0 112.446 179.029 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 40.8 t -70.15 -45.94 74.13 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 123.972 0.909 . . . . 0.0 111.868 177.897 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 68.8 m -88.93 -21.64 23.48 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 114.831 1.419 . . . . 0.0 114.831 -172.343 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.24 -141.2 45.89 Favored Glycine 0 CA--C 1.53 0.97 0 C-N-CA 124.504 1.05 . . . . 0.0 113.646 170.981 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -66.11 -19.93 66.0 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.083 1.353 . . . . 0.0 113.588 -175.462 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 78.0 mtp85 -62.24 -33.71 75.11 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.827 0.851 . . . . 0.0 112.897 178.068 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.46 161.54 37.31 Favored Glycine 0 CA--C 1.534 1.259 0 C-N-CA 124.685 1.136 . . . . 0.0 113.734 -178.227 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 55.0 p90 -97.52 165.79 11.82 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.881 1.673 . . . . 0.0 112.899 -176.558 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 46.3 t80 -115.94 -36.94 3.99 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 124.82 1.248 . . . . 0.0 111.314 168.74 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 81.0 t80 52.74 98.27 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 127.45 2.3 . . . . 0.0 115.163 169.587 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 92.3 m -111.65 111.17 54.63 Favored Pre-proline 0 N--CA 1.477 0.88 0 C-N-CA 123.953 0.901 . . . . 0.0 110.836 -176.871 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -82.14 -153.21 0.04 OUTLIER 'Trans proline' 0 CA--C 1.539 0.743 0 C-N-CA 124.729 3.619 . . . . 0.0 110.391 169.89 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -51.6 -33.47 33.03 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 124.537 1.135 . . . . 0.0 113.583 170.904 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 25.5 m -134.05 -99.43 0.25 Allowed 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 126.558 1.943 . . . . 0.0 109.135 176.967 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 16.2 tppt? -168.65 -48.52 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 126.046 1.738 . . . . 0.0 111.561 -177.657 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 32.9 ptt-85 . . . . . 0 C--O 1.253 1.264 0 C-N-CA 125.443 1.497 . . . . 0.0 113.085 171.221 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 13.8 tt . . . . . 0 N--CA 1.483 1.188 0 N-CA-C 115.476 1.658 . . . . 0.0 115.476 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 18.2 t -52.14 -41.76 33.88 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 C-N-CA 124.224 1.009 . . . . 0.0 110.647 169.036 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 -70.74 -5.24 28.45 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 179.617 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 52.6 tt0 -104.3 -63.08 1.24 Allowed 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.007 0.923 . . . . 0.0 108.938 168.014 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 68.7 m -59.1 -33.51 70.92 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 113.674 0.99 . . . . 0.0 113.674 -170.15 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 13.6 t -77.75 -26.92 50.23 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 113.371 0.878 . . . . 0.0 113.371 -172.358 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 28.5 p -116.2 -35.05 4.47 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 125.718 1.607 . . . . 0.0 112.962 -175.611 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 9.0 t -113.95 -169.04 1.44 Allowed 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 126.449 1.9 . . . . 0.0 110.601 174.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 33.8 mm -92.39 145.55 7.45 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 C-N-CA 125.021 1.328 . . . . 0.0 110.456 179.543 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 15.6 p -141.64 176.84 8.58 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.776 1.23 . . . . 0.0 111.234 169.241 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 91.2 p -153.1 164.0 38.82 Favored 'General case' 0 N--CA 1.47 0.549 0 O-C-N 121.075 -1.016 . . . . 0.0 112.918 -169.661 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 21.5 mt -57.18 -37.13 71.68 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 123.945 0.898 . . . . 0.0 112.599 -173.661 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 87.2 t80 -62.05 -28.37 69.55 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.144 0.978 . . . . 0.0 113.475 175.381 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 46.8 mt-30 -87.5 -29.8 21.09 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.398 1.079 . . . . 0.0 111.04 176.141 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 72.5 mt -67.1 -38.17 85.2 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.969 0.908 . . . . 0.0 112.325 170.536 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -52.82 -31.59 39.71 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.743 1.217 . . . . 0.0 113.392 174.297 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -62.97 -19.32 64.19 Favored 'General case' 0 CA--C 1.548 0.886 0 N-CA-C 113.653 0.983 . . . . 0.0 113.653 178.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 95.4 m-85 -107.57 2.94 24.39 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.747 1.619 . . . . 0.0 113.937 -178.184 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 98.7 m -72.0 141.66 49.35 Favored 'General case' 0 CA--C 1.537 0.461 0 O-C-N 121.148 -0.97 . . . . 0.0 113.005 177.029 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 34.5 t30 . . . . . 0 C--O 1.252 1.208 0 C-N-CA 125.458 1.503 . . . . 0.0 111.327 171.566 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 37.9 t80 . . . . . 0 N--CA 1.49 1.573 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 24.3 t 79.27 -51.33 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 C-N-CA 128.404 2.682 . . . . 0.0 112.645 175.0 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -141.3 111.21 6.61 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 126.738 2.015 . . . . 0.0 107.896 175.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -170.86 174.73 4.73 Favored 'General case' 0 CA--C 1.543 0.695 0 O-C-N 121.496 -0.753 . . . . 0.0 111.949 -166.043 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 94.4 m-70 -81.41 142.2 33.2 Favored 'General case' 0 CA--C 1.55 0.968 0 N-CA-C 107.283 -1.377 . . . . 0.0 107.283 163.767 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 87.4 mt -145.09 135.98 24.66 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 125.819 1.648 . . . . 0.0 110.495 178.327 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.5 t -149.66 145.48 26.75 Favored 'General case' 0 N--CA 1.471 0.608 0 O-C-N 120.865 -1.147 . . . . 0.0 113.235 178.422 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 59.95 -126.68 42.38 Favored Glycine 0 CA--C 1.528 0.862 0 C-N-CA 124.49 1.043 . . . . 0.0 112.77 176.492 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 20.3 p -52.34 -40.79 62.38 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 124.884 1.274 . . . . 0.0 113.021 176.193 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 27.6 m80 -62.93 -42.27 99.75 Favored 'General case' 0 CA--C 1.543 0.687 0 O-C-N 121.206 -0.934 . . . . 0.0 111.66 178.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 48.6 tp -69.03 -41.36 77.81 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 124.085 0.954 . . . . 0.0 111.376 176.654 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 37.8 t -62.15 -44.71 99.38 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 C-N-CA 124.513 1.125 . . . . 0.0 111.267 175.407 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -66.59 -40.07 88.73 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 118.426 0.557 . . . . 0.0 111.977 175.262 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.48 -41.82 99.06 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 119.55 1.068 . . . . 0.0 111.938 174.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 43.2 mt -59.05 -47.17 86.22 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-O 118.818 -0.611 . . . . 0.0 111.046 171.754 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 24.2 m-85 -62.93 -33.89 76.29 Favored 'General case' 0 CA--C 1.545 0.762 0 CA-C-N 120.01 1.277 . . . . 0.0 113.711 175.359 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 70.2 mt -67.24 -42.44 83.96 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 119.395 0.998 . . . . 0.0 112.054 173.051 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 55.5 t -73.52 -46.67 47.95 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 C-N-CA 123.793 0.837 . . . . 0.0 112.097 -179.462 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 33.6 m -85.37 -18.56 33.39 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 113.758 1.022 . . . . 0.0 113.758 -174.064 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 70.55 -155.22 52.88 Favored Glycine 0 CA--C 1.531 1.067 0 C-N-CA 124.709 1.147 . . . . 0.0 112.434 -174.521 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -61.72 -21.12 64.23 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.072 1.349 . . . . 0.0 113.275 -178.733 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 76.9 mtp85 -62.7 -28.18 69.77 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.22 1.008 . . . . 0.0 113.297 175.051 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.86 -166.48 53.27 Favored Glycine 0 CA--C 1.533 1.193 0 C-N-CA 124.942 1.258 . . . . 0.0 113.801 -178.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 44.1 p90 -121.63 148.42 44.58 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 126.025 1.73 . . . . 0.0 111.411 -179.058 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 27.4 p90 -85.83 -13.75 47.11 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 113.299 0.851 . . . . 0.0 113.299 175.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 71.8 t80 -63.98 154.41 34.2 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 126.081 1.752 . . . . 0.0 114.39 -177.622 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 26.3 p -132.63 134.69 25.02 Favored Pre-proline 0 N--CA 1.477 0.914 0 C-N-CA 126.382 1.873 . . . . 0.0 108.31 170.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -63.12 101.42 0.28 Allowed 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 124.371 3.381 . . . . 0.0 112.891 -168.598 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . 0.311 61.5 pttt . . . . . 0 CA--C 1.549 0.94 0 C-N-CA 127.849 2.46 . . . . 0.0 116.83 -174.145 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 20.3 tt . . . . . 0 N--CA 1.488 1.453 0 N-CA-C 115.656 1.725 . . . . 0.0 115.656 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . 0.465 HG12 ' H ' ' B' ' 29' ' ' LYS . 6.4 p -62.32 -23.46 32.15 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.141 0 C-N-CA 124.124 0.969 . . . . 0.0 112.754 177.226 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -76.04 0.72 17.67 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.224 1.409 . . . . 0.0 112.508 175.336 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 63.4 tp60 -117.93 -54.71 2.31 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 125.042 1.337 . . . . 0.0 109.025 166.868 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 22.8 m -67.72 -26.1 65.99 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 115.419 1.637 . . . . 0.0 115.419 -170.713 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 37.7 t -103.0 -41.95 5.96 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 119.112 0.869 . . . . 0.0 113.085 -176.547 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 24.1 p -71.42 -33.2 69.22 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 125.986 1.715 . . . . 0.0 112.169 176.359 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.8 t -134.42 -157.81 0.83 Allowed 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.957 1.703 . . . . 0.0 109.606 173.509 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 86.4 mt -100.14 150.11 5.62 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 C-N-CA 125.887 1.675 . . . . 0.0 110.847 -176.003 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.1 p -143.42 -164.02 1.77 Allowed 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 124.148 0.979 . . . . 0.0 112.233 169.387 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 26.5 t -154.84 151.76 28.99 Favored 'General case' 0 N--CA 1.469 0.494 0 O-C-N 120.727 -1.233 . . . . 0.0 111.59 -171.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 62.6 mt -60.77 -28.52 68.8 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.888 0.875 . . . . 0.0 112.22 178.641 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 68.6 t80 -62.15 -31.05 71.49 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.529 1.132 . . . . 0.0 113.049 172.363 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 65.6 mt-30 -81.54 -35.26 30.52 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 123.736 0.814 . . . . 0.0 110.842 175.328 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 17.8 mt -58.71 -41.18 85.71 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 118.924 0.784 . . . . 0.0 111.464 172.787 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -56.3 -28.46 58.85 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.865 1.666 . . . . 0.0 114.167 176.776 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 15.2 t-20 -66.11 -22.26 66.39 Favored 'General case' 0 CA--C 1.547 0.829 0 O-C-N 121.264 -0.898 . . . . 0.0 112.917 176.658 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 56.7 m-85 -100.88 4.91 43.12 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.404 1.482 . . . . 0.0 113.655 -178.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 77.9 m -73.76 168.35 19.56 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.172 0.989 . . . . 0.0 112.897 171.818 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.248 0.989 0 C-N-CA 125.86 1.664 . . . . 0.0 111.966 -178.863 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 . . . . . 0 N--CA 1.483 1.194 0 CA-C-O 118.313 -0.851 . . . . 0.0 111.078 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 92.5 t -78.72 -39.39 22.61 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.252 0 CA-C-N 120.525 1.511 . . . . 0.0 111.488 -177.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 2.3 t30 59.23 75.05 0.42 Allowed 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 125.564 1.546 . . . . 0.0 112.525 169.145 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -149.51 160.79 43.18 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 124.428 1.091 . . . . 0.0 111.93 -178.146 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 98.0 m-70 -85.02 140.9 30.68 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.494 1.117 . . . . 0.0 111.214 170.833 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 62.0 mt -141.57 137.1 31.71 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 125.941 1.696 . . . . 0.0 110.112 174.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 1.8 t -140.16 143.67 36.27 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 113.132 0.79 . . . . 0.0 113.132 -175.056 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 49.91 -123.03 12.67 Favored Glycine 0 N--CA 1.469 0.896 0 C-N-CA 125.232 1.396 . . . . 0.0 114.175 169.432 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.1 p -56.28 -36.46 68.63 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 124.908 1.283 . . . . 0.0 113.048 177.242 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -73.14 -32.51 64.95 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 120.736 -1.227 . . . . 0.0 112.035 178.235 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 41.9 tp -70.74 -43.3 69.13 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.918 0.887 . . . . 0.0 111.475 172.733 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 39.1 t -59.89 -43.78 92.85 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 C-N-CA 124.497 1.119 . . . . 0.0 110.911 172.524 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -64.08 -43.66 94.76 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.598 0.759 . . . . 0.0 111.088 175.477 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.93 -41.68 99.56 Favored 'General case' 0 CA--C 1.54 0.589 0 O-C-N 121.329 -0.857 . . . . 0.0 112.249 177.009 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 21.6 mt -60.06 -46.38 89.74 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 118.547 0.612 . . . . 0.0 110.662 173.126 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 19.3 m-85 -62.05 -35.72 79.45 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 120.936 -1.102 . . . . 0.0 113.69 173.525 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 62.5 mt -70.24 -41.57 73.37 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 119.49 1.041 . . . . 0.0 111.999 176.091 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 63.0 t -71.7 -42.36 70.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 C-N-CA 123.578 0.751 . . . . 0.0 111.702 179.407 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 36.7 m -86.41 -15.21 41.01 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 114.328 1.233 . . . . 0.0 114.328 -178.144 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 72.9 -162.01 54.61 Favored Glycine 0 CA--C 1.534 1.262 0 C-N-CA 124.963 1.268 . . . . 0.0 112.781 -174.076 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -58.61 -20.72 49.83 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 125.033 1.333 . . . . 0.0 113.354 179.04 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 73.6 mtp85 -61.66 -24.16 66.55 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 125.483 1.513 . . . . 0.0 113.302 175.335 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.42 -178.45 44.76 Favored Glycine 0 CA--C 1.529 0.951 0 C-N-CA 124.74 1.162 . . . . 0.0 113.81 -179.164 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 55.3 p90 -119.01 156.54 29.44 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 125.399 1.48 . . . . 0.0 111.932 -178.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 84.6 t80 -91.38 -40.12 11.63 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.328 1.051 . . . . 0.0 113.042 -177.739 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 8.2 t80 -87.85 112.74 22.81 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 114.162 1.171 . . . . 0.0 114.162 -169.028 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 6.6 t -72.4 144.05 86.21 Favored Pre-proline 0 N--CA 1.476 0.84 0 C-N-CA 124.891 1.276 . . . . 0.0 111.275 179.183 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -73.99 167.03 28.21 Favored 'Trans proline' 0 CA--C 1.537 0.667 0 C-N-CA 123.086 2.524 . . . . 0.0 111.101 169.84 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . 0.465 ' H ' HG12 ' A' ' 3' ' ' VAL . 16.1 tptm . . . . . 0 CA--C 1.547 0.865 0 O-C-N 121.217 -0.927 . . . . 0.0 113.093 178.225 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.484 1.228 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 9.5 p -66.0 -36.69 78.08 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 N-CA-C 112.976 0.732 . . . . 0.0 112.976 -179.253 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 46.8 mp0 -68.6 -45.78 71.07 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 119.158 0.89 . . . . 0.0 110.759 169.836 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 22.5 tt0 -61.18 -49.99 74.96 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.397 1.079 . . . . 0.0 112.165 -172.87 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 1.5 m -68.99 -17.98 64.0 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 113.726 1.01 . . . . 0.0 113.726 176.503 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 48.7 t -98.83 -42.27 7.25 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 119.245 0.929 . . . . 0.0 113.214 -174.667 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 1.9 t -73.6 -26.56 60.86 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 125.352 1.461 . . . . 0.0 112.712 -179.5 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.5 t -137.34 -173.05 3.36 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 125.475 1.51 . . . . 0.0 110.821 174.525 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 63.0 mt -82.44 139.49 17.77 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 C-N-CA 124.748 1.219 . . . . 0.0 110.462 176.831 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 16.5 p -129.99 158.07 40.58 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.332 1.053 . . . . 0.0 111.558 168.831 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 22.6 t -108.63 154.96 21.24 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 124.424 1.09 . . . . 0.0 113.904 -169.714 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.529 HD22 ' H ' ' A' ' 13' ' ' LEU . 2.1 mm? -58.52 -31.15 67.64 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.32 1.048 . . . . 0.0 111.462 174.052 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 90.1 t80 -62.1 -33.07 73.74 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.081 0.952 . . . . 0.0 112.98 173.384 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 57.4 mt-30 -76.23 -42.14 46.93 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 123.433 0.693 . . . . 0.0 109.886 174.613 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 81.3 mt -59.14 -41.96 89.52 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 118.455 0.571 . . . . 0.0 111.876 174.668 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 23.5 mt-10 -63.51 -32.53 74.01 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 171.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.4 t-20 -69.95 -23.51 63.2 Favored 'General case' 0 CA--C 1.546 0.819 0 CA-C-N 119.038 0.836 . . . . 0.0 112.772 173.067 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 13.2 m-85 -86.94 -11.04 51.79 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 124.897 1.279 . . . . 0.0 113.614 174.869 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 61.3 m -63.1 151.35 40.3 Favored 'General case' 0 N--CA 1.47 0.549 0 O-C-N 120.988 -1.07 . . . . 0.0 111.68 169.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 . . . . . 0 C--O 1.252 1.215 0 C-N-CA 125.072 1.349 . . . . 0.0 112.618 179.383 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 77.7 m-85 . . . . . 0 N--CA 1.486 1.349 0 CA-C-O 118.94 -0.553 . . . . 0.0 112.43 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 27.4 m -129.39 -167.48 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.126 0 C-N-CA 125.816 1.646 . . . . 0.0 110.092 -179.024 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 17.8 p-10 -60.82 117.58 5.59 Favored 'General case' 0 CA--C 1.545 0.773 0 O-C-N 121.183 -0.948 . . . . 0.0 110.484 169.755 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 36.9 mt-30 -146.6 174.95 10.96 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.422 1.489 . . . . 0.0 111.333 -167.875 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 38.4 m-70 -79.51 135.01 36.52 Favored 'General case' 0 CA--C 1.545 0.776 0 O-C-N 121.366 -0.834 . . . . 0.0 109.249 167.373 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 82.7 mt -136.9 121.16 17.98 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 125.931 1.692 . . . . 0.0 109.688 178.215 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 80.9 m -121.19 132.87 55.09 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.772 1.229 . . . . 0.0 111.957 -174.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 50.28 -117.99 5.55 Favored Glycine 0 N--CA 1.476 1.307 0 C-N-CA 125.349 1.452 . . . . 0.0 114.838 168.827 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.1 p -53.85 -39.58 65.75 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 125.221 1.408 . . . . 0.0 112.91 176.678 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -69.67 -34.29 73.76 Favored 'General case' 0 CA--C 1.54 0.586 0 O-C-N 121.098 -1.001 . . . . 0.0 111.826 178.599 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 59.9 tp -68.89 -44.17 73.76 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 123.574 0.75 . . . . 0.0 111.69 172.19 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 47.6 t -60.87 -43.53 95.84 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 C-N-CA 123.948 0.899 . . . . 0.0 110.741 175.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 29.1 mm-40 -64.79 -41.54 95.75 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.434 0.694 . . . . 0.0 112.062 174.083 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.45 -40.75 97.63 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 119.293 0.952 . . . . 0.0 112.047 175.298 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 43.0 mt -61.22 -43.31 99.08 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.568 0.747 . . . . 0.0 111.608 173.84 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 20.1 m-85 -61.49 -42.65 99.11 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 119.635 1.107 . . . . 0.0 112.327 172.44 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 70.4 mt -67.51 -41.57 84.21 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.933 0.893 . . . . 0.0 112.466 179.489 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 51.5 t -73.1 -47.3 48.18 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 C-N-CA 123.962 0.905 . . . . 0.0 111.478 179.441 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 65.7 m -81.67 -30.11 32.83 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 113.621 0.971 . . . . 0.0 113.621 -174.383 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 66.66 -134.43 32.69 Favored Glycine 0 CA--C 1.527 0.814 0 C-N-CA 124.056 0.836 . . . . 0.0 111.127 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 2.5 pm0 -68.24 -13.94 62.62 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 114.229 1.196 . . . . 0.0 114.229 178.08 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 84.3 mtm180 -65.25 -36.2 83.4 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.943 0.897 . . . . 0.0 112.77 179.045 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.83 177.92 40.06 Favored Glycine 0 CA--C 1.535 1.282 0 C-N-CA 124.154 0.883 . . . . 0.0 112.609 -170.573 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 51.6 p90 -153.37 161.93 41.81 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 114.419 1.266 . . . . 0.0 114.419 -171.462 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -96.39 144.04 26.89 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.634 1.574 . . . . 0.0 110.11 168.815 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 69.6 t80 -161.28 142.67 11.58 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.882 1.273 . . . . 0.0 111.365 -174.526 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 40.4 p -126.59 108.57 23.13 Favored Pre-proline 0 C--O 1.239 0.512 0 C-N-CA 125.118 1.367 . . . . 0.0 110.903 179.79 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -67.89 106.2 1.27 Allowed 'Trans proline' 0 N--CA 1.457 -0.665 0 C-N-CA 121.82 1.68 . . . . 0.0 108.117 168.161 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 21.6 ttmm . . . . . 0 N--CA 1.472 0.653 0 C-N-CA 129.076 2.95 . . . . 0.0 114.281 -176.531 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . 0.463 ' N ' ' HG1' ' B' ' 27' ' ' THR . 10.4 tp . . . . . 0 N--CA 1.48 1.044 0 CA-C-O 118.898 -0.572 . . . . 0.0 112.485 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 96.0 t -63.11 -51.88 66.02 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 CA-C-N 118.519 0.6 . . . . 0.0 110.541 174.865 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -53.21 -48.15 68.37 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 123.571 0.748 . . . . 0.0 111.067 173.036 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 42.1 tp60 -65.64 -55.18 18.91 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.886 0.875 . . . . 0.0 111.354 -172.358 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 72.0 m -69.47 -26.45 64.58 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 -178.014 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 84.9 m -71.88 -50.44 29.3 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 119.453 1.024 . . . . 0.0 111.17 171.802 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -79.93 -19.34 48.29 Favored 'General case' 0 N--CA 1.478 0.965 0 N-CA-C 114.065 1.135 . . . . 0.0 114.065 -172.291 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 95.8 p -149.82 168.93 22.31 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.254 1.022 . . . . 0.0 113.09 -173.406 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 53.2 mt -69.63 125.27 27.34 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 O-C-N 121.244 -0.91 . . . . 0.0 109.504 170.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 15.3 p -117.13 -159.9 0.75 Allowed 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.693 1.197 . . . . 0.0 110.411 170.427 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 6.7 t -157.19 168.76 26.46 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 120.209 -1.557 . . . . 0.0 111.481 175.161 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 52.0 mt -63.28 -27.46 69.35 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.685 1.194 . . . . 0.0 112.839 -174.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.2 t80 -63.73 -32.43 73.93 Favored 'General case' 0 CA--C 1.546 0.79 0 O-C-N 121.282 -0.886 . . . . 0.0 113.081 169.874 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 44.6 mm-40 -75.07 -23.57 58.07 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 123.569 0.748 . . . . 0.0 111.245 175.701 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 30.5 mt -77.06 -48.29 18.26 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 123.892 0.877 . . . . 0.0 110.817 172.679 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 -63.11 -22.72 67.05 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 113.639 0.977 . . . . 0.0 113.639 178.026 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 16.8 t30 -54.48 -29.4 49.84 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 123.929 0.892 . . . . 0.0 112.856 169.964 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 97.3 m-85 -100.8 7.45 43.75 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.316 1.446 . . . . 0.0 113.429 176.807 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 22.8 t -89.76 167.78 12.61 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.885 1.274 . . . . 0.0 111.782 170.029 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 21.7 m-80 . . . . . 0 C--O 1.252 1.192 0 C-N-CA 125.136 1.374 . . . . 0.0 112.561 173.253 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 65.6 m-85 . . . . . 0 N--CA 1.487 1.413 0 N-CA-C 110.779 -0.082 . . . . 0.0 110.779 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 76.2 t -68.62 142.31 16.41 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.239 0 C-N-CA 124.438 1.095 . . . . 0.0 110.606 -179.627 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 6.4 t-20 65.08 64.55 0.62 Allowed 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 126.114 1.766 . . . . 0.0 112.679 173.425 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 47.4 mt-30 -143.33 -170.68 3.33 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 126.037 1.735 . . . . 0.0 110.308 -179.139 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 23.6 m-70 -73.7 146.24 44.59 Favored 'General case' 0 CA--C 1.545 0.761 0 O-C-N 120.897 -1.127 . . . . 0.0 109.815 167.025 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 62.9 mt -143.82 125.56 15.1 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 126.001 1.72 . . . . 0.0 109.072 174.713 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 5.6 t -137.99 149.91 46.53 Favored 'General case' 0 CA--C 1.537 0.475 0 O-C-N 121.275 -0.89 . . . . 0.0 112.993 -176.719 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 54.29 -130.46 44.7 Favored Glycine 0 N--CA 1.468 0.827 0 C-N-CA 125.028 1.299 . . . . 0.0 113.572 174.132 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.9 m -56.54 -32.02 64.71 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.306 1.043 . . . . 0.0 113.128 179.141 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -73.07 -35.91 66.76 Favored 'General case' 0 CA--C 1.543 0.696 0 O-C-N 120.862 -1.149 . . . . 0.0 112.024 177.576 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 58.9 tp -67.25 -44.89 78.29 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 123.66 0.784 . . . . 0.0 110.943 172.106 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 58.3 t -61.45 -42.46 93.94 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 123.907 0.883 . . . . 0.0 110.902 176.006 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -62.67 -44.55 95.96 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 123.329 0.652 . . . . 0.0 112.052 173.687 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.33 -40.47 96.47 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 118.784 0.72 . . . . 0.0 112.22 175.757 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 16.0 mt -59.71 -44.5 93.69 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.025 0.93 . . . . 0.0 111.774 172.68 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 20.7 m-85 -62.93 -40.66 98.32 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 119.499 1.045 . . . . 0.0 112.993 173.322 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 78.7 mt -66.92 -41.97 86.18 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.676 0.79 . . . . 0.0 112.556 177.128 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 38.9 t -71.73 -48.44 51.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 C-N-CA 124.482 1.113 . . . . 0.0 111.949 178.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 28.0 t -86.84 -37.24 17.93 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 113.31 0.856 . . . . 0.0 113.31 -170.124 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 69.63 -146.0 42.96 Favored Glycine 0 CA--C 1.533 1.187 0 C-N-CA 124.201 0.905 . . . . 0.0 112.097 -177.264 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -65.44 -15.63 62.82 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 125.136 1.375 . . . . 0.0 113.44 -178.805 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 80.1 mtm180 -60.83 -29.95 69.8 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.886 1.274 . . . . 0.0 113.734 -178.591 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 80.52 138.91 2.19 Favored Glycine 0 N--CA 1.472 1.077 0 C-N-CA 125.249 1.405 . . . . 0.0 113.336 178.875 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 44.2 p90 -118.75 153.24 34.74 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 125.284 1.434 . . . . 0.0 113.232 -178.057 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 26.3 p90 -120.31 37.96 4.11 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 127.844 2.458 . . . . 0.0 111.227 -177.016 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -49.34 142.16 7.88 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 125.87 1.668 . . . . 0.0 114.231 -178.892 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 27' ' ' THR . . . . . 0.463 ' HG1' ' N ' ' A' ' 2' ' ' ILE . 11.2 p -93.13 111.09 50.15 Favored Pre-proline 0 N--CA 1.474 0.766 0 C-N-CA 125.233 1.413 . . . . 0.0 112.806 -175.442 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_endo -79.62 161.08 25.01 Favored 'Trans proline' 0 C--N 1.353 0.807 0 C-N-CA 123.758 2.972 . . . . 0.0 110.597 169.35 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 43.5 tptt . . . . . 0 CA--C 1.549 0.908 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 -178.539 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 15.1 tt . . . . . 0 N--CA 1.486 1.366 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 7.1 p -65.56 -23.43 32.69 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.76 0 C-N-CA 124.511 1.124 . . . . 0.0 112.95 -177.661 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 26.0 pm0 -68.96 -11.53 60.8 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.338 1.455 . . . . 0.0 113.951 169.807 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 71.6 tp60 -105.92 -45.96 4.23 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 124.056 0.943 . . . . 0.0 110.542 169.454 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 54.4 m -79.33 -29.25 42.2 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 115.907 1.817 . . . . 0.0 115.907 -171.586 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 42.0 t -98.46 -56.92 2.32 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 119.86 1.209 . . . . 0.0 113.113 -173.436 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 17.0 p -66.47 -46.81 75.12 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.103 1.361 . . . . 0.0 111.074 178.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.9 t -102.15 -161.24 0.84 Allowed 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 124.771 1.228 . . . . 0.0 110.59 168.548 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 49.4 mt -110.01 150.16 12.71 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 C-N-CA 126.59 1.956 . . . . 0.0 110.28 -179.541 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 12.2 p -141.34 158.77 43.43 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 114.571 1.322 . . . . 0.0 114.571 174.153 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 78.6 p -98.3 167.59 10.76 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 126.195 1.798 . . . . 0.0 113.478 175.696 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 31.4 mt -65.0 -27.63 68.96 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 121.356 -0.84 . . . . 0.0 112.053 173.644 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.5 t80 -67.02 -34.74 78.38 Favored 'General case' 0 CA--C 1.542 0.643 0 O-C-N 121.449 -0.782 . . . . 0.0 112.253 171.456 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 81.7 mt-30 -73.39 -26.5 61.01 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 118.746 -0.645 . . . . 0.0 112.073 172.873 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 68.7 mt -68.61 -49.45 59.18 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 119.47 1.032 . . . . 0.0 110.523 168.404 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 18.1 mm-40 -56.35 -30.56 62.78 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.71 1.204 . . . . 0.0 113.256 175.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -59.45 -24.19 63.34 Favored 'General case' 0 CA--C 1.55 0.945 0 N-CA-C 113.68 0.993 . . . . 0.0 113.68 178.549 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 78.8 m-85 -100.48 -2.46 33.09 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.224 1.41 . . . . 0.0 114.037 175.462 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 75.1 m -86.99 153.62 21.42 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 121.03 -1.044 . . . . 0.0 113.506 179.395 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 31.6 m120 . . . . . 0 C--O 1.253 1.244 0 C-N-CA 125.277 1.431 . . . . 0.0 113.241 179.46 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 22.8 p90 . . . . . 0 N--CA 1.486 1.339 0 CA-C-O 119.471 -0.3 . . . . 0.0 110.78 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 34.8 m -66.29 -21.36 28.61 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.325 0 N-CA-C 114.757 1.391 . . . . 0.0 114.757 -171.103 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 22.0 t-20 -73.96 111.63 9.31 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 169.358 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -162.97 -179.07 6.48 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 113.158 0.799 . . . . 0.0 113.158 -167.915 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 89.0 m-70 -81.95 136.76 35.26 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 123.502 0.721 . . . . 0.0 110.719 168.588 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 65.7 mt -142.04 135.02 28.79 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 126.411 1.884 . . . . 0.0 108.872 173.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 1.3 t -139.32 145.27 38.87 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 112.878 0.696 . . . . 0.0 112.878 -174.767 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 48.57 -123.34 10.1 Favored Glycine 0 N--CA 1.47 0.948 0 C-N-CA 125.197 1.38 . . . . 0.0 114.146 170.071 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 18.3 m -54.9 -36.74 65.49 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 124.606 1.162 . . . . 0.0 113.393 178.409 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 73.4 m-70 -76.62 -29.41 56.47 Favored 'General case' 0 CA--C 1.538 0.486 0 O-C-N 120.777 -1.202 . . . . 0.0 112.693 177.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 39.4 tp -69.81 -44.59 69.7 Favored 'General case' 0 N--CA 1.468 0.431 0 O-C-N 121.658 -0.651 . . . . 0.0 111.304 170.483 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 42.7 t -60.15 -44.26 94.85 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 125.15 1.38 . . . . 0.0 111.141 173.036 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -59.98 -46.78 88.32 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.993 1.317 . . . . 0.0 111.866 173.305 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.47 -43.03 99.8 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 118.942 0.792 . . . . 0.0 112.093 177.082 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 29.0 mt -58.35 -45.01 89.01 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 123.617 0.767 . . . . 0.0 111.366 174.73 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 11.5 m-85 -61.8 -44.67 96.4 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 123.243 0.617 . . . . 0.0 112.436 173.686 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 73.3 mt -68.14 -41.56 81.46 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 123.852 0.861 . . . . 0.0 112.52 -178.515 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 65.6 t -72.14 -48.79 47.59 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 C-N-CA 123.658 0.783 . . . . 0.0 111.527 -179.461 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 71.3 m -96.97 -17.24 20.2 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 115.013 1.486 . . . . 0.0 115.013 -169.487 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 67.76 -145.48 45.29 Favored Glycine 0 CA--C 1.53 1.017 0 C-N-CA 124.533 1.064 . . . . 0.0 113.834 172.585 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -61.06 -20.4 62.52 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.363 1.465 . . . . 0.0 113.906 -176.114 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 40.4 mtp180 -56.23 -38.53 71.2 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.032 1.333 . . . . 0.0 112.973 177.262 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.38 175.48 45.42 Favored Glycine 0 CA--C 1.535 1.337 0 C-N-CA 124.729 1.156 . . . . 0.0 113.618 -176.002 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 51.9 p90 -153.1 160.87 42.97 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.315 1.446 . . . . 0.0 113.865 -172.794 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 70.7 t80 -89.06 146.24 24.96 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.607 1.563 . . . . 0.0 110.937 170.038 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 56.4 t80 -155.26 129.36 8.81 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.846 0.858 . . . . 0.0 112.412 -178.482 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 21.3 p -146.49 159.16 45.54 Favored Pre-proline 0 N--CA 1.477 0.899 0 C-N-CA 126.739 2.015 . . . . 0.0 110.343 176.374 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -74.56 -179.83 5.22 Favored 'Trans proline' 0 C--N 1.351 0.699 0 C-N-CA 123.767 2.978 . . . . 0.0 112.202 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 48.5 mtmt . . . . . 0 N--CA 1.477 0.888 0 C-N-CA 124.811 1.244 . . . . 0.0 113.544 -179.367 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 14.1 tt . . . . . 0 N--CA 1.481 1.114 0 N-CA-C 114.072 1.138 . . . . 0.0 114.072 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 50.5 t -62.93 -38.19 81.27 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.32 0 CA-C-N 119.488 1.04 . . . . 0.0 111.184 -175.181 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.1 pm0 -67.22 -7.61 25.28 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 114.105 1.15 . . . . 0.0 114.105 176.641 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 13.2 tp60 -105.6 -56.76 2.13 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.295 1.038 . . . . 0.0 110.224 168.921 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 19.2 m -77.29 -25.37 51.29 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 115.025 1.491 . . . . 0.0 115.025 -170.559 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 34.2 t -96.31 -42.37 8.18 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 119.569 1.077 . . . . 0.0 111.807 178.043 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 33.7 m -62.74 -37.89 88.36 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 125.263 1.425 . . . . 0.0 112.153 176.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.9 t -138.22 -170.49 2.82 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.587 1.155 . . . . 0.0 110.952 178.54 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 55.2 mt -79.0 139.87 17.73 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 C-N-CA 124.713 1.205 . . . . 0.0 110.089 175.801 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 8.7 p -136.05 157.4 46.93 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 121.907 0.86 . . . . 0.0 113.056 169.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.4 m -104.55 164.3 11.85 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 125.168 1.387 . . . . 0.0 111.749 -173.062 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 45.3 mt -56.27 -32.03 64.16 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 121.458 -0.776 . . . . 0.0 112.235 172.177 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.7 t80 -61.58 -29.78 70.24 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 124.113 0.965 . . . . 0.0 113.4 174.221 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 61.6 mm-40 -78.87 -36.43 42.23 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.317 0.647 . . . . 0.0 110.484 175.652 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 87.2 mt -64.13 -43.52 95.03 Favored 'General case' 0 CA--C 1.539 0.546 0 O-C-N 121.813 -0.554 . . . . 0.0 111.467 171.716 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -59.39 -24.19 63.24 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.601 1.56 . . . . 0.0 114.172 173.765 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.4 t30 -77.3 -29.49 53.7 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 123.951 0.901 . . . . 0.0 112.702 176.247 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 27.0 m-85 -86.23 -1.3 57.34 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 124.625 1.17 . . . . 0.0 113.884 175.16 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 57.2 m -73.5 132.2 42.62 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 123.405 0.682 . . . . 0.0 110.36 168.593 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.251 1.161 0 C-N-CA 127.168 2.187 . . . . 0.0 112.765 -172.31 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 12.5 t80 . . . . . 0 N--CA 1.489 1.478 0 CA-C-O 118.757 -0.639 . . . . 0.0 110.301 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 92.1 t -61.67 122.48 12.39 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 CA-C-N 120.224 1.375 . . . . 0.0 111.457 -174.212 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 47.4 t30 -168.27 103.0 0.44 Allowed 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 126.351 1.861 . . . . 0.0 109.312 -174.063 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 3.0 mm-40 -164.21 179.51 6.82 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.802 1.241 . . . . 0.0 111.563 -168.817 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 40.9 m-70 -72.73 138.54 46.61 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 123.775 0.83 . . . . 0.0 110.37 168.173 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 72.6 mt -140.39 126.79 20.03 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 126.925 2.09 . . . . 0.0 109.045 175.613 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 87.4 m -128.0 141.92 51.38 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.61 1.164 . . . . 0.0 112.614 -172.382 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 47.94 -121.04 6.66 Favored Glycine 0 C--N 1.343 0.941 0 C-N-CA 125.273 1.416 . . . . 0.0 114.552 169.11 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 18.1 m -54.65 -37.69 65.99 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.835 1.254 . . . . 0.0 113.105 178.382 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 77.2 m-70 -75.07 -28.52 60.39 Favored 'General case' 0 CA--C 1.543 0.68 0 O-C-N 120.958 -1.089 . . . . 0.0 112.759 176.882 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 28.5 tp -70.08 -43.54 70.94 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 121.353 -0.842 . . . . 0.0 111.371 170.051 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 60.8 t -61.75 -41.8 91.94 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.094 0 C-N-CA 124.348 1.059 . . . . 0.0 110.891 173.009 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -58.35 -49.87 75.69 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.894 1.277 . . . . 0.0 111.49 173.666 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.41 -42.4 96.08 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.532 0.733 . . . . 0.0 111.645 179.454 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 47.0 mt -56.69 -51.11 70.04 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-O 118.661 -0.685 . . . . 0.0 111.349 173.685 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -66.47 -35.18 79.65 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 119.897 1.226 . . . . 0.0 112.271 -178.193 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 83.8 mt -68.95 -41.14 78.44 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 123.611 0.765 . . . . 0.0 112.525 176.422 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 41.9 t -71.5 -46.58 62.82 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.984 0 C-N-CA 123.66 0.784 . . . . 0.0 112.002 177.389 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 72.0 m -78.13 -38.34 44.1 Favored 'General case' 0 N--CA 1.466 0.334 0 N-CA-C 113.306 0.854 . . . . 0.0 113.306 -173.072 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 56.36 -123.71 32.34 Favored Glycine 0 CA--C 1.53 1.013 0 C-N-CA 123.659 0.647 . . . . 0.0 111.912 -179.602 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 3.2 pm0 -67.01 -15.45 63.74 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.671 1.588 . . . . 0.0 114.705 178.374 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 81.8 mtp180 -67.99 -26.22 65.81 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 119.106 0.866 . . . . 0.0 112.732 178.607 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.42 168.69 20.11 Favored Glycine 0 CA--C 1.534 1.229 0 C-N-CA 124.616 1.103 . . . . 0.0 112.245 -169.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 34.3 p90 -152.96 165.68 34.78 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 125.026 1.33 . . . . 0.0 112.821 -178.423 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -132.11 104.81 7.0 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 123.933 0.893 . . . . 0.0 110.49 171.141 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 83.7 t80 -73.4 148.98 42.83 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 123.97 0.908 . . . . 0.0 111.394 171.139 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -158.02 115.51 1.81 Allowed Pre-proline 0 N--CA 1.472 0.657 0 C-N-CA 124.997 1.319 . . . . 0.0 109.659 178.694 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_endo -79.71 177.38 8.49 Favored 'Trans proline' 0 CA--C 1.534 0.508 0 C-N-CA 123.982 3.121 . . . . 0.0 112.686 -172.607 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt . . . . . 0 CA--C 1.548 0.901 0 C-N-CA 125.036 1.334 . . . . 0.0 112.605 176.034 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 14.2 tt . . . . . 0 N--CA 1.484 1.252 0 CA-C-O 119.991 -0.052 . . . . 0.0 110.96 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 2.7 t -65.73 -33.11 61.41 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.127 0 C-N-CA 123.556 0.743 . . . . 0.0 111.184 -171.655 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.5 pm0 -68.67 -8.96 47.2 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.961 1.305 . . . . 0.0 113.879 175.318 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 72.0 tp60 -103.72 -58.42 1.88 Allowed 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.108 0.963 . . . . 0.0 108.951 168.208 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 41.8 m -65.86 -31.17 71.97 Favored 'General case' 0 N--CA 1.469 0.486 0 N-CA-C 115.159 1.54 . . . . 0.0 115.159 -170.729 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 48.5 t -96.97 -47.34 5.85 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 119.09 0.859 . . . . 0.0 112.167 -178.398 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 32.1 m -69.95 -31.52 69.29 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 125.496 1.518 . . . . 0.0 111.887 -179.504 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.4 t -133.36 -152.87 0.51 Allowed 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.34 1.456 . . . . 0.0 109.974 172.503 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 78.5 mt -101.34 147.55 8.17 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 C-N-CA 126.522 1.929 . . . . 0.0 109.76 179.283 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.0 p -138.5 160.97 38.21 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 113.103 0.779 . . . . 0.0 113.103 169.252 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 76.6 p -105.74 163.01 13.04 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 125.46 1.504 . . . . 0.0 113.626 -174.811 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 81.6 mt -60.51 -33.24 72.34 Favored 'General case' 0 N--CA 1.471 0.581 0 O-C-N 121.47 -0.769 . . . . 0.0 111.984 170.18 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 91.6 t80 -65.25 -36.17 83.29 Favored 'General case' 0 N--CA 1.47 0.544 0 O-C-N 121.604 -0.685 . . . . 0.0 112.327 174.271 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 87.8 mt-30 -70.18 -40.15 74.81 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 118.563 -0.732 . . . . 0.0 111.054 172.177 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 73.0 mt -58.77 -41.52 86.78 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 119.549 1.068 . . . . 0.0 111.979 172.07 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.4 ' HA ' ' SG ' ' A' ' 20' ' ' CYS . 18.3 mt-10 -63.21 -35.68 81.13 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 113.527 0.936 . . . . 0.0 113.527 171.81 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 26.9 t30 -65.37 -24.07 67.14 Favored 'General case' 0 CA--C 1.547 0.837 0 O-C-N 120.94 -1.1 . . . . 0.0 112.429 174.355 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 47.6 m-85 -90.99 0.71 57.47 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 125.163 1.385 . . . . 0.0 114.056 173.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.4 ' SG ' ' HA ' ' A' ' 17' ' ' GLU . 67.2 m -71.74 149.59 45.25 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 120.93 -1.106 . . . . 0.0 111.307 169.172 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 . . . . . 0 C--O 1.251 1.184 0 C-N-CA 125.342 1.457 . . . . 0.0 112.999 -179.569 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 82.0 m-85 . . . . . 0 N--CA 1.486 1.326 0 CA-C-O 119.34 -0.362 . . . . 0.0 111.359 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 22.8 t 73.83 -50.28 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 C-N-CA 128.252 2.621 . . . . 0.0 113.21 172.633 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 3.6 m120 -99.79 134.03 43.28 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.236 1.415 . . . . 0.0 111.362 -178.671 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 2.4 mm-40 -159.75 169.94 22.57 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.977 1.311 . . . . 0.0 112.508 -178.065 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 97.0 m-70 -88.98 135.29 33.63 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.784 1.233 . . . . 0.0 109.372 167.191 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 77.5 mt -143.81 119.46 10.44 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 125.592 1.557 . . . . 0.0 109.521 -177.555 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 86.4 m -123.78 130.79 53.17 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.818 1.247 . . . . 0.0 112.543 -176.468 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 58.83 -121.12 25.54 Favored Glycine 0 N--CA 1.472 1.063 0 C-N-CA 124.815 1.198 . . . . 0.0 113.998 169.243 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 24.1 p -53.47 -43.15 67.92 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 124.437 1.095 . . . . 0.0 112.501 177.182 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 27.4 m80 -61.08 -40.74 94.84 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.313 1.045 . . . . 0.0 112.031 177.428 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 47.3 tp -66.72 -45.91 77.18 Favored 'General case' 0 C--O 1.223 -0.323 0 C-N-CA 124.117 0.967 . . . . 0.0 111.363 174.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 68.6 t -62.89 -42.16 95.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 C-N-CA 123.903 0.881 . . . . 0.0 111.241 178.339 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.7 mm-40 -59.01 -52.04 67.48 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.677 0.791 . . . . 0.0 111.216 173.436 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.79 -44.74 89.01 Favored 'General case' 0 CA--C 1.538 0.518 0 O-C-N 121.681 -0.637 . . . . 0.0 111.905 -177.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 62.5 tp -58.66 -50.03 75.38 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 125.023 1.329 . . . . 0.0 111.217 178.513 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -68.01 -35.83 78.96 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 119.437 1.017 . . . . 0.0 112.291 179.258 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 78.4 mt -67.47 -36.33 80.93 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 118.864 0.757 . . . . 0.0 112.195 176.129 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 33.4 t -67.04 -45.66 86.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 CA-C-N 118.906 0.776 . . . . 0.0 111.482 171.895 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 72.2 m -73.6 -34.54 65.11 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 113.655 0.983 . . . . 0.0 113.655 -176.763 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 64.49 -130.93 37.84 Favored Glycine 0 CA--C 1.529 0.931 0 C-N-CA 124.142 0.877 . . . . 0.0 111.041 -177.698 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -65.91 -15.25 62.78 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 114.47 1.285 . . . . 0.0 114.47 178.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 83.4 mtm180 -66.89 -32.75 74.21 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.21 1.004 . . . . 0.0 113.564 -176.641 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.09 176.63 44.36 Favored Glycine 0 CA--C 1.533 1.204 0 C-N-CA 123.867 0.746 . . . . 0.0 112.212 -169.587 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 45.3 p90 -149.14 159.62 44.08 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 114.881 1.437 . . . . 0.0 114.881 -168.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 76.8 t80 -100.35 136.44 40.24 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 126.601 1.961 . . . . 0.0 109.691 169.255 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 64.1 t80 -153.94 122.34 6.18 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.775 0.83 . . . . 0.0 112.283 -179.7 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 9.3 t 170.87 136.17 0.07 OUTLIER Pre-proline 0 N--CA 1.479 1.007 0 C-N-CA 129.316 3.046 . . . . 0.0 109.544 170.811 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -85.24 166.71 10.85 Favored 'Trans proline' 0 CA--C 1.536 0.624 0 C-N-CA 123.628 2.885 . . . . 0.0 112.07 174.857 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 94.0 mttt . . . . . 0 CA--C 1.542 0.651 0 N-CA-C 112.807 0.669 . . . . 0.0 112.807 169.408 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 17.8 tt . . . . . 0 N--CA 1.484 1.256 0 N-CA-C 114.026 1.121 . . . . 0.0 114.026 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 41.9 t -66.77 -32.55 58.53 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.99 0 C-N-CA 123.556 0.742 . . . . 0.0 111.745 -178.342 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -69.25 -48.07 62.89 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.398 0.679 . . . . 0.0 110.498 169.799 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 31.7 tt0 -69.1 -45.63 69.76 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 124.005 0.922 . . . . 0.0 111.979 -169.946 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 61.0 m -64.05 -24.49 67.72 Favored 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 113.617 0.969 . . . . 0.0 113.617 175.475 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 37.3 t -92.95 -42.6 9.38 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 118.746 0.703 . . . . 0.0 112.158 -177.714 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 69.6 p -79.67 -21.95 44.09 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 124.981 1.313 . . . . 0.0 113.64 179.361 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 9.0 t -142.14 -166.89 2.34 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.327 1.451 . . . . 0.0 111.099 175.326 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 71.0 mt -97.76 112.23 29.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 O-C-N 120.57 -1.331 . . . . 0.0 108.172 170.889 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 31.6 p -83.58 156.62 22.66 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 123.694 0.798 . . . . 0.0 111.298 171.036 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 48.7 m -83.59 149.64 26.43 Favored 'General case' 0 N--CA 1.471 0.613 0 O-C-N 120.747 -1.221 . . . . 0.0 111.72 -178.118 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 74.2 mt -60.81 -26.71 67.5 Favored 'General case' 0 CA--C 1.546 0.801 0 O-C-N 121.048 -1.032 . . . . 0.0 111.556 171.008 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 82.7 t80 -65.12 -28.53 69.49 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 124.885 1.274 . . . . 0.0 113.808 169.807 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 94.5 mt-30 -79.56 -36.15 38.72 Favored 'General case' 0 N--CA 1.472 0.628 0 O-C-N 121.048 -1.033 . . . . 0.0 110.279 174.59 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 82.1 mt -61.26 -42.99 99.57 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 118.598 0.635 . . . . 0.0 111.419 169.082 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 45.8 mm-40 -60.75 -34.3 74.23 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.561 1.144 . . . . 0.0 113.312 170.84 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 17.0 t30 -64.63 -28.65 69.76 Favored 'General case' 0 CA--C 1.546 0.817 0 O-C-N 121.021 -1.049 . . . . 0.0 112.703 179.2 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 23.8 m-85 -87.79 -12.22 45.7 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 124.547 1.139 . . . . 0.0 113.394 173.727 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 35.1 t -80.53 174.01 12.03 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.416 1.486 . . . . 0.0 111.525 168.784 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 12.6 m-80 . . . . . 0 C--O 1.251 1.146 0 C-N-CA 125.126 1.37 . . . . 0.0 112.672 171.336 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 71.1 m-85 . . . . . 0 N--CA 1.489 1.489 0 N-CA-C 111.466 0.173 . . . . 0.0 111.466 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 8.5 p -63.36 150.0 9.94 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.125 0 C-N-CA 124.734 1.214 . . . . 0.0 112.435 178.337 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 43.4 t30 81.24 178.96 0.08 Allowed 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 127.628 2.371 . . . . 0.0 113.421 172.262 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 38.0 mt-30 -134.99 -179.97 5.95 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 127.091 2.156 . . . . 0.0 110.218 -176.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 27.0 m-70 -69.68 135.67 50.13 Favored 'General case' 0 CA--C 1.546 0.821 0 O-C-N 121.202 -0.936 . . . . 0.0 110.246 168.691 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 87.7 mt -137.34 118.59 14.57 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 126.803 2.041 . . . . 0.0 109.601 -176.888 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 85.9 m -123.7 139.6 53.83 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.213 1.405 . . . . 0.0 111.307 -178.268 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 50.84 -123.88 18.31 Favored Glycine 0 N--CA 1.473 1.14 0 C-N-CA 124.693 1.14 . . . . 0.0 114.582 169.518 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 18.5 m -56.02 -32.74 64.28 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.542 1.137 . . . . 0.0 113.389 178.63 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 1.4 t-80 -72.72 -35.04 67.49 Favored 'General case' 0 CA--C 1.54 0.585 0 O-C-N 120.825 -1.172 . . . . 0.0 111.537 176.711 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 49.8 tp -68.43 -42.1 79.38 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 123.66 0.784 . . . . 0.0 111.474 171.446 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 65.3 t -59.94 -44.07 93.67 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 C-N-CA 123.577 0.751 . . . . 0.0 110.566 173.707 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -63.12 -44.24 96.16 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.52 0.728 . . . . 0.0 112.215 174.842 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.47 -39.87 94.82 Favored 'General case' 0 CA--C 1.537 0.479 0 O-C-N 121.221 -0.924 . . . . 0.0 112.179 175.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 37.0 mt -62.71 -41.7 99.28 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 123.612 0.765 . . . . 0.0 111.455 173.748 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 19.7 m-85 -61.42 -40.99 96.42 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-N 119.915 1.234 . . . . 0.0 112.376 171.601 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 77.8 mt -68.22 -42.59 79.59 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.772 0.829 . . . . 0.0 112.816 178.188 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 46.8 t -72.71 -47.43 50.23 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 124.005 0.922 . . . . 0.0 111.608 178.512 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 33.9 t -83.35 -41.37 18.29 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 113.432 0.901 . . . . 0.0 113.432 -170.393 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 70.62 -143.07 36.27 Favored Glycine 0 CA--C 1.53 1.025 0 C-N-CA 124.217 0.913 . . . . 0.0 112.514 -176.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -64.67 -18.58 65.09 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 125.234 1.414 . . . . 0.0 113.518 -178.161 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 71.0 mtm180 -60.84 -30.67 70.25 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.664 1.185 . . . . 0.0 114.084 -177.236 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 80.46 142.23 2.98 Favored Glycine 0 CA--C 1.534 1.237 0 C-N-CA 125.57 1.557 . . . . 0.0 113.352 179.628 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 52.7 p90 -129.41 155.85 45.01 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 125.199 1.4 . . . . 0.0 112.579 -177.764 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -85.83 143.67 28.14 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.485 1.114 . . . . 0.0 110.571 171.248 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 65.0 t80 -158.84 130.61 6.52 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.242 1.017 . . . . 0.0 112.732 -179.775 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 98.6 m -144.25 121.95 6.69 Favored Pre-proline 0 N--CA 1.475 0.803 0 C-N-CA 126.302 1.841 . . . . 0.0 108.065 170.09 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_endo -80.83 153.01 19.52 Favored 'Trans proline' 0 N--CA 1.458 -0.617 0 C-N-CA 123.053 2.502 . . . . 0.0 110.548 177.215 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 5.2 tmtt? . . . . . 0 CA--C 1.547 0.865 0 N-CA-C 114.081 1.141 . . . . 0.0 114.081 -178.079 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 9.2 tp . . . . . 0 N--CA 1.486 1.335 0 N-CA-C 114.544 1.313 . . . . 0.0 114.544 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 16.4 t -62.78 -33.25 59.09 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.888 0 C-N-CA 124.467 1.107 . . . . 0.0 111.72 -178.139 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -70.05 -21.53 63.16 Favored 'General case' 0 CA--C 1.544 0.72 0 O-C-N 121.508 -0.745 . . . . 0.0 112.485 176.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 72.0 tp60 -87.56 -59.34 2.28 Favored 'General case' 0 CA--C 1.535 0.375 0 O-C-N 121.516 -0.74 . . . . 0.0 110.025 170.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 63.0 m -70.52 -32.37 69.81 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 114.75 1.389 . . . . 0.0 114.75 -169.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 16.5 t -82.91 -53.62 5.71 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 119.523 1.056 . . . . 0.0 110.936 -176.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 17.7 m -77.95 -24.39 48.2 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 126.278 1.831 . . . . 0.0 112.655 -174.008 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.4 t -137.77 -167.28 2.11 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.085 1.354 . . . . 0.0 111.364 176.308 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 69.9 mt -86.04 145.26 8.01 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 C-N-CA 124.699 1.199 . . . . 0.0 109.946 175.694 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.0 p -137.83 159.27 42.46 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 114.146 1.165 . . . . 0.0 114.146 171.583 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 87.9 p -117.57 168.31 10.52 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.63 1.572 . . . . 0.0 113.394 -176.452 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 79.0 mt -57.11 -34.03 67.95 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 124.214 1.006 . . . . 0.0 112.78 177.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 89.3 t80 -61.43 -32.76 72.73 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.235 1.014 . . . . 0.0 112.583 175.189 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 90.9 mt-30 -82.75 -31.28 28.44 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.815 0.846 . . . . 0.0 111.107 177.699 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 76.1 mt -65.92 -41.35 91.52 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 118.725 0.693 . . . . 0.0 111.55 169.722 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 45.7 mm-40 -60.27 -37.51 80.65 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.911 1.285 . . . . 0.0 112.705 169.724 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.8 t-20 -61.97 -26.22 68.08 Favored 'General case' 0 CA--C 1.55 0.97 0 O-C-N 121.085 -1.009 . . . . 0.0 113.542 -175.829 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 51.5 m-85 -97.26 -2.0 43.6 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 125.267 1.427 . . . . 0.0 113.874 175.561 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 18.7 t -79.72 172.03 14.34 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.861 1.265 . . . . 0.0 111.394 168.826 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 9.1 m-80 . . . . . 0 C--O 1.256 1.407 0 C-N-CA 124.497 1.119 . . . . 0.0 112.494 171.723 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.48 0 CA-C-O 119.17 -0.443 . . . . 0.0 111.367 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 92.3 t -87.43 110.06 20.15 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 CA-C-N 119.513 1.051 . . . . 0.0 109.273 177.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 37.3 t30 -162.53 98.66 1.01 Allowed 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 127.312 2.245 . . . . 0.0 107.615 -179.279 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 6.1 tt0 -161.04 170.28 20.83 Favored 'General case' 0 N--CA 1.476 0.826 0 O-C-N 121.542 -0.724 . . . . 0.0 112.119 -166.264 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 31.6 m-70 -73.77 141.93 46.25 Favored 'General case' 0 CA--C 1.549 0.906 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 164.268 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 76.5 mt -145.21 133.55 21.78 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 126.884 2.073 . . . . 0.0 108.733 175.569 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.7 t -146.69 154.52 41.53 Favored 'General case' 0 N--CA 1.471 0.62 0 O-C-N 121.363 -0.836 . . . . 0.0 113.209 -178.814 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 54.99 -133.98 48.18 Favored Glycine 0 N--CA 1.471 0.989 0 C-N-CA 124.436 1.017 . . . . 0.0 113.021 176.612 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 18.4 m -54.36 -36.55 63.97 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.207 1.003 . . . . 0.0 113.028 177.889 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 17.5 t-160 -67.76 -39.05 84.18 Favored 'General case' 0 CA--C 1.544 0.733 0 O-C-N 120.942 -1.099 . . . . 0.0 111.721 179.598 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 39.8 tp -67.62 -42.75 81.87 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 123.569 0.747 . . . . 0.0 111.882 172.017 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 54.2 t -59.99 -43.41 92.41 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 C-N-CA 123.361 0.665 . . . . 0.0 110.867 175.244 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -64.86 -42.42 94.87 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 123.624 0.77 . . . . 0.0 112.4 174.339 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.28 -42.33 98.46 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 119.443 1.02 . . . . 0.0 112.106 174.459 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 51.0 mt -61.91 -43.08 99.57 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.688 0.795 . . . . 0.0 111.489 174.408 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 13.6 m-85 -59.79 -44.09 94.1 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 119.885 1.221 . . . . 0.0 112.329 172.224 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 74.5 mt -66.67 -42.03 87.21 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.829 0.852 . . . . 0.0 112.437 179.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 60.1 t -76.24 -49.38 25.27 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 123.359 0.664 . . . . 0.0 111.977 179.818 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 48.5 t -79.13 -39.62 33.11 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 113.014 0.746 . . . . 0.0 113.014 -172.209 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 69.39 -142.03 36.51 Favored Glycine 0 CA--C 1.53 1.016 0 C-N-CA 124.326 0.965 . . . . 0.0 112.296 -179.348 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -64.26 -19.08 65.15 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 125.221 1.408 . . . . 0.0 113.637 -176.658 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 80.3 mtm180 -60.73 -32.87 72.12 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.899 1.28 . . . . 0.0 113.797 -178.368 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 80.52 142.79 3.16 Favored Glycine 0 CA--C 1.534 1.263 0 C-N-CA 125.212 1.387 . . . . 0.0 113.419 -178.491 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 50.8 p90 -129.11 158.43 38.98 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.653 1.581 . . . . 0.0 112.766 -175.518 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 81.7 t80 -83.41 140.75 32.19 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.862 0.865 . . . . 0.0 110.893 169.625 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 65.1 t80 -149.46 142.47 24.86 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.714 1.206 . . . . 0.0 111.723 173.52 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 3.5 m -162.42 131.4 3.05 Favored Pre-proline 0 N--CA 1.478 0.938 0 C-N-CA 127.65 2.38 . . . . 0.0 107.325 173.077 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -72.07 113.09 3.58 Favored 'Trans proline' 0 C--N 1.35 0.656 0 C-N-CA 122.712 2.275 . . . . 0.0 110.239 178.376 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 28.4 tptp . . . . . 0 N--CA 1.47 0.567 0 C-N-CA 123.765 0.826 . . . . 0.0 111.574 -179.539 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 9.5 tt . . . . . 0 N--CA 1.484 1.255 0 N-CA-C 111.623 0.231 . . . . 0.0 111.623 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 8.4 p -67.56 -21.92 28.03 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 124.256 1.022 . . . . 0.0 112.445 -174.515 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -64.1 -10.19 20.99 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 125.882 1.673 . . . . 0.0 113.173 171.625 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 11.6 tt0 -113.06 -50.98 2.85 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 126.137 1.775 . . . . 0.0 109.452 168.368 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 61.0 m -67.49 -22.46 65.46 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 115.404 1.631 . . . . 0.0 115.404 -171.249 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 37.2 t -102.58 -33.76 9.35 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 119.398 0.999 . . . . 0.0 113.0 177.436 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 44.5 p -72.35 -34.53 68.08 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 125.211 1.404 . . . . 0.0 111.969 178.694 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 9.1 t -134.05 -161.32 1.13 Allowed 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 126.453 1.901 . . . . 0.0 110.031 172.844 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 66.9 mt -101.86 116.61 45.8 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 C-N-CA 124.628 1.171 . . . . 0.0 108.148 171.223 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 21.7 p -89.58 152.69 21.27 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.294 0.637 . . . . 0.0 111.111 169.777 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 36.9 t -80.61 151.32 29.1 Favored 'General case' 0 N--CA 1.47 0.561 0 O-C-N 120.902 -1.124 . . . . 0.0 112.089 -176.449 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 80.0 mt -57.96 -32.78 68.16 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 121.402 -0.811 . . . . 0.0 111.217 170.268 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 83.4 t80 -64.35 -27.43 69.01 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.053 0.941 . . . . 0.0 113.071 173.654 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 80.2 mt-30 -80.79 -39.0 27.5 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 123.399 0.68 . . . . 0.0 110.551 173.445 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 58.6 mt -57.24 -42.31 81.23 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 119.275 0.943 . . . . 0.0 111.783 172.045 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -60.54 -17.51 46.33 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 114.74 1.385 . . . . 0.0 114.74 174.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 14.6 t-20 -70.04 -24.06 63.2 Favored 'General case' 0 CA--C 1.547 0.843 0 CA-C-N 119.878 1.217 . . . . 0.0 112.963 176.014 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 88.4 m-85 -94.01 -2.06 53.59 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.118 1.367 . . . . 0.0 113.805 -177.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 82.9 m -70.03 132.2 45.52 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.61 1.164 . . . . 0.0 112.112 177.445 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.253 1.261 0 C-N-CA 128.229 2.611 . . . . 0.0 112.313 -172.447 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 72.1 m-85 . . . . . 0 N--CA 1.486 1.366 0 CA-C-O 119.439 -0.315 . . . . 0.0 110.541 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 7.6 p -161.5 144.99 4.23 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 C-N-CA 124.576 1.15 . . . . 0.0 111.245 -178.726 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 53.1 t30 -85.82 -157.8 0.35 Allowed 'General case' 0 CA--C 1.557 1.224 0 C-N-CA 125.423 1.489 . . . . 0.0 111.029 174.483 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 45.8 mm-40 -135.31 173.08 12.11 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 126.083 1.753 . . . . 0.0 110.792 175.247 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 32.4 m-70 -69.0 133.43 48.13 Favored 'General case' 0 CA--C 1.544 0.72 0 O-C-N 121.647 -0.658 . . . . 0.0 109.988 169.469 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 87.2 mt -133.84 120.47 20.49 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 125.871 1.669 . . . . 0.0 109.843 -176.244 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -121.5 140.04 52.71 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 125.05 1.34 . . . . 0.0 111.988 -179.321 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 52.94 -126.46 33.03 Favored Glycine 0 CA--C 1.53 1.006 0 C-N-CA 124.79 1.186 . . . . 0.0 114.484 169.867 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 20.6 m -56.41 -29.59 61.75 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 124.533 1.133 . . . . 0.0 113.325 178.499 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 29.6 m80 -69.47 -40.68 76.95 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 120.877 -1.139 . . . . 0.0 111.335 176.541 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 49.5 tp -65.9 -43.14 89.1 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.307 1.043 . . . . 0.0 111.153 173.657 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 41.5 t -59.87 -46.24 94.06 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 124.469 1.108 . . . . 0.0 111.188 174.364 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -64.24 -44.0 93.18 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 123.502 0.721 . . . . 0.0 111.404 177.151 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.41 -44.12 92.91 Favored 'General case' 0 CA--C 1.539 0.521 0 O-C-N 121.557 -0.715 . . . . 0.0 111.253 175.896 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 18.1 mt -60.31 -45.34 93.72 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.899 0.879 . . . . 0.0 111.878 175.538 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -57.51 -44.75 85.27 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 119.439 1.018 . . . . 0.0 112.759 174.236 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 10.0 mp -69.69 -41.18 75.78 Favored 'General case' 0 N--CA 1.471 0.575 0 C-N-CA 123.432 0.693 . . . . 0.0 112.454 178.888 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 29.9 t -66.46 -43.53 90.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 124.388 1.075 . . . . 0.0 111.485 178.629 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 71.2 m -72.94 -45.37 58.45 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 118.795 0.725 . . . . 0.0 112.763 -178.586 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.4 -129.68 40.21 Favored Glycine 0 CA--C 1.533 1.198 0 C-N-CA 124.269 0.938 . . . . 0.0 112.0 179.308 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -59.84 -21.16 60.55 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 125.081 1.352 . . . . 0.0 113.557 -179.514 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 83.5 mtm180 -67.94 -16.37 64.03 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.548 1.139 . . . . 0.0 113.841 177.226 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.87 159.93 25.4 Favored Glycine 0 CA--C 1.53 1.006 0 C-N-CA 125.35 1.452 . . . . 0.0 113.35 -179.919 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 68.8 t80 -159.15 148.27 18.48 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.482 1.113 . . . . 0.0 112.346 178.114 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 90.2 t80 -174.82 114.8 0.16 Allowed 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 127.778 2.431 . . . . 0.0 109.624 168.318 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 35.5 t80 -167.84 143.28 3.84 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 126.004 1.722 . . . . 0.0 110.439 178.558 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 10.3 p -103.4 129.21 25.89 Favored Pre-proline 0 N--CA 1.475 0.817 0 C-N-CA 124.825 1.25 . . . . 0.0 112.15 -169.71 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -85.82 150.11 9.81 Favored 'Trans proline' 0 C--N 1.352 0.734 0 C-N-CA 123.762 2.974 . . . . 0.0 111.403 176.178 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 81.7 tttt . . . . . 0 CA--C 1.549 0.928 0 C-N-CA 124.833 1.253 . . . . 0.0 113.867 -179.914 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 15.1 tt . . . . . 0 N--CA 1.481 1.092 0 N-CA-C 115.537 1.68 . . . . 0.0 115.537 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 4.7 p -59.64 -34.01 53.79 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.248 0 CA-C-N 119.87 1.214 . . . . 0.0 112.562 176.585 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -69.61 -14.71 62.97 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 123.982 0.913 . . . . 0.0 112.648 178.625 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 27.6 tt0 -99.89 -55.69 2.57 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.816 0.846 . . . . 0.0 111.098 171.683 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 59.6 m -59.08 -27.77 65.85 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 114.578 1.325 . . . . 0.0 114.578 -171.78 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 68.2 m -70.44 -29.86 66.56 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 113.641 0.978 . . . . 0.0 113.641 -179.086 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 33.5 p -122.66 -37.57 2.75 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 125.003 1.321 . . . . 0.0 112.781 -170.124 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 50.8 m -100.46 163.99 12.12 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.319 1.447 . . . . 0.0 110.992 171.072 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 16.0 tt -81.46 132.07 32.39 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 O-C-N 121.542 -0.724 . . . . 0.0 109.534 174.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 13.9 p -128.2 165.92 19.52 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.6 1.16 . . . . 0.0 111.975 -176.764 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 38.1 t -116.03 151.39 35.6 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 -169.456 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 9.6 mp -58.26 -28.89 65.34 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 123.707 0.803 . . . . 0.0 111.742 169.817 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 87.7 t80 -60.36 -32.37 71.22 Favored 'General case' 0 CA--C 1.541 0.622 0 O-C-N 121.623 -0.673 . . . . 0.0 112.567 171.583 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 56.9 mt-30 -80.49 -35.24 35.01 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 123.953 0.901 . . . . 0.0 111.017 176.676 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 82.4 mt -59.27 -43.12 92.52 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-N 118.459 0.572 . . . . 0.0 111.189 171.294 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -68.5 -33.68 74.57 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 123.675 0.79 . . . . 0.0 112.972 172.779 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 22.7 t-20 -66.22 -33.19 75.2 Favored 'General case' 0 CA--C 1.546 0.801 0 O-C-N 120.606 -1.309 . . . . 0.0 112.356 176.287 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 19.2 m-85 -82.59 -1.46 50.9 Favored 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 125.513 1.525 . . . . 0.0 113.658 171.161 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 10.6 t -86.78 179.5 6.74 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 124.844 1.257 . . . . 0.0 112.17 170.02 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 . . . . . 0 C--O 1.253 1.244 0 C-N-CA 125.578 1.551 . . . . 0.0 113.235 179.776 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 34.0 t80 . . . . . 0 N--CA 1.49 1.557 0 CA-C-O 119.435 -0.317 . . . . 0.0 110.829 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 7.0 p -60.76 -23.96 30.75 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 C-N-CA 124.731 1.212 . . . . 0.0 114.054 -173.742 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 2.9 p30 -137.99 136.65 37.13 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.949 1.3 . . . . 0.0 109.646 167.718 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 5.0 tt0 -169.23 169.31 9.32 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.163 0.985 . . . . 0.0 111.246 -167.336 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 99.6 m-70 -85.12 142.77 29.28 Favored 'General case' 0 CA--C 1.543 0.703 0 O-C-N 121.381 -0.825 . . . . 0.0 108.782 165.5 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 86.0 mt -148.66 132.15 16.7 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 125.827 1.651 . . . . 0.0 109.65 -179.039 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.7 t -145.16 136.09 24.68 Favored 'General case' 0 N--CA 1.469 0.522 0 O-C-N 121.346 -0.846 . . . . 0.0 113.068 -178.348 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 58.56 -122.8 31.2 Favored Glycine 0 N--CA 1.469 0.862 0 C-N-CA 124.564 1.078 . . . . 0.0 112.962 174.795 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 25.8 p -54.36 -34.77 61.83 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.767 1.227 . . . . 0.0 113.281 176.8 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 35.1 m80 -68.49 -40.77 80.78 Favored 'General case' 0 CA--C 1.543 0.708 0 O-C-N 120.909 -1.12 . . . . 0.0 111.599 177.311 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 63.4 tp -67.92 -43.43 79.21 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 123.807 0.843 . . . . 0.0 110.999 175.06 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 44.9 t -59.49 -46.02 93.26 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 124.131 0.973 . . . . 0.0 110.647 174.625 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -63.37 -43.31 97.99 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.524 0.729 . . . . 0.0 111.65 176.179 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.65 -42.89 97.91 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 118.911 0.778 . . . . 0.0 112.192 174.679 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 49.0 mt -62.16 -39.54 92.98 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 118.718 0.69 . . . . 0.0 111.879 175.474 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 30.4 m-85 -67.58 -38.32 83.87 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 119.407 1.003 . . . . 0.0 113.104 172.665 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 75.4 mt -69.33 -44.28 71.99 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 119.295 0.952 . . . . 0.0 112.079 176.943 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 73.9 t -77.54 -41.05 29.02 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 C-N-CA 124.49 1.116 . . . . 0.0 112.171 -177.297 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -139.43 8.77 2.44 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 115.925 1.824 . . . . 0.0 115.925 -168.75 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -61.95 -31.04 77.1 Favored Glycine 0 N--CA 1.476 1.359 0 CA-C-N 120.135 1.334 . . . . 0.0 114.725 -171.654 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -78.48 -33.96 47.88 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 118.198 0.999 . . . . 0.0 112.623 176.97 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 81.2 mtm180 -72.71 -29.01 63.02 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 124.079 0.952 . . . . 0.0 111.806 170.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 83.19 109.03 0.5 Allowed Glycine 0 CA--C 1.529 0.911 0 C-N-CA 126.549 2.023 . . . . 0.0 111.196 -179.262 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 50.6 p90 -86.83 145.27 26.67 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.44 0.696 . . . . 0.0 112.209 175.526 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -82.74 -28.57 30.33 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.205 1.002 . . . . 0.0 112.643 -177.176 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 49.6 t80 -66.04 151.63 46.42 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 114.822 1.416 . . . . 0.0 114.822 -171.49 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 49.0 m -138.45 122.48 11.5 Favored Pre-proline 0 CA--C 1.539 0.531 0 C-N-CA 125.957 1.703 . . . . 0.0 107.687 169.029 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 78.3 Cg_exo -56.58 156.92 20.49 Favored 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 123.729 2.953 . . . . 0.0 113.778 177.958 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 58.3 tptt . . . . . 0 CA--C 1.549 0.92 0 N-CA-C 113.032 0.753 . . . . 0.0 113.032 173.211 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 12.3 tt . . . . . 0 N--CA 1.482 1.132 0 N-CA-C 114.056 1.132 . . . . 0.0 114.056 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 9.3 p -63.83 -35.62 73.82 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.265 0 CA-C-N 120.458 1.481 . . . . 0.0 112.566 -177.847 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -72.04 -8.9 57.2 Favored 'General case' 0 CA--C 1.547 0.835 0 N-CA-C 113.471 0.915 . . . . 0.0 113.471 176.262 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 21.7 tt0 -93.73 -58.51 2.24 Favored 'General case' 0 N--CA 1.464 0.246 0 C-N-CA 124.788 1.235 . . . . 0.0 109.083 168.607 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 71.4 m -72.33 -22.3 61.2 Favored 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 114.555 1.317 . . . . 0.0 114.555 -169.945 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 4.7 t -77.51 -18.25 57.21 Favored 'General case' 0 N--CA 1.473 0.72 0 O-C-N 121.453 -0.779 . . . . 0.0 112.471 171.853 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 31.7 m -103.78 -42.56 5.58 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 126.663 1.985 . . . . 0.0 111.463 -173.216 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 67.3 m -124.54 168.7 12.75 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 126.795 2.038 . . . . 0.0 111.856 -179.478 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 31.8 mm -66.54 133.73 30.87 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 O-C-N 120.749 -1.219 . . . . 0.0 109.638 171.224 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.7 m -116.32 158.78 22.88 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 122.645 1.212 . . . . 0.0 113.534 175.614 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 20.9 t -122.43 162.29 21.94 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 126.443 1.897 . . . . 0.0 112.443 -176.244 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.485 ' H ' HD12 ' A' ' 13' ' ' LEU . 5.4 mp -64.12 -32.96 74.71 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 124.707 1.203 . . . . 0.0 111.923 -176.414 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 82.3 t80 -61.67 -30.79 70.96 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 123.701 0.8 . . . . 0.0 112.773 175.828 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 -78.21 -33.92 49.69 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.817 0.847 . . . . 0.0 110.667 176.766 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 90.2 mt -66.49 -46.49 76.11 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 118.644 0.656 . . . . 0.0 111.678 171.47 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 -64.11 -20.87 66.27 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 113.803 1.038 . . . . 0.0 113.803 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.7 t30 -57.01 -28.26 62.31 Favored 'General case' 0 CA--C 1.548 0.878 0 CA-C-N 119.356 0.98 . . . . 0.0 112.978 172.676 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 98.0 m-85 -98.61 -2.78 37.69 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.395 1.478 . . . . 0.0 113.487 178.547 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 12.3 t -84.65 -149.56 0.11 Allowed 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 125.989 1.716 . . . . 0.0 111.025 173.71 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 41.1 m-80 . . . . . 0 C--O 1.255 1.364 0 C-N-CA 127.045 2.138 . . . . 0.0 112.177 176.758 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 50.9 t80 . . . . . 0 N--CA 1.484 1.262 0 CA-C-O 119.627 -0.225 . . . . 0.0 111.019 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 7.1 p -70.18 -38.21 74.02 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.3 0 C-N-CA 124.023 0.929 . . . . 0.0 113.37 -173.541 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -74.23 111.68 9.64 Favored 'General case' 0 CA--C 1.544 0.718 0 N-CA-C 108.218 -1.03 . . . . 0.0 108.218 169.186 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 -170.64 172.34 5.89 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 123.932 0.893 . . . . 0.0 110.965 -165.219 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 95.1 m-70 -68.29 138.83 55.81 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 107.261 -1.385 . . . . 0.0 107.261 163.277 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 92.7 mt -138.2 126.39 22.95 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 125.177 1.391 . . . . 0.0 109.204 -178.334 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 6.3 t -146.42 145.11 30.13 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 123.312 0.645 . . . . 0.0 111.665 -174.651 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 51.92 -128.13 32.97 Favored Glycine 0 N--CA 1.472 1.091 0 C-N-CA 124.457 1.027 . . . . 0.0 112.75 175.822 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 36.2 m -58.73 -31.42 68.27 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 113.275 0.843 . . . . 0.0 113.275 179.277 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -72.05 -36.82 69.71 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 119.16 0.891 . . . . 0.0 111.641 176.571 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 57.5 tp -65.95 -47.29 75.14 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 118.591 0.632 . . . . 0.0 110.74 171.336 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 54.1 t -60.99 -43.76 96.76 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 C-N-CA 123.525 0.73 . . . . 0.0 110.618 -179.724 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -64.4 -46.25 84.11 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.602 0.761 . . . . 0.0 112.056 175.153 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.4 -42.3 99.32 Favored 'General case' 0 CA--C 1.539 0.548 0 O-C-N 121.408 -0.808 . . . . 0.0 111.857 177.5 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 46.0 tp -63.5 -41.22 98.55 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.652 1.181 . . . . 0.0 111.252 177.238 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 7.2 m-85 -60.41 -45.9 91.95 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 119.253 0.933 . . . . 0.0 112.435 169.831 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 72.2 mt -65.94 -43.5 87.86 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 123.305 0.642 . . . . 0.0 112.377 -179.378 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 53.2 t -76.97 -37.77 27.29 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 123.877 0.871 . . . . 0.0 112.327 -177.723 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 44.1 t -77.2 -41.82 39.92 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 118.779 0.718 . . . . 0.0 112.569 177.72 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 73.07 -148.21 40.8 Favored Glycine 0 CA--C 1.529 0.951 0 C-N-CA 124.646 1.117 . . . . 0.0 112.744 179.587 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -62.49 -19.98 64.13 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.257 1.423 . . . . 0.0 113.733 -177.522 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 86.9 mtm180 -57.32 -35.1 69.44 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 125.237 1.415 . . . . 0.0 114.043 179.153 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.07 144.9 2.42 Favored Glycine 0 CA--C 1.532 1.123 0 C-N-CA 125.272 1.415 . . . . 0.0 113.4 -178.148 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 48.0 p90 -113.23 151.2 31.34 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.186 1.395 . . . . 0.0 112.007 177.886 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 37.9 p90 -93.43 -10.09 36.32 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 114.34 1.237 . . . . 0.0 114.34 -178.646 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 74.7 t80 -70.2 148.25 48.84 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.934 1.294 . . . . 0.0 114.283 -177.761 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 85.7 m -127.47 131.2 23.71 Favored Pre-proline 0 N--CA 1.478 0.938 0 C-N-CA 126.389 1.876 . . . . 0.0 107.862 170.231 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -67.2 133.04 29.4 Favored 'Trans proline' 0 C--N 1.351 0.677 0 C-N-CA 122.888 2.392 . . . . 0.0 112.337 -173.14 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 84.0 tttt . . . . . 0 CA--C 1.546 0.816 0 C-N-CA 124.163 0.985 . . . . 0.0 112.971 177.875 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 8.7 tp . . . . . 0 N--CA 1.483 1.202 0 N-CA-C 114.114 1.153 . . . . 0.0 114.114 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 5.7 p -62.58 -29.67 47.44 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 C-N-CA 123.556 0.742 . . . . 0.0 112.89 -179.522 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -76.86 -8.24 56.97 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 119.566 1.075 . . . . 0.0 112.855 179.188 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 79.7 mm-40 -97.19 -59.95 1.68 Allowed 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.985 0.914 . . . . 0.0 108.869 169.039 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 94.5 m -69.09 -29.03 67.04 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 114.923 1.453 . . . . 0.0 114.923 -170.538 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 7.9 t -80.65 -43.26 20.73 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 119.392 0.996 . . . . 0.0 111.03 176.847 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 23.2 m -68.97 -38.14 79.19 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 127.011 2.124 . . . . 0.0 112.917 -175.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.4 t -146.79 -172.04 3.89 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.949 1.299 . . . . 0.0 111.146 179.459 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 50.1 mt -76.64 124.0 34.11 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 O-C-N 120.893 -1.129 . . . . 0.0 109.0 170.72 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 23.8 p -103.25 157.76 16.79 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.062 0.945 . . . . 0.0 111.453 170.635 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 34.4 t -92.8 156.21 17.14 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.57 0.748 . . . . 0.0 111.847 179.687 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 59.2 mt -58.4 -29.36 66.01 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 123.398 0.679 . . . . 0.0 111.719 172.684 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.3 t80 -62.84 -33.04 74.41 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 113.16 0.8 . . . . 0.0 113.16 172.289 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 60.6 mm-40 -77.02 -34.55 57.33 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 123.281 0.633 . . . . 0.0 110.721 175.919 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 95.6 mt -65.1 -44.37 89.05 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 118.552 0.614 . . . . 0.0 111.186 171.772 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.422 ' HA ' ' SG ' ' A' ' 20' ' ' CYS . 24.6 mt-10 -63.85 -25.5 68.19 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 113.907 1.077 . . . . 0.0 113.907 175.929 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 -63.05 -21.25 66.04 Favored 'General case' 0 CA--C 1.547 0.832 0 CA-C-N 119.14 0.882 . . . . 0.0 112.87 175.944 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 73.7 m-85 -102.01 -0.21 34.02 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.161 1.384 . . . . 0.0 114.389 177.024 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.422 ' SG ' ' HA ' ' A' ' 17' ' ' GLU . 67.4 m -65.31 144.75 56.93 Favored 'General case' 0 CA--C 1.544 0.746 0 CA-C-N 119.373 0.988 . . . . 0.0 110.473 169.132 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 21.4 t-20 . . . . . 0 C--O 1.255 1.347 0 C-N-CA 124.867 1.267 . . . . 0.0 113.105 -175.643 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 68.5 t80 . . . . . 0 N--CA 1.484 1.23 0 CA-C-O 119.931 -0.081 . . . . 0.0 110.898 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 16.9 m -67.66 148.82 11.78 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.025 0 C-N-CA 124.181 0.993 . . . . 0.0 112.566 -178.422 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 42.9 54.9 4.6 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 126.123 1.769 . . . . 0.0 114.483 174.696 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 3.1 mm-40 -145.54 -177.21 5.45 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.963 1.705 . . . . 0.0 110.832 -175.258 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 27.6 m-70 -64.48 131.21 46.47 Favored 'General case' 0 CA--C 1.546 0.809 0 O-C-N 121.312 -0.868 . . . . 0.0 109.836 168.238 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 78.4 mt -141.77 127.02 18.6 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 126.2 1.8 . . . . 0.0 109.07 -177.79 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.7 t -145.14 143.43 30.35 Favored 'General case' 0 N--CA 1.472 0.653 0 O-C-N 121.357 -0.839 . . . . 0.0 112.327 -175.322 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 56.68 -127.43 44.24 Favored Glycine 0 CA--C 1.531 1.081 0 C-N-CA 124.165 0.888 . . . . 0.0 113.252 175.293 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 31.6 p -56.82 -33.7 67.0 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.731 1.213 . . . . 0.0 113.706 177.277 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 19.1 t-160 -70.89 -37.32 73.01 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 121.119 -0.988 . . . . 0.0 111.576 176.377 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 43.1 tp -69.97 -41.68 74.14 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 123.78 0.832 . . . . 0.0 111.747 172.907 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 37.8 t -58.16 -46.14 88.52 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 C-N-CA 124.152 0.981 . . . . 0.0 110.472 172.812 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -64.48 -42.61 95.79 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.829 0.852 . . . . 0.0 112.219 176.517 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.35 -40.69 95.2 Favored 'General case' 0 CA--C 1.538 0.516 0 O-C-N 121.347 -0.846 . . . . 0.0 112.14 174.477 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 47.8 mt -65.16 -39.06 92.43 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.522 -0.736 . . . . 0.0 112.047 174.896 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 15.7 m-85 -59.56 -44.3 93.33 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 119.568 1.076 . . . . 0.0 112.037 170.052 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 80.8 mt -68.9 -43.2 75.73 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.95 0.9 . . . . 0.0 112.62 179.615 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 42.2 t -72.29 -48.23 49.38 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 124.204 1.002 . . . . 0.0 111.821 -179.048 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 84.6 m -77.54 -34.39 53.91 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 121.432 -0.793 . . . . 0.0 113.0 -177.344 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 65.02 -132.26 36.57 Favored Glycine 0 CA--C 1.527 0.821 0 C-N-CA 124.06 0.838 . . . . 0.0 111.748 179.079 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -63.12 -20.16 65.11 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 124.533 1.133 . . . . 0.0 113.257 178.874 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 85.3 mtm180 -63.83 -35.32 80.23 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.795 0.838 . . . . 0.0 113.022 179.127 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.53 179.14 34.37 Favored Glycine 0 CA--C 1.537 1.452 0 C-N-CA 124.488 1.042 . . . . 0.0 112.9 -169.868 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 46.6 p90 -158.29 169.47 24.41 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 125.416 1.486 . . . . 0.0 113.658 -172.572 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 69.6 t80 -121.85 112.95 18.97 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.302 1.441 . . . . 0.0 110.252 173.093 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 45.7 t80 -74.93 138.22 42.21 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 123.552 0.741 . . . . 0.0 111.739 177.814 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 23.2 p -128.09 108.03 19.87 Favored Pre-proline 0 N--CA 1.478 0.957 0 C-N-CA 124.375 1.07 . . . . 0.0 111.825 179.507 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 31.0 Cg_exo -66.85 171.06 11.6 Favored 'Trans proline' 0 CA--C 1.538 0.681 0 C-N-CA 124.237 3.291 . . . . 0.0 112.072 168.853 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 60.4 tttp . . . . . 0 CA--C 1.546 0.81 0 N-CA-C 112.847 0.684 . . . . 0.0 112.847 169.635 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 10.8 tp . . . . . 0 N--CA 1.483 1.214 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 58.2 t -68.64 -23.89 28.41 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 C-N-CA 123.71 0.804 . . . . 0.0 112.241 179.064 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -80.74 -46.47 15.42 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.639 -0.663 . . . . 0.0 110.063 168.909 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 13.2 tp60 -68.31 -46.69 69.57 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.191 0.996 . . . . 0.0 112.853 -169.509 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 61.5 m -72.15 -21.13 61.5 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 113.12 0.785 . . . . 0.0 113.12 176.874 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 10.8 t -88.11 -48.62 7.6 Favored 'General case' 0 N--CA 1.467 0.395 0 O-C-N 121.407 -0.808 . . . . 0.0 111.632 -176.821 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 68.2 p -75.75 -22.44 56.5 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 125.03 1.332 . . . . 0.0 113.558 -178.919 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.3 t -150.24 -175.28 5.01 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.652 1.181 . . . . 0.0 111.743 178.19 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 62.4 mt -76.79 134.53 28.6 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 C-N-CA 124.551 1.141 . . . . 0.0 110.019 176.248 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.9 p -126.31 160.63 29.82 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.964 1.306 . . . . 0.0 110.973 170.271 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 90.3 p -110.82 165.36 11.91 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.44 1.096 . . . . 0.0 112.714 -179.103 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 10.2 mp -58.29 -28.34 64.91 Favored 'General case' 0 N--CA 1.473 0.681 0 O-C-N 121.609 -0.682 . . . . 0.0 112.515 173.602 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 78.3 t80 -64.31 -33.92 76.95 Favored 'General case' 0 CA--C 1.542 0.666 0 O-C-N 121.59 -0.694 . . . . 0.0 112.857 172.521 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 65.7 mm-40 -75.66 -24.24 56.36 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.623 0.769 . . . . 0.0 111.984 173.209 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 81.2 mt -75.93 -47.24 26.02 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 119.238 0.926 . . . . 0.0 111.447 172.268 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -65.29 -20.42 66.4 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 113.192 0.812 . . . . 0.0 113.192 177.146 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.5 t30 -54.79 -30.29 56.52 Favored 'General case' 0 CA--C 1.549 0.92 0 CA-C-N 119.144 0.884 . . . . 0.0 113.235 171.732 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 98.2 m-85 -98.18 -2.06 40.72 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.583 1.553 . . . . 0.0 113.646 178.567 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 11.3 t -78.31 169.5 18.16 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.465 1.506 . . . . 0.0 111.533 171.192 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 9.9 m-80 . . . . . 0 C--O 1.252 1.233 0 C-N-CA 124.857 1.263 . . . . 0.0 112.409 173.943 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 67.6 t80 . . . . . 0 N--CA 1.486 1.347 0 CA-C-O 119.681 -0.2 . . . . 0.0 110.697 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 13.0 m -80.71 68.56 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 C-N-CA 125.042 1.337 . . . . 0.0 111.144 177.149 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 39.7 p-10 -156.2 147.9 22.86 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.47 1.508 . . . . 0.0 113.426 -174.49 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 1.6 mm-40 -176.44 177.26 1.49 Allowed 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 126.982 2.113 . . . . 0.0 110.569 -177.551 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 27.0 m-70 -77.44 141.45 39.72 Favored 'General case' 0 CA--C 1.548 0.885 0 O-C-N 120.948 -1.095 . . . . 0.0 109.603 166.458 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 69.8 mt -144.12 135.56 25.77 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 126.521 1.928 . . . . 0.0 109.119 174.141 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 5.5 t -149.33 142.7 25.23 Favored 'General case' 0 N--CA 1.473 0.676 0 O-C-N 121.138 -0.976 . . . . 0.0 112.944 -177.464 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 62.57 -131.1 43.87 Favored Glycine 0 CA--C 1.529 0.941 0 C-N-CA 124.613 1.102 . . . . 0.0 113.321 175.46 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 26.1 p -56.02 -35.26 66.66 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 124.734 1.214 . . . . 0.0 113.026 177.6 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 23.6 m80 -64.48 -42.15 96.06 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.193 0.997 . . . . 0.0 111.613 176.541 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 48.0 tp -70.41 -42.51 71.56 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 123.928 0.891 . . . . 0.0 111.68 176.583 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 55.9 t -60.37 -44.28 95.68 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 123.293 0.637 . . . . 0.0 110.694 174.829 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -64.45 -43.09 95.35 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.819 0.848 . . . . 0.0 111.999 175.343 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.37 -44.01 96.02 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 118.609 0.64 . . . . 0.0 111.684 174.449 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 31.8 mt -59.9 -43.67 94.68 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 118.87 0.759 . . . . 0.0 111.345 175.606 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 20.8 m-85 -60.59 -44.87 95.76 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 119.131 0.878 . . . . 0.0 112.624 173.546 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 81.3 mt -69.36 -43.92 72.62 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 123.694 0.797 . . . . 0.0 112.493 -179.502 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 69.6 t -78.03 -40.92 26.9 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 124.766 1.226 . . . . 0.0 111.796 -174.074 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 48.7 t -78.19 -41.43 34.58 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 118.781 0.718 . . . . 0.0 112.282 176.459 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 72.25 -146.83 39.96 Favored Glycine 0 CA--C 1.531 1.064 0 C-N-CA 124.325 0.964 . . . . 0.0 112.741 178.524 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -60.79 -21.1 62.75 Favored 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 125.465 1.506 . . . . 0.0 113.561 -176.663 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 89.1 mtm180 -56.8 -36.12 69.53 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.968 1.307 . . . . 0.0 113.029 175.889 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 80.07 140.71 2.41 Favored Glycine 0 CA--C 1.534 1.273 0 C-N-CA 125.352 1.453 . . . . 0.0 112.935 -178.482 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 38.7 p90 -119.04 162.91 17.78 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.819 1.248 . . . . 0.0 112.258 179.857 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 4.1 t80 -145.31 85.1 1.71 Allowed 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.891 1.276 . . . . 0.0 109.452 175.373 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -78.4 169.4 18.31 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 115.614 1.709 . . . . 0.0 115.614 -173.089 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 87.7 m -106.31 100.92 32.18 Favored Pre-proline 0 N--CA 1.476 0.857 0 C-N-CA 125.572 1.549 . . . . 0.0 109.53 173.824 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -92.55 143.55 2.44 Favored 'Trans proline' 0 C--N 1.35 0.647 0 C-N-CA 123.406 2.738 . . . . 0.0 113.162 -177.959 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt . . . . . 0 N--CA 1.478 0.948 0 C-N-CA 128.801 2.84 . . . . 0.0 115.761 168.607 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 11.2 tp . . . . . 0 N--CA 1.482 1.174 0 N-CA-C 114.25 1.204 . . . . 0.0 114.25 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 47.9 t -62.24 -35.66 70.31 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.134 0 CA-C-N 118.624 0.647 . . . . 0.0 111.334 176.267 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -76.67 -7.66 55.73 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.463 1.105 . . . . 0.0 112.91 -179.454 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 35.9 tp60 -103.01 -57.52 2.03 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.935 1.294 . . . . 0.0 109.861 173.941 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 83.4 m -74.34 -25.55 59.61 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 115.16 1.541 . . . . 0.0 115.16 -169.522 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 72.3 m -77.24 -23.31 51.32 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 119.373 0.988 . . . . 0.0 113.019 -179.692 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 18.0 p -114.09 -48.13 2.91 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 125.966 1.707 . . . . 0.0 111.747 -171.315 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 73.2 m -96.67 169.91 9.56 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.505 1.522 . . . . 0.0 111.437 172.087 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 61.8 mt -77.69 130.1 36.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 O-C-N 120.939 -1.101 . . . . 0.0 109.034 172.964 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.3 m -97.56 155.81 16.79 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 122.343 1.068 . . . . 0.0 112.756 173.223 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 90.5 p -118.33 162.76 17.76 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 126.665 1.986 . . . . 0.0 110.996 177.504 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 58.3 mt -62.55 -28.13 69.65 Favored 'General case' 0 CA--C 1.536 0.437 0 O-C-N 121.884 -0.51 . . . . 0.0 111.797 175.484 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 89.4 t80 -65.01 -38.87 92.34 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 123.795 0.838 . . . . 0.0 112.766 172.204 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -72.74 -28.37 62.59 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 123.074 0.55 . . . . 0.0 112.011 175.631 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 86.3 mt -72.39 -44.63 62.22 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-N 118.531 0.605 . . . . 0.0 111.971 169.89 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.0 mm-40 -55.38 -38.4 68.82 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.041 1.336 . . . . 0.0 112.569 172.394 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 -60.09 -22.55 62.9 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 113.554 0.946 . . . . 0.0 113.554 177.351 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 18.7 m-85 -103.39 1.69 32.93 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.672 1.589 . . . . 0.0 114.288 175.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 86.4 m -71.97 154.22 41.32 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 120.566 -1.334 . . . . 0.0 111.765 169.07 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 21.4 t-20 . . . . . 0 C--O 1.254 1.313 0 C-N-CA 124.496 1.118 . . . . 0.0 112.933 176.98 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . 0.251 23.4 p90 . . . . . 0 N--CA 1.488 1.448 0 CA-C-O 118.249 -0.881 . . . . 0.0 111.209 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 18.6 m -69.7 161.62 4.33 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.281 0 CA-C-N 120.569 1.532 . . . . 0.0 111.98 170.66 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 8.5 p-10 -55.46 135.85 50.2 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.735 1.214 . . . . 0.0 112.401 171.837 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -166.73 163.23 16.57 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 124.991 1.316 . . . . 0.0 110.979 -169.344 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 98.4 m-70 -69.77 136.47 50.92 Favored 'General case' 0 CA--C 1.545 0.778 0 O-C-N 121.224 -0.922 . . . . 0.0 110.385 168.663 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 72.4 mt -140.67 131.45 25.8 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 124.808 1.243 . . . . 0.0 109.518 -177.472 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.6 t -145.6 147.18 31.78 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -176.71 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 56.1 -123.52 31.33 Favored Glycine 0 CA--C 1.528 0.873 0 C-N-CA 124.742 1.163 . . . . 0.0 113.174 172.441 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 23.8 p -55.85 -41.38 74.24 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.299 1.04 . . . . 0.0 112.986 176.263 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 14.7 m-70 -70.28 -32.21 69.91 Favored 'General case' 0 CA--C 1.541 0.63 0 O-C-N 120.682 -1.261 . . . . 0.0 112.575 178.619 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 46.5 tp -68.14 -41.18 82.04 Favored 'General case' 0 N--CA 1.471 0.59 0 O-C-N 121.581 -0.699 . . . . 0.0 111.003 171.221 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 25.5 t -61.57 -45.74 98.01 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 C-N-CA 124.23 1.012 . . . . 0.0 110.774 173.321 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -59.59 -46.29 89.37 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 123.97 0.908 . . . . 0.0 111.652 174.299 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.89 -41.32 99.38 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 121.505 -0.747 . . . . 0.0 112.215 178.372 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 73.6 mt -64.18 -41.25 97.18 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 118.768 -0.634 . . . . 0.0 111.521 174.542 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 -59.31 -44.55 92.55 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-N 119.798 1.181 . . . . 0.0 112.286 171.0 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 67.8 mt -67.16 -42.28 84.59 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.172 0.989 . . . . 0.0 112.965 -179.636 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 53.8 t -74.93 -49.39 29.03 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 123.419 0.688 . . . . 0.0 111.659 178.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 58.1 m -78.03 -33.46 51.06 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 113.267 0.84 . . . . 0.0 113.267 -172.352 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 64.8 -135.33 38.02 Favored Glycine 0 CA--C 1.53 1.006 0 C-N-CA 124.024 0.821 . . . . 0.0 112.125 179.095 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -62.05 -23.21 66.34 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 124.539 1.136 . . . . 0.0 113.554 -178.423 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 88.2 mtm180 -59.79 -38.29 81.48 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.087 0.955 . . . . 0.0 112.876 176.893 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 76.78 178.22 46.12 Favored Glycine 0 CA--C 1.533 1.215 0 C-N-CA 124.12 0.867 . . . . 0.0 112.117 -168.606 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 54.4 p90 -141.41 157.46 45.15 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 113.898 1.073 . . . . 0.0 113.898 -171.612 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -96.42 158.36 15.47 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 126.304 1.841 . . . . 0.0 108.943 167.93 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 26.2 t80 -148.1 143.77 27.38 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 121.403 -0.811 . . . . 0.0 111.906 -173.861 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 18.6 m -141.33 115.54 7.0 Favored Pre-proline 0 N--CA 1.475 0.82 0 C-N-CA 124.725 1.21 . . . . 0.0 109.676 179.592 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -83.55 166.06 13.88 Favored 'Trans proline' 0 CA--C 1.538 0.701 0 C-N-CA 124.316 3.344 . . . . 0.0 111.97 179.496 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 40.6 ttpt . . . . . 0 CA--C 1.545 0.78 0 C-N-CA 123.692 0.797 . . . . 0.0 112.667 170.628 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . 0.544 ' N ' ' HG1' ' B' ' 27' ' ' THR . 8.3 tt . . . . . 0 N--CA 1.482 1.141 0 N-CA-C 113.63 0.974 . . . . 0.0 113.63 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 55.6 t -62.52 -30.51 49.33 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 CA-C-N 119.069 0.85 . . . . 0.0 111.176 178.862 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -69.5 -36.89 76.9 Favored 'General case' 0 CA--C 1.541 0.608 0 O-C-N 120.813 -1.18 . . . . 0.0 111.009 174.94 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 19.8 tp60 -77.73 -36.47 50.85 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.757 0.823 . . . . 0.0 112.219 -179.754 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 56.2 m -97.47 -27.26 14.52 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 115.069 1.507 . . . . 0.0 115.069 -175.85 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 22.8 t -102.01 -58.0 1.96 Allowed 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 120.006 1.275 . . . . 0.0 111.964 -176.927 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 15.5 m -65.8 -55.62 16.21 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 124.413 1.085 . . . . 0.0 109.498 177.32 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 74.8 m -89.89 176.0 6.99 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 124.112 0.965 . . . . 0.0 111.035 167.329 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 11.3 tt -92.65 147.09 5.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 124.033 0.933 . . . . 0.0 110.466 171.453 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.6 p -130.3 154.73 47.32 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 114.034 1.124 . . . . 0.0 114.034 176.643 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 47.0 t -92.95 153.94 18.47 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.698 1.599 . . . . 0.0 112.824 178.59 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 10.8 mp -59.36 -28.49 66.91 Favored 'General case' 0 N--CA 1.47 0.548 0 O-C-N 121.321 -0.862 . . . . 0.0 111.824 172.214 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.8 t80 -60.85 -36.22 78.57 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 121.466 -0.772 . . . . 0.0 112.529 170.647 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -76.22 -37.5 57.66 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 123.809 0.844 . . . . 0.0 110.392 177.637 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 93.7 mt -59.48 -43.13 93.35 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 123.288 0.635 . . . . 0.0 111.539 172.708 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -67.64 -33.05 74.19 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 113.412 0.894 . . . . 0.0 113.412 172.578 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 -70.59 -27.48 64.14 Favored 'General case' 0 CA--C 1.544 0.749 0 CA-C-N 119.652 1.115 . . . . 0.0 113.504 177.04 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 17.2 m-85 -79.0 -5.38 53.77 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 124.069 0.948 . . . . 0.0 113.482 169.351 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 2.8 t -82.04 168.35 17.89 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.785 1.234 . . . . 0.0 112.367 171.065 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.251 1.177 0 C-N-CA 125.34 1.456 . . . . 0.0 113.0 -174.303 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 65.6 m-85 . . . . . 0 N--CA 1.487 1.416 0 CA-C-O 119.642 -0.218 . . . . 0.0 110.525 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 26.8 t -84.97 115.76 27.37 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 N-CA-C 106.742 -1.577 . . . . 0.0 106.742 168.689 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -154.89 146.25 22.98 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.352 1.061 . . . . 0.0 112.92 -169.554 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 29.3 tt0 -158.62 160.36 36.45 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.13 0.972 . . . . 0.0 111.144 -169.831 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 70.7 m-70 -86.56 128.74 35.0 Favored 'General case' 0 CA--C 1.545 0.762 0 O-C-N 121.509 -0.745 . . . . 0.0 110.578 168.89 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 66.3 mt -143.03 133.91 25.44 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 126.604 1.962 . . . . 0.0 109.582 -173.224 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -137.76 140.08 40.44 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 123.89 0.876 . . . . 0.0 112.24 -172.074 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 52.94 -123.35 24.07 Favored Glycine 0 N--CA 1.474 1.171 0 C-N-CA 124.387 0.994 . . . . 0.0 114.39 169.536 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 25.2 p -58.64 -36.38 74.01 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.174 0.989 . . . . 0.0 113.119 177.109 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 93.3 m-70 -66.87 -36.83 83.2 Favored 'General case' 0 CA--C 1.54 0.559 0 O-C-N 120.739 -1.225 . . . . 0.0 111.791 175.001 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 40.2 tp -67.97 -41.75 81.9 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 123.721 0.808 . . . . 0.0 111.753 173.506 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 50.9 t -59.44 -47.67 89.88 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.137 0 C-N-CA 124.329 1.051 . . . . 0.0 111.038 172.808 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -63.57 -40.45 97.0 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 123.116 0.567 . . . . 0.0 112.042 176.336 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.1 -42.65 99.64 Favored 'General case' 0 CA--C 1.534 0.342 0 O-C-N 121.273 -0.892 . . . . 0.0 112.292 174.807 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 49.2 mt -58.94 -43.1 91.15 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 118.887 0.767 . . . . 0.0 111.566 174.925 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 23.7 m-85 -61.19 -47.29 86.81 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 118.479 0.581 . . . . 0.0 112.319 172.641 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 72.3 mt -68.85 -42.29 77.3 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.587 0.755 . . . . 0.0 112.807 -177.713 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 74.0 t -79.17 -41.79 23.21 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 C-N-CA 124.403 1.081 . . . . 0.0 111.821 -173.905 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 21.7 t -85.8 -33.2 21.43 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 113.809 1.04 . . . . 0.0 113.809 178.607 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 83.84 -153.78 30.08 Favored Glycine 0 CA--C 1.53 1.023 0 C-N-CA 124.468 1.032 . . . . 0.0 112.464 -174.768 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -68.56 -7.34 31.76 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 115.296 1.591 . . . . 0.0 115.296 -172.815 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 85.0 mtm180 -58.96 -36.58 75.05 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 124.906 1.282 . . . . 0.0 113.29 -178.579 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 86.48 147.16 10.5 Favored Glycine 0 CA--C 1.534 1.273 0 C-N-CA 125.2 1.381 . . . . 0.0 113.748 175.085 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 54.0 p90 -138.72 175.2 9.76 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.96 1.704 . . . . 0.0 112.594 -170.714 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -136.65 109.71 7.72 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.12 1.368 . . . . 0.0 109.236 169.46 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -88.68 149.72 23.36 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 113.215 0.82 . . . . 0.0 113.215 -179.292 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 27' ' ' THR . . . . . 0.544 ' HG1' ' N ' ' A' ' 2' ' ' ILE . 19.0 p -120.39 73.25 21.15 Favored Pre-proline 0 N--CA 1.475 0.79 0 C-N-CA 125.868 1.667 . . . . 0.0 112.543 -172.356 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_endo -72.12 144.84 43.03 Favored 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 123.338 2.692 . . . . 0.0 110.789 169.48 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 70.3 tttt . . . . . 0 CA--C 1.551 1.01 0 C-N-CA 124.046 0.938 . . . . 0.0 113.517 -175.883 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 16.6 tt . . . . . 0 N--CA 1.48 1.045 0 N-CA-C 113.954 1.094 . . . . 0.0 113.954 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 23.5 t -61.08 -39.97 84.13 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.062 0 CA-C-N 118.924 0.784 . . . . 0.0 110.408 -177.962 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -64.7 -16.62 63.15 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 126.07 1.748 . . . . 0.0 113.138 176.551 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 40.2 tt0 -90.68 -59.58 2.14 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 123.535 0.734 . . . . 0.0 109.247 168.964 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 76.0 m -55.91 -35.39 66.52 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 114.612 1.338 . . . . 0.0 114.612 -171.379 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 74.1 m -81.29 -20.8 40.07 Favored 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 113.885 1.068 . . . . 0.0 113.885 -178.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 38.3 m -114.83 -36.9 4.34 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 124.886 1.275 . . . . 0.0 112.534 -168.406 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 7.6 t -125.61 -164.91 1.35 Allowed 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 126.207 1.803 . . . . 0.0 109.911 171.343 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 13.9 tt -86.36 145.9 7.12 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.676 0 C-N-CA 124.387 1.075 . . . . 0.0 110.79 174.528 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 13.7 p -137.08 156.1 48.82 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.144 0.978 . . . . 0.0 112.334 174.389 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 14.5 m -107.24 149.21 28.0 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 113.953 1.094 . . . . 0.0 113.953 -167.749 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 27.4 mt -61.45 -29.93 70.26 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 121.272 -0.892 . . . . 0.0 111.696 174.959 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 91.7 t80 -59.95 -30.87 69.37 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.304 1.441 . . . . 0.0 113.05 170.693 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 59.1 mt-30 -80.88 -36.26 31.54 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 123.617 0.767 . . . . 0.0 110.921 174.731 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 59.7 mt -62.69 -40.54 97.46 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 118.656 0.662 . . . . 0.0 112.354 173.478 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 26.8 mt-10 -60.29 -20.38 58.86 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 114.814 1.413 . . . . 0.0 114.814 175.204 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 26.6 t30 -59.69 -27.39 66.38 Favored 'General case' 0 CA--C 1.546 0.813 0 CA-C-N 119.579 1.081 . . . . 0.0 112.723 174.343 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 76.9 m-85 -100.8 -0.06 37.78 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.331 1.452 . . . . 0.0 114.293 -174.495 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 65.8 m -75.18 126.59 31.33 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.431 0.692 . . . . 0.0 111.822 176.503 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.252 1.228 0 C-N-CA 129.169 2.988 . . . . 0.0 112.154 -171.925 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 5.9 p90 . . . . . 0 N--CA 1.483 1.221 0 N-CA-C 111.587 0.217 . . . . 0.0 111.587 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 72.3 t -90.26 146.51 6.1 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.222 0 C-N-CA 124.874 1.27 . . . . 0.0 109.503 171.333 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 53.1 p-10 -149.89 151.32 33.24 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 124.761 1.224 . . . . 0.0 113.568 -178.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 2.9 mm-40 -163.71 172.23 14.49 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.359 1.464 . . . . 0.0 111.944 -170.075 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 99.8 m-70 -90.62 135.05 33.95 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.615 1.166 . . . . 0.0 109.905 168.523 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 78.6 mt -149.41 139.44 22.06 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 124.775 1.23 . . . . 0.0 110.359 -174.607 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 2.4 t -151.57 152.36 32.8 Favored 'General case' 0 C--O 1.237 0.402 0 O-C-N 121.072 -1.018 . . . . 0.0 113.405 177.029 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 56.31 -128.1 45.22 Favored Glycine 0 CA--C 1.53 0.988 0 C-N-CA 124.738 1.161 . . . . 0.0 113.743 171.602 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 29.6 p -57.29 -37.53 72.57 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 124.36 1.064 . . . . 0.0 112.91 177.38 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 66.9 m-70 -72.31 -29.03 63.47 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 119.589 1.086 . . . . 0.0 113.027 176.665 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 50.8 tp -72.08 -45.27 61.35 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 119.035 0.834 . . . . 0.0 110.926 170.51 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 45.1 t -58.59 -40.91 80.55 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.159 0 C-N-CA 124.205 1.002 . . . . 0.0 111.231 174.184 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . 0.409 ' HA ' ' CE2' ' B' ' 16' ' ' TYR . 39.9 tt0 -61.25 -46.38 90.6 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 125.234 1.414 . . . . 0.0 112.036 171.092 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.23 -41.36 96.73 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 121.55 -0.719 . . . . 0.0 111.799 176.637 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -55.96 -51.98 65.79 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 119.138 0.881 . . . . 0.0 110.728 172.011 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . 0.409 ' CE2' ' HA ' ' B' ' 13' ' ' GLU 0.265 1.0 OUTLIER -69.47 -29.41 67.06 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 113.819 1.044 . . . . 0.0 113.819 -177.718 . . . . . . . . 4 4 . 1 . 017 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 82.4 mt -74.33 -41.74 60.6 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.161 0.984 . . . . 0.0 112.551 173.931 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 38.8 t -67.84 -47.91 77.56 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 C-N-CA 123.698 0.799 . . . . 0.0 110.786 177.81 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 86.2 m -73.75 -39.12 64.45 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 112.682 0.623 . . . . 0.0 112.682 -177.619 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.25 -129.0 40.06 Favored Glycine 0 CA--C 1.528 0.876 0 C-N-CA 123.913 0.768 . . . . 0.0 111.687 -179.624 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -60.37 -23.97 64.73 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.905 1.282 . . . . 0.0 113.182 177.527 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 85.3 mtm180 -65.39 -30.15 70.94 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.042 0.937 . . . . 0.0 113.248 178.738 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.89 175.99 11.76 Favored Glycine 0 CA--C 1.536 1.372 0 C-N-CA 124.889 1.233 . . . . 0.0 113.164 -173.766 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 15.9 p90 -143.15 161.12 39.05 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.759 1.224 . . . . 0.0 111.669 174.448 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 9.0 t80 -127.78 -13.7 5.23 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 113.822 1.045 . . . . 0.0 113.822 -176.115 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 88.3 t80 -61.18 127.12 29.99 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 124.198 0.999 . . . . 0.0 113.622 -179.569 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 12.2 p -92.49 128.71 43.39 Favored Pre-proline 0 CA--C 1.54 0.569 0 C-N-CA 125.466 1.507 . . . . 0.0 110.212 174.539 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_endo -67.38 131.47 24.91 Favored 'Trans proline' 0 C--N 1.35 0.655 0 C-N-CA 123.273 2.649 . . . . 0.0 111.421 -169.94 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 96.8 mttt . . . . . 0 N--CA 1.482 1.134 0 C-N-CA 126.787 2.035 . . . . 0.0 114.281 -179.028 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 44.6 pt . . . . . 0 N--CA 1.48 1.061 0 N-CA-C 115.5 1.667 . . . . 0.0 115.5 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . 0.648 HG21 ' HA ' ' B' ' 28' ' ' PRO . 75.2 t -56.07 -35.98 43.44 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.313 0 CA-C-N 120.462 1.483 . . . . 0.0 111.193 178.23 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 18.4 tt0 -70.81 -17.92 62.75 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 123.735 0.814 . . . . 0.0 112.769 179.102 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 37.5 tt0 -88.69 -51.76 5.5 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 124.816 1.246 . . . . 0.0 109.434 168.826 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 88.5 m -55.92 -38.77 70.72 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.444 1.098 . . . . 0.0 112.747 -176.231 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 96.0 m -76.14 -27.87 57.19 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 113.74 1.015 . . . . 0.0 113.74 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 82.0 p -102.95 -22.85 13.77 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 124.829 1.252 . . . . 0.0 113.161 -172.783 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 10.6 t -151.2 -166.2 2.46 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.289 1.836 . . . . 0.0 110.371 -174.868 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 56.7 mt -81.1 139.36 18.17 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 O-C-N 120.448 -1.407 . . . . 0.0 110.594 174.658 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 11.8 p -133.81 161.08 35.72 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 124.532 1.133 . . . . 0.0 111.207 168.628 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 24.2 p -103.1 159.28 15.67 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 113.669 0.989 . . . . 0.0 113.669 -171.552 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 56.4 mt -68.04 -27.46 66.55 Favored 'General case' 0 CA--C 1.537 0.451 0 O-C-N 121.193 -0.942 . . . . 0.0 111.86 174.805 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.9 t80 -66.05 -34.03 77.14 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 123.595 0.758 . . . . 0.0 112.766 171.471 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 70.1 mt-30 -67.12 -43.29 82.81 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 118.834 -0.603 . . . . 0.0 110.804 170.704 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 36.9 mt -58.65 -45.9 88.3 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 118.932 0.787 . . . . 0.0 111.852 175.502 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 11.3 tt0 -65.47 -23.01 66.81 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 113.78 1.03 . . . . 0.0 113.78 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 13.8 t-20 -62.55 -22.4 66.3 Favored 'General case' 0 CA--C 1.549 0.91 0 O-C-N 120.983 -1.073 . . . . 0.0 113.089 176.8 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -98.55 2.86 47.88 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 125.626 1.571 . . . . 0.0 113.794 175.57 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 11.5 t -76.64 169.93 17.36 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.627 1.171 . . . . 0.0 111.46 169.534 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 8.2 m-80 . . . . . 0 C--O 1.251 1.165 0 C-N-CA 124.036 0.934 . . . . 0.0 112.109 172.343 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 44.0 t80 . . . . . 0 N--CA 1.484 1.225 0 CA-C-O 119.784 -0.15 . . . . 0.0 110.876 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 13.8 p -66.54 150.55 10.95 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 C-N-CA 124.539 1.136 . . . . 0.0 111.708 175.337 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . 0.269 0.8 OUTLIER 47.98 59.03 4.5 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 126.244 1.818 . . . . 0.0 113.861 -179.998 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 -129.85 162.44 28.53 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.327 1.451 . . . . 0.0 111.028 -172.744 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 15.8 m-70 -76.44 135.41 39.41 Favored 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 164.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 82.3 mt -141.76 126.83 18.4 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 124.993 1.317 . . . . 0.0 109.856 -176.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 3.7 t -144.89 151.2 38.34 Favored 'General case' 0 N--CA 1.468 0.456 0 O-C-N 121.383 -0.823 . . . . 0.0 112.851 176.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.13 -124.93 34.36 Favored Glycine 0 CA--C 1.53 0.973 0 C-N-CA 125.018 1.294 . . . . 0.0 112.847 172.025 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 11.4 p -50.16 -48.64 53.74 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 125.361 1.464 . . . . 0.0 112.981 175.69 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -67.07 -34.56 77.93 Favored 'General case' 0 CA--C 1.541 0.63 0 O-C-N 121.171 -0.956 . . . . 0.0 112.216 -178.261 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . 0.592 HD21 HG22 ' A' ' 3' ' ' VAL . 52.2 tp -70.91 -42.57 69.77 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.623 0.769 . . . . 0.0 111.723 175.007 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 50.9 t -62.1 -43.09 97.3 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.858 0 C-N-CA 124.063 0.945 . . . . 0.0 110.547 174.531 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 27.1 mm-40 -63.82 -42.07 97.74 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 123.25 0.62 . . . . 0.0 112.175 173.573 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.03 -41.68 99.59 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 119.512 1.051 . . . . 0.0 111.811 175.571 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 28.0 mt -58.67 -44.54 90.21 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.822 0.849 . . . . 0.0 111.438 172.804 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 20.0 m-85 -63.01 -41.74 99.65 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 119.243 0.929 . . . . 0.0 112.952 173.268 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 64.7 mt -67.52 -41.09 84.97 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 123.919 0.887 . . . . 0.0 112.274 179.268 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 41.8 t -72.25 -48.56 48.09 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 C-N-CA 124.05 0.94 . . . . 0.0 111.934 177.583 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 48.6 t -81.62 -37.31 27.76 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 112.887 0.699 . . . . 0.0 112.887 -171.839 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 69.65 -144.27 40.02 Favored Glycine 0 CA--C 1.529 0.964 0 C-N-CA 124.111 0.862 . . . . 0.0 112.567 178.364 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -62.59 -21.52 65.68 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 125.091 1.356 . . . . 0.0 113.384 -177.211 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 90.4 mtm180 -58.76 -35.96 73.6 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.866 1.266 . . . . 0.0 113.262 178.82 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.12 142.42 1.92 Allowed Glycine 0 CA--C 1.535 1.313 0 C-N-CA 125.519 1.533 . . . . 0.0 113.517 -178.937 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 52.8 p90 -113.36 147.54 37.49 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.102 1.361 . . . . 0.0 111.077 176.397 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 45.4 p90 -94.97 -14.83 24.04 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.378 1.071 . . . . 0.0 113.709 -176.105 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 25.4 t80 -87.26 107.07 18.33 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.139 1.376 . . . . 0.0 113.506 -169.627 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 20.8 p -76.38 145.63 76.34 Favored Pre-proline 0 N--CA 1.475 0.802 0 C-N-CA 124.657 1.183 . . . . 0.0 110.064 168.831 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . 0.648 ' HA ' HG21 ' A' ' 3' ' ' VAL . 73.4 Cg_endo -72.6 151.84 53.05 Favored 'Trans proline' 0 CA--C 1.537 0.651 0 C-N-CA 122.612 2.208 . . . . 0.0 112.59 -172.406 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 22.2 tptm . . . . . 0 CA--C 1.548 0.89 0 C-N-CA 123.956 0.903 . . . . 0.0 112.26 171.584 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 10.8 tp . . . . . 0 N--CA 1.479 0.988 0 N-CA-C 114.179 1.177 . . . . 0.0 114.179 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 5.4 p -66.32 -44.25 91.08 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.102 0 CA-C-N 120.394 1.452 . . . . 0.0 112.621 -172.7 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -75.06 -32.96 61.65 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 118.778 0.717 . . . . 0.0 111.468 174.826 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -65.96 -29.93 70.41 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 124.424 1.09 . . . . 0.0 112.35 -179.858 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 65.6 m -100.6 -26.53 13.79 Favored 'General case' 0 CA--C 1.543 0.703 0 N-CA-C 114.987 1.477 . . . . 0.0 114.987 174.141 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 15.1 t -96.14 -43.97 7.51 Favored 'General case' 0 N--CA 1.479 1.021 0 CA-C-N 120.021 1.282 . . . . 0.0 112.814 -174.974 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 25.5 m -86.18 -44.81 11.9 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 124.652 1.181 . . . . 0.0 110.167 176.898 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 75.4 m -101.36 175.4 5.59 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.976 1.31 . . . . 0.0 111.801 170.109 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 7.7 mt -96.98 141.88 14.94 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 C-N-CA 125.157 1.383 . . . . 0.0 109.468 -179.409 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 12.8 p -136.6 156.29 48.76 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 115.155 1.539 . . . . 0.0 115.155 -177.913 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 34.4 t -101.09 160.85 14.04 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 127.121 2.168 . . . . 0.0 111.334 173.916 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 54.9 mt -58.06 -27.5 63.68 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 123.844 0.858 . . . . 0.0 112.094 171.484 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 86.6 t80 -61.53 -32.11 72.16 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.292 1.037 . . . . 0.0 113.465 172.354 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 37.4 mt-30 -80.31 -33.29 37.7 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 123.901 0.88 . . . . 0.0 110.958 176.625 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 55.5 mt -61.3 -43.94 98.04 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.143 0.577 . . . . 0.0 111.679 169.469 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.3 tt0 -55.58 -28.75 56.81 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.721 1.608 . . . . 0.0 113.849 179.918 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 -63.04 -20.99 65.85 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 113.551 0.945 . . . . 0.0 113.551 178.213 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 73.3 m-85 -102.8 -1.23 30.18 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 125.527 1.531 . . . . 0.0 113.449 -179.165 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 72.0 m -69.47 148.9 48.9 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.162 0.985 . . . . 0.0 113.162 174.443 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 28.4 m120 . . . . . 0 C--O 1.251 1.176 0 C-N-CA 125.024 1.33 . . . . 0.0 112.35 169.325 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 54.8 p90 . . . . . 0 N--CA 1.482 1.168 0 CA-C-O 119.761 -0.161 . . . . 0.0 110.867 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 13.4 p -70.61 122.17 21.9 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.975 0 C-N-CA 123.585 0.754 . . . . 0.0 111.582 -178.909 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 55.7 t30 -169.49 118.21 0.63 Allowed 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.876 1.67 . . . . 0.0 109.901 -177.33 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 2.7 mm-40 -161.25 171.62 18.07 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.816 1.246 . . . . 0.0 111.301 -171.065 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 82.4 m-70 -83.19 141.32 32.0 Favored 'General case' 0 CA--C 1.545 0.782 0 O-C-N 121.51 -0.744 . . . . 0.0 110.829 169.054 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 72.6 mt -141.88 138.88 32.41 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 126.349 1.859 . . . . 0.0 109.049 174.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 2.7 t -151.77 148.0 27.34 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 123.176 0.59 . . . . 0.0 112.232 -175.786 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.19 -130.63 47.69 Favored Glycine 0 N--CA 1.472 1.043 0 C-N-CA 124.501 1.048 . . . . 0.0 113.128 174.43 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 18.6 m -53.93 -37.11 63.51 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 124.829 1.252 . . . . 0.0 113.121 177.838 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 88.9 m-70 -68.57 -39.29 81.06 Favored 'General case' 0 CA--C 1.543 0.687 0 O-C-N 121.116 -0.99 . . . . 0.0 111.685 178.612 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 58.3 tp -65.96 -44.5 84.78 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 123.645 0.778 . . . . 0.0 111.462 173.365 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 50.2 t -60.48 -44.89 97.36 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 C-N-CA 124.178 0.991 . . . . 0.0 111.141 176.962 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 27.3 mm-40 -65.28 -42.72 92.87 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.161 0.584 . . . . 0.0 111.943 175.003 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.58 -40.16 96.24 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 119.401 1.0 . . . . 0.0 112.295 177.19 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 32.1 mt -58.46 -50.53 73.4 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 123.217 0.607 . . . . 0.0 110.422 171.671 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 23.5 m-85 -61.86 -33.47 74.24 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 119.637 1.108 . . . . 0.0 113.453 176.52 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 69.4 mt -69.05 -41.9 77.02 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 119.174 0.897 . . . . 0.0 112.419 173.866 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 56.0 t -70.66 -44.36 76.67 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 CA-C-N 118.781 0.719 . . . . 0.0 111.872 177.951 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 34.9 m -81.32 -18.77 44.6 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 114.094 1.146 . . . . 0.0 114.094 -176.281 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 66.99 -146.78 48.64 Favored Glycine 0 CA--C 1.531 1.042 0 C-N-CA 124.229 0.919 . . . . 0.0 111.703 -174.247 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 2.5 pm0 -67.22 -15.51 63.74 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.926 1.291 . . . . 0.0 113.95 179.659 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 76.9 mtp85 -68.71 -31.43 70.51 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.848 0.859 . . . . 0.0 112.52 177.216 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.61 -177.03 49.96 Favored Glycine 0 CA--C 1.533 1.206 0 C-N-CA 125.191 1.377 . . . . 0.0 113.831 -179.156 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 42.4 p90 -123.22 161.95 23.53 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.058 1.343 . . . . 0.0 111.861 178.348 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 82.7 t80 -128.08 115.34 18.29 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.194 0.998 . . . . 0.0 110.056 172.925 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 49.0 t80 -169.28 153.52 5.4 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 125.478 1.511 . . . . 0.0 112.635 -175.089 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 17.4 p -128.29 106.94 19.46 Favored Pre-proline 0 N--CA 1.473 0.714 0 C-N-CA 126.424 1.889 . . . . 0.0 109.933 173.845 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -56.4 142.81 88.54 Favored 'Trans proline' 0 C--N 1.351 0.71 0 C-N-CA 124.255 3.303 . . . . 0.0 112.75 173.451 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 62.1 pttt . . . . . 0 N--CA 1.476 0.859 0 N-CA-C 114.852 1.427 . . . . 0.0 114.852 -175.82 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.068 0 N-CA-C 114.477 1.288 . . . . 0.0 114.477 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 84.2 t -65.76 -52.91 44.32 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 CA-C-N 118.75 0.705 . . . . 0.0 110.452 -175.328 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -64.25 -36.95 85.74 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 117.842 0.292 . . . . 0.0 111.131 178.156 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 52.5 tt0 -62.85 -53.97 45.99 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.812 1.245 . . . . 0.0 111.671 -179.199 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 51.9 m -70.24 -26.52 63.88 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 113.13 0.789 . . . . 0.0 113.13 178.008 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 89.8 m -71.14 -53.29 15.07 Favored 'General case' 0 N--CA 1.472 0.662 0 O-C-N 120.965 -1.085 . . . . 0.0 111.274 173.894 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 82.4 p -83.97 -16.92 42.3 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 124.599 1.16 . . . . 0.0 114.11 -171.308 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 77.6 p -143.48 168.33 20.1 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.904 0.882 . . . . 0.0 112.677 -179.011 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 20.4 mt -68.2 131.57 33.32 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 O-C-N 121.265 -0.897 . . . . 0.0 110.038 172.555 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 13.6 p -126.23 179.12 5.41 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.505 1.122 . . . . 0.0 111.914 171.789 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 88.2 p -139.78 165.14 28.08 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 125.258 1.423 . . . . 0.0 111.759 -171.547 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 11.2 mp -61.5 -29.42 69.97 Favored 'General case' 0 CA--C 1.54 0.562 0 O-C-N 121.29 -0.881 . . . . 0.0 112.306 -179.409 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 81.9 t80 -63.51 -37.48 87.47 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 112.872 0.693 . . . . 0.0 112.872 170.92 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 60.1 mt-30 -74.43 -33.74 63.04 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 124.063 0.945 . . . . 0.0 111.403 175.45 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 89.2 mt -63.28 -51.5 65.83 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 118.604 0.638 . . . . 0.0 110.988 171.601 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 25.0 mt-10 -66.28 -27.94 68.32 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 113.483 0.92 . . . . 0.0 113.483 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 16.1 t30 -58.84 -28.72 66.34 Favored 'General case' 0 CA--C 1.546 0.822 0 CA-C-N 119.317 0.962 . . . . 0.0 112.84 176.9 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 52.0 m-85 -98.09 5.69 48.38 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.615 1.566 . . . . 0.0 113.308 176.606 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 81.1 m -98.7 163.84 12.47 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.837 1.255 . . . . 0.0 112.62 170.911 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 73.4 m-80 . . . . . 0 C--O 1.251 1.17 0 CA-C-O 117.935 -1.031 . . . . 0.0 112.779 177.223 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 26.6 t80 . . . . . 0 N--CA 1.487 1.383 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 4.3 p -60.89 148.75 8.64 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 CA-C-N 120.409 1.459 . . . . 0.0 112.482 -178.803 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 1.9 t30 65.45 52.63 1.36 Allowed 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 125.319 1.447 . . . . 0.0 111.586 172.562 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 2.9 mm-40 -149.21 167.6 25.55 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.32 1.048 . . . . 0.0 111.7 -177.725 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 28.0 m-70 -78.55 143.84 36.15 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 123.35 0.66 . . . . 0.0 109.382 167.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 60.8 mt -140.86 126.25 18.74 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 125.596 1.558 . . . . 0.0 109.483 174.425 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 5.2 t -142.53 149.62 39.36 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 121.598 -0.689 . . . . 0.0 112.414 -175.687 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 59.5 -132.06 51.49 Favored Glycine 0 CA--C 1.529 0.955 0 C-N-CA 124.392 0.996 . . . . 0.0 113.488 172.362 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 24.4 p -57.15 -36.22 70.47 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.81 1.244 . . . . 0.0 113.11 177.927 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 67.5 m-70 -71.97 -29.65 64.47 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 119.665 1.12 . . . . 0.0 113.001 175.643 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 58.3 tp -70.75 -42.75 70.06 Favored 'General case' 0 N--CA 1.471 0.581 0 O-C-N 121.287 -0.883 . . . . 0.0 111.403 170.367 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 43.5 t -58.95 -48.39 86.65 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 124.415 1.086 . . . . 0.0 110.533 173.909 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -55.96 -49.7 72.83 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.354 1.462 . . . . 0.0 111.692 173.611 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.27 -47.91 83.86 Favored 'General case' 0 CA--C 1.534 0.359 0 O-C-N 121.618 -0.676 . . . . 0.0 111.937 178.487 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 50.4 mt -60.23 -40.9 91.83 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 118.884 0.765 . . . . 0.0 111.524 178.568 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 11.8 m-85 -63.63 -47.13 82.63 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-N 119.139 0.881 . . . . 0.0 112.716 173.575 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 9.2 mp -69.7 -38.23 76.9 Favored 'General case' 0 N--CA 1.472 0.632 0 O-C-N 121.614 -0.679 . . . . 0.0 112.463 -178.373 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 73.8 t -76.08 -43.76 37.94 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 C-N-CA 124.391 1.077 . . . . 0.0 111.633 -177.559 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 64.5 m -96.71 -20.62 18.12 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 114.763 1.394 . . . . 0.0 114.763 -173.81 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 71.68 -143.56 35.47 Favored Glycine 0 CA--C 1.533 1.2 0 C-N-CA 124.584 1.087 . . . . 0.0 112.466 179.243 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -63.67 -17.7 63.22 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 125.012 1.325 . . . . 0.0 113.65 -178.531 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 61.6 mtm180 -61.23 -31.2 70.99 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.354 1.062 . . . . 0.0 113.729 -179.516 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.18 171.81 29.66 Favored Glycine 0 CA--C 1.533 1.173 0 C-N-CA 124.192 0.901 . . . . 0.0 113.872 178.634 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 51.7 p90 -137.67 155.98 48.54 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 125.682 1.593 . . . . 0.0 113.333 -169.793 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 2.8 t80 -100.43 114.17 27.52 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.548 1.539 . . . . 0.0 108.944 169.108 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 15.6 t80 -85.36 57.2 4.32 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 124.953 1.301 . . . . 0.0 112.245 -173.285 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 2.7 m -65.89 122.69 82.18 Favored Pre-proline 0 N--CA 1.476 0.869 0 C-N-CA 125.255 1.422 . . . . 0.0 112.413 -169.598 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -80.01 -171.84 1.36 Allowed 'Trans proline' 0 CA--C 1.537 0.655 0 C-N-CA 124.165 3.244 . . . . 0.0 111.305 175.151 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 61.4 tttm . . . . . 0 CA--C 1.547 0.842 0 O-C-N 121.273 -0.892 . . . . 0.0 113.284 174.025 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 18.1 tt . . . . . 0 N--CA 1.482 1.144 0 N-CA-C 115.921 1.823 . . . . 0.0 115.921 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 5.4 p -62.24 -27.21 42.14 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 O-C-N 121.294 -0.879 . . . . 0.0 112.492 176.105 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -73.71 -1.25 18.35 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 124.808 1.243 . . . . 0.0 112.862 174.821 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 12.2 tt0 -111.3 -57.46 2.24 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.046 1.338 . . . . 0.0 108.978 168.129 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 67.2 m -67.0 -27.61 67.58 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 114.802 1.408 . . . . 0.0 114.802 -170.604 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 11.9 t -92.64 -30.65 15.48 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.459 0.703 . . . . 0.0 112.819 -177.592 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 37.8 p -87.85 -31.65 19.42 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 126.344 1.857 . . . . 0.0 112.251 -178.965 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 9.1 t -142.59 -164.81 1.9 Allowed 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 126.268 1.827 . . . . 0.0 109.997 179.798 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 23.1 mm -86.52 144.66 8.94 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 C-N-CA 125.28 1.432 . . . . 0.0 110.469 177.057 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 15.0 p -137.29 172.81 12.43 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.119 1.368 . . . . 0.0 111.337 169.087 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 46.3 t -120.1 151.32 39.22 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 124.249 1.019 . . . . 0.0 112.354 -175.846 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 26.1 mt -60.77 -27.38 67.94 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.76 0.824 . . . . 0.0 112.116 175.431 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 87.1 t80 -60.87 -32.29 71.73 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 123.885 0.874 . . . . 0.0 113.178 170.262 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 68.6 mt-30 -77.73 -31.77 52.42 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.785 0.834 . . . . 0.0 110.934 176.989 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 41.2 mt -59.96 -50.37 74.0 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 122.95 0.5 . . . . 0.0 110.309 169.707 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -60.96 -28.92 69.34 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 113.294 0.85 . . . . 0.0 113.294 175.333 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 31.6 t30 -73.28 -33.88 65.46 Favored 'General case' 0 CA--C 1.545 0.778 0 CA-C-N 118.859 0.754 . . . . 0.0 112.415 176.674 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -70.81 -48.59 53.36 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.972 0.909 . . . . 0.0 112.09 171.937 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 85.0 m -54.13 134.61 44.23 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.067 1.347 . . . . 0.0 113.244 179.399 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 5.4 p30 . . . . . 0 C--O 1.252 1.189 0 C-N-CA 126.13 1.772 . . . . 0.0 113.518 -174.999 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 60.5 t80 . . . . . 0 N--CA 1.486 1.361 0 CA-C-O 119.618 -0.23 . . . . 0.0 110.527 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 10.3 t 78.37 -34.65 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 C-N-CA 128.346 2.658 . . . . 0.0 111.336 -175.99 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 11.4 p-10 -71.19 135.08 47.38 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 125.863 1.665 . . . . 0.0 112.459 169.594 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 3.3 tt0 -167.85 169.88 11.16 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.881 1.272 . . . . 0.0 111.701 179.705 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 98.5 m-70 -86.75 147.48 25.83 Favored 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 165.02 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 64.5 mt -149.22 141.26 23.86 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.784 1.634 . . . . 0.0 109.632 174.91 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.7 t -147.88 144.35 28.04 Favored 'General case' 0 N--CA 1.474 0.75 0 O-C-N 120.97 -1.081 . . . . 0.0 112.997 -178.076 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 50.04 -125.23 19.24 Favored Glycine 0 N--CA 1.471 1.003 0 C-N-CA 125.123 1.344 . . . . 0.0 113.841 171.496 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 20.0 m -56.83 -33.15 66.47 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.568 1.147 . . . . 0.0 113.248 178.492 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -73.25 -36.27 66.36 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.075 -1.016 . . . . 0.0 111.802 176.727 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 26.8 tp -68.49 -43.41 76.95 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 123.889 0.876 . . . . 0.0 111.041 173.253 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 50.4 t -60.45 -44.25 95.87 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.984 0 C-N-CA 124.731 1.212 . . . . 0.0 111.253 173.277 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -64.56 -43.88 92.52 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 123.446 0.698 . . . . 0.0 111.537 175.68 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.07 -45.18 94.65 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 123.33 0.652 . . . . 0.0 111.677 176.594 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 18.9 mt -53.66 -51.0 64.56 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.196 0.999 . . . . 0.0 111.118 172.869 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 21.1 m-85 -60.46 -46.52 89.77 Favored 'General case' 0 CA--C 1.542 0.662 0 O-C-N 121.479 -0.763 . . . . 0.0 113.025 177.207 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 84.4 mt -67.72 -40.72 84.22 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 123.672 0.789 . . . . 0.0 112.907 -178.998 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 49.5 t -75.21 -44.56 43.0 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 C-N-CA 123.826 0.85 . . . . 0.0 111.598 -178.599 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 78.3 m -87.53 -23.79 24.27 Favored 'General case' 0 N--CA 1.466 0.348 0 N-CA-C 114.413 1.264 . . . . 0.0 114.413 -171.619 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 52.35 -103.88 0.14 Allowed Glycine 0 CA--C 1.533 1.18 0 C-N-CA 124.428 1.013 . . . . 0.0 114.04 169.43 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -80.1 -16.11 55.7 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 126.181 1.792 . . . . 0.0 114.729 -177.468 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -70.76 -31.05 67.72 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 119.077 0.853 . . . . 0.0 112.385 175.753 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 82.64 142.16 4.26 Favored Glycine 0 CA--C 1.535 1.314 0 C-N-CA 125.027 1.299 . . . . 0.0 112.213 -173.913 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -80.62 173.39 12.65 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 114.197 1.184 . . . . 0.0 114.197 -175.387 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 19.3 t80 -156.37 39.82 0.35 Allowed 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.444 1.097 . . . . 0.0 112.033 -174.388 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 60.3 t80 -54.66 140.56 35.08 Favored 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 113.74 1.015 . . . . 0.0 113.74 -177.861 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 38.6 m -140.02 117.79 8.39 Favored Pre-proline 0 N--CA 1.474 0.765 0 C-N-CA 125.119 1.368 . . . . 0.0 109.651 177.688 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_exo -56.36 -178.71 0.08 OUTLIER 'Trans proline' 0 C--N 1.353 0.8 1 C-N-CA 125.668 4.245 . . . . 0.0 115.427 170.136 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 45.1 mttm . . . . . 0 N--CA 1.474 0.733 0 C-N-CA 125.373 1.469 . . . . 0.0 113.387 -179.038 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.483 1.214 0 N-CA-C 114.875 1.435 . . . . 0.0 114.875 . . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 23.2 t -59.45 -41.58 85.03 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.171 0 CA-C-N 119.879 1.218 . . . . 0.0 110.618 -174.248 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -70.3 -9.2 55.37 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.93 1.692 . . . . 0.0 113.472 -179.569 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 54.8 tt0 -103.54 -62.98 1.23 Allowed 'General case' 0 C--O 1.226 -0.178 0 C-N-CA 124.38 1.072 . . . . 0.0 109.24 169.815 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 86.8 m -55.48 -32.67 63.01 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 114.656 1.354 . . . . 0.0 114.656 -169.547 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 84.1 m -76.0 -20.59 57.72 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 113.889 1.07 . . . . 0.0 113.889 -176.456 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 39.5 p -126.09 -43.49 1.81 Allowed 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 125.564 1.545 . . . . 0.0 112.251 -171.053 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 67.5 m -102.84 176.51 5.13 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 127.136 2.174 . . . . 0.0 110.963 171.527 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 69.1 mt -82.24 145.57 8.44 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 O-C-N 120.619 -1.3 . . . . 0.0 110.077 173.781 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 15.0 p -136.57 -179.9 5.97 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.113 1.365 . . . . 0.0 111.432 170.492 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 93.4 p -138.49 159.86 41.02 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 121.149 -0.969 . . . . 0.0 112.02 -171.798 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 39.7 mt -62.42 -30.94 71.59 Favored 'General case' 0 CA--C 1.541 0.597 0 O-C-N 122.043 -0.411 . . . . 0.0 111.516 174.956 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.3 t80 -63.93 -34.15 77.32 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 123.784 0.833 . . . . 0.0 113.17 172.168 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 36.1 mt-30 -76.82 -26.59 54.54 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 123.639 0.776 . . . . 0.0 111.914 172.888 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 38.0 mt -71.05 -41.67 70.46 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 119.427 1.012 . . . . 0.0 111.901 169.673 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -53.55 -33.1 53.46 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.401 1.08 . . . . 0.0 113.182 175.055 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.0 t-20 -60.08 -22.44 62.73 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 178.075 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 70.1 m-85 -107.91 9.26 28.75 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.718 1.607 . . . . 0.0 114.184 177.357 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 75.9 m -83.39 147.31 27.96 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 121.113 -0.992 . . . . 0.0 111.795 169.545 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 83.4 m-20 . . . . . 0 C--O 1.254 1.3 0 CA-C-O 117.774 -1.107 . . . . 0.0 112.074 173.086 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . 0.277 8.8 p90 . . . . . 0 N--CA 1.496 1.83 0 CA-C-O 117.978 -1.011 . . . . 0.0 108.984 . . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 48.8 t -140.76 91.46 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 C-N-CA 126.33 1.852 . . . . 0.0 106.718 169.523 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 -162.36 152.1 16.15 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.617 1.167 . . . . 0.0 113.088 -167.836 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -174.98 177.68 1.92 Allowed 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 126.646 1.978 . . . . 0.0 110.688 -174.977 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -83.19 145.25 29.28 Favored 'General case' 0 CA--C 1.546 0.794 0 O-C-N 120.983 -1.073 . . . . 0.0 109.692 167.454 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 77.2 mt -147.99 138.43 22.93 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 125.892 1.677 . . . . 0.0 110.106 177.261 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 3.6 t -148.0 155.45 41.53 Favored 'General case' 0 CA--C 1.535 0.401 0 O-C-N 120.977 -1.077 . . . . 0.0 113.117 175.342 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 53.93 -130.6 43.69 Favored Glycine 0 N--CA 1.469 0.894 0 C-N-CA 124.874 1.226 . . . . 0.0 113.402 171.791 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.8 m -52.3 -39.35 60.42 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 124.529 1.132 . . . . 0.0 112.768 178.667 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 12.9 t60 -76.19 -30.67 58.12 Favored 'General case' 0 CA--C 1.541 0.626 0 O-C-N 121.097 -1.002 . . . . 0.0 112.578 -177.209 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 50.2 tp -67.94 -41.2 82.87 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 121.54 -0.725 . . . . 0.0 110.899 169.091 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 53.8 t -63.43 -43.1 98.31 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 C-N-CA 124.267 1.027 . . . . 0.0 111.389 174.64 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 57.0 mt-10 -56.88 -50.33 72.83 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.64 0.776 . . . . 0.0 111.341 170.58 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.63 -43.69 93.72 Favored 'General case' 0 CA--C 1.539 0.546 0 O-C-N 121.693 -0.629 . . . . 0.0 111.715 179.628 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 31.3 mt -59.02 -45.11 91.53 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.656 0.782 . . . . 0.0 111.842 173.682 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 18.4 m-85 -62.01 -42.33 99.04 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-N 119.585 1.084 . . . . 0.0 112.918 174.328 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 8.9 mp -68.41 -40.88 81.12 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 118.673 0.67 . . . . 0.0 112.029 178.472 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 54.7 t -70.7 -45.37 74.19 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 123.78 0.832 . . . . 0.0 111.852 179.46 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 57.2 m -80.38 -27.86 38.08 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 113.632 0.975 . . . . 0.0 113.632 -177.859 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 67.42 -138.94 34.7 Favored Glycine 0 CA--C 1.53 0.992 0 C-N-CA 123.891 0.758 . . . . 0.0 111.711 -176.426 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 2.4 pm0 -69.37 -15.49 63.32 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.786 1.234 . . . . 0.0 113.757 178.104 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 54.6 mtm180 -69.06 -34.36 75.04 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.296 1.039 . . . . 0.0 112.646 179.706 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.09 177.64 36.97 Favored Glycine 0 CA--C 1.533 1.175 0 C-N-CA 124.453 1.025 . . . . 0.0 113.711 -175.415 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 7.3 p90 -117.26 166.44 12.28 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 126.485 1.914 . . . . 0.0 112.922 -176.529 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 47.0 p90 -128.7 8.99 5.87 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.276 1.43 . . . . 0.0 113.731 175.145 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 5.2 p90 -55.13 147.43 16.15 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 115.167 1.543 . . . . 0.0 115.167 -171.951 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 23.6 p -89.25 134.75 32.37 Favored Pre-proline 0 N--CA 1.47 0.529 0 C-N-CA 124.596 1.158 . . . . 0.0 110.041 170.015 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -80.06 177.54 8.18 Favored 'Trans proline' 0 CA--C 1.538 0.712 0 C-N-CA 123.145 2.564 . . . . 0.0 111.397 176.859 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 40.6 ttpt . . . . . 0 N--CA 1.474 0.736 0 C-N-CA 123.751 0.82 . . . . 0.0 113.06 177.156 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 10.2 tt . . . . . 0 N--CA 1.479 0.997 0 N-CA-C 112.902 0.705 . . . . 0.0 112.902 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 87.4 t -65.83 -46.19 89.43 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 CA-C-N 119.418 1.008 . . . . 0.0 112.151 -169.244 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -73.69 -29.59 62.38 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 119.235 0.925 . . . . 0.0 112.084 174.474 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 -67.95 -35.77 78.95 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.586 1.155 . . . . 0.0 112.219 179.398 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 14.8 m -97.48 -25.57 15.13 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 114.992 1.479 . . . . 0.0 114.992 176.842 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 27.8 t -95.06 -59.18 1.96 Allowed 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 120.014 1.279 . . . . 0.0 112.157 -176.305 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 20.9 m -71.26 -50.48 32.34 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.39 1.076 . . . . 0.0 109.847 179.265 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 75.2 m -91.22 171.16 9.43 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 124.203 1.001 . . . . 0.0 111.129 168.623 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 12.3 tt -91.87 147.38 5.34 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 124.124 0.97 . . . . 0.0 110.893 175.411 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 18.9 p -135.71 150.98 49.72 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 113.568 0.951 . . . . 0.0 113.568 177.325 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 13.2 t -106.53 164.14 12.31 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 125.262 1.425 . . . . 0.0 111.206 176.092 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 78.0 mt -59.39 -25.88 64.65 Favored 'General case' 0 CA--C 1.541 0.617 0 O-C-N 121.355 -0.841 . . . . 0.0 113.037 -177.755 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.8 t80 -60.01 -32.53 70.96 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 123.832 0.853 . . . . 0.0 113.224 170.397 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -81.08 -30.51 34.7 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.452 1.101 . . . . 0.0 110.927 176.181 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -64.89 -44.49 89.44 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 119.546 1.066 . . . . 0.0 110.626 169.238 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -59.84 -28.59 67.63 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 124.449 1.1 . . . . 0.0 113.822 176.421 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 22.4 t30 -59.36 -28.24 66.68 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 123.764 0.825 . . . . 0.0 113.095 177.446 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 97.6 m-85 -99.99 2.2 43.27 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.848 1.259 . . . . 0.0 113.899 -179.292 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 64.8 m -72.28 170.08 14.88 Favored 'General case' 0 CA--C 1.549 0.907 0 O-C-N 120.959 -1.088 . . . . 0.0 111.951 169.642 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.253 1.261 0 C-N-CA 125.374 1.469 . . . . 0.0 112.678 176.402 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 64.2 m-85 . . . . . 0 N--CA 1.488 1.469 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 8.0 t -85.92 57.48 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.369 0 CA-C-N 120.228 1.376 . . . . 0.0 109.223 174.456 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -97.32 130.36 44.5 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.535 1.534 . . . . 0.0 113.027 -170.749 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 41.1 mt-30 -148.01 163.77 35.85 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.872 1.669 . . . . 0.0 111.124 -174.903 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 57.5 m-70 -94.44 129.55 41.14 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 167.439 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 69.8 mt -137.06 135.1 37.21 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 126.184 1.794 . . . . 0.0 109.03 -176.36 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 1.4 t -143.02 142.95 31.72 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.256 0.622 . . . . 0.0 111.87 -171.918 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 51.17 -121.6 12.12 Favored Glycine 0 CA--C 1.53 0.973 0 C-N-CA 124.567 1.08 . . . . 0.0 113.957 170.439 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 16.3 t -55.51 -39.82 70.98 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.13 0.972 . . . . 0.0 112.701 178.199 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 72.6 m-70 -73.56 -27.93 61.59 Favored 'General case' 0 CA--C 1.542 0.661 0 O-C-N 120.455 -1.403 . . . . 0.0 113.348 178.013 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 41.8 tp -72.86 -41.79 64.39 Favored 'General case' 0 N--CA 1.467 0.415 0 O-C-N 121.437 -0.789 . . . . 0.0 111.654 170.836 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 24.9 t -60.67 -43.31 94.66 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.851 0 C-N-CA 124.495 1.118 . . . . 0.0 111.0 172.084 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -60.34 -46.8 88.65 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.312 1.445 . . . . 0.0 111.68 173.011 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.15 -40.99 95.91 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 121.461 -0.774 . . . . 0.0 112.23 175.907 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 59.6 mt -63.14 -42.18 99.42 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 118.915 0.779 . . . . 0.0 111.846 174.51 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 21.7 m-85 -61.58 -40.04 93.34 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 119.269 0.94 . . . . 0.0 112.521 172.309 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 79.0 mt -69.46 -44.51 71.07 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 123.824 0.849 . . . . 0.0 112.28 177.997 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 79.3 t -74.66 -44.46 46.56 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 C-N-CA 123.921 0.888 . . . . 0.0 112.095 -177.63 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 40.5 m -87.55 -26.61 23.05 Favored 'General case' 0 N--CA 1.474 0.772 0 N-CA-C 113.599 0.963 . . . . 0.0 113.599 -176.159 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 73.48 -153.09 47.29 Favored Glycine 0 CA--C 1.531 1.069 0 C-N-CA 125.188 1.375 . . . . 0.0 112.998 -179.698 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -59.14 -22.12 60.4 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.372 1.469 . . . . 0.0 113.867 -176.741 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.97 -26.98 68.82 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.759 1.223 . . . . 0.0 113.087 178.009 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 79.09 -172.62 55.27 Favored Glycine 0 CA--C 1.53 0.969 0 C-N-CA 124.543 1.068 . . . . 0.0 113.657 -176.098 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 40.4 p90 -148.92 161.02 42.7 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.011 1.324 . . . . 0.0 113.658 -169.321 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 57.3 m-85 -88.48 149.19 23.78 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 125.35 1.46 . . . . 0.0 109.364 167.89 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 48.4 t80 -138.5 130.36 28.08 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 121.455 -0.778 . . . . 0.0 112.864 -176.097 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 78.5 m -141.13 108.18 6.27 Favored Pre-proline 0 N--CA 1.472 0.666 0 C-N-CA 124.688 1.195 . . . . 0.0 110.267 -179.348 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_endo -80.88 168.65 17.25 Favored 'Trans proline' 0 N--CA 1.455 -0.756 0 C-N-CA 123.528 2.819 . . . . 0.0 110.908 169.487 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 39.7 ttpt . . . . . 0 CA--C 1.546 0.807 0 C-N-CA 123.351 0.66 . . . . 0.0 112.291 172.009 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . 0.528 ' N ' ' HH ' ' B' ' 26' ' ' TYR . 9.8 tt . . . . . 0 N--CA 1.484 1.251 0 N-CA-C 114.332 1.234 . . . . 0.0 114.332 . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 9.0 p -58.9 -35.67 57.63 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 O-C-N 121.106 -0.996 . . . . 0.0 113.636 -169.809 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 55.1 mt-10 -73.13 -10.46 59.8 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 119.178 0.899 . . . . 0.0 113.325 175.864 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 -93.26 -60.34 1.81 Allowed 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 108.565 -0.902 . . . . 0.0 108.565 169.053 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 56.1 m -62.83 -29.97 71.13 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 115.304 1.594 . . . . 0.0 115.304 -173.461 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 13.9 t -89.7 -29.0 19.05 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.581 0.752 . . . . 0.0 112.802 -175.847 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 28.1 m -97.07 -39.09 9.49 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 125.835 1.654 . . . . 0.0 111.502 -176.171 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 70.2 m -124.96 -173.21 2.75 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.247 1.819 . . . . 0.0 110.017 176.062 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 11.6 tt -88.41 143.47 11.15 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 O-C-N 120.336 -1.478 . . . . 0.0 110.577 176.281 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 18.9 p -130.92 166.08 21.69 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.438 1.095 . . . . 0.0 111.754 175.677 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 44.9 p -108.08 159.98 16.15 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 113.718 1.007 . . . . 0.0 113.718 -174.199 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 77.0 mt -64.53 -30.83 71.86 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 121.332 -0.855 . . . . 0.0 111.433 172.369 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 87.6 t80 -65.63 -34.67 78.76 Favored 'General case' 0 CA--C 1.542 0.645 0 O-C-N 121.481 -0.762 . . . . 0.0 112.816 174.153 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -71.46 -26.53 62.75 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 123.6 0.76 . . . . 0.0 112.07 172.837 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 98.5 mt -74.49 -41.82 60.05 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 119.143 0.883 . . . . 0.0 112.01 169.769 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -55.97 -29.07 59.66 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 124.21 1.004 . . . . 0.0 113.237 176.735 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 17.8 t30 -52.88 -32.04 42.92 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.729 1.211 . . . . 0.0 113.511 174.376 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 87.4 m-85 -97.69 2.03 49.26 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 125.398 1.479 . . . . 0.0 114.695 -175.766 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 73.0 m -78.43 150.83 32.99 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.005 0.922 . . . . 0.0 113.239 178.575 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 . . . . . 0 C--O 1.25 1.101 0 C-N-CA 124.31 1.044 . . . . 0.0 112.243 170.535 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 52.8 p90 . . . . . 0 N--CA 1.485 1.288 0 CA-C-O 118.832 -0.604 . . . . 0.0 110.721 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . 0.3 24.0 m 58.59 -37.3 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 C-N-CA 130.39 3.476 . . . . 0.0 116.44 -173.809 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 17.6 m120 -126.95 138.53 53.29 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 127.329 2.251 . . . . 0.0 109.209 169.011 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 33.0 tp60 -158.95 160.43 36.02 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 123.51 0.724 . . . . 0.0 111.483 -169.365 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 95.9 m-70 -98.13 133.03 43.14 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 123.881 0.872 . . . . 0.0 109.017 167.724 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 88.5 mt -146.57 141.88 27.42 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 124.986 1.314 . . . . 0.0 110.383 -171.799 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 2.0 t -153.25 146.26 24.55 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.157 0.583 . . . . 0.0 111.823 -177.247 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 52.3 -126.47 30.93 Favored Glycine 0 N--CA 1.475 1.263 0 C-N-CA 124.766 1.174 . . . . 0.0 114.086 171.952 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 31.4 p -58.97 -33.87 71.15 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.628 1.171 . . . . 0.0 113.142 178.301 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 22.4 t-160 -71.55 -37.22 71.13 Favored 'General case' 0 CA--C 1.544 0.731 0 O-C-N 121.036 -1.04 . . . . 0.0 111.57 176.497 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 64.0 tp -65.15 -44.99 86.8 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 123.587 0.755 . . . . 0.0 111.525 171.689 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 40.4 t -60.82 -43.85 96.32 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 C-N-CA 124.286 1.034 . . . . 0.0 111.177 175.414 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -64.42 -42.75 95.88 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 123.59 0.756 . . . . 0.0 111.725 175.628 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.37 -41.61 98.76 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 121.677 -0.639 . . . . 0.0 111.885 175.782 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 36.6 mt -58.78 -47.84 83.34 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 118.46 0.573 . . . . 0.0 110.852 172.906 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 26.2 m-85 -59.47 -41.54 89.98 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 119.679 1.127 . . . . 0.0 112.876 175.252 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 77.6 mt -67.0 -41.32 86.94 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.998 0.919 . . . . 0.0 112.424 177.511 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 44.3 t -69.86 -42.37 79.88 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 C-N-CA 124.239 1.016 . . . . 0.0 111.798 178.62 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 61.4 m -81.6 -32.0 32.23 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 113.837 1.051 . . . . 0.0 113.837 -176.003 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 82.04 -148.21 26.84 Favored Glycine 0 CA--C 1.53 1.01 0 C-N-CA 124.616 1.103 . . . . 0.0 112.686 -177.832 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 3.8 pm0 -62.88 -23.43 67.33 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 126.292 1.837 . . . . 0.0 115.494 -169.032 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 18.1 mtm-85 -83.7 -20.18 33.96 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 124.663 1.185 . . . . 0.0 113.221 -177.951 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.9 -161.63 54.3 Favored Glycine 0 CA--C 1.532 1.155 0 C-N-CA 124.611 1.101 . . . . 0.0 113.38 -174.96 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 9.9 p90 -125.73 164.83 19.8 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 126.252 1.821 . . . . 0.0 112.993 -172.947 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 43.0 p90 -101.58 3.71 40.26 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 124.793 1.237 . . . . 0.0 112.394 168.301 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 26' ' ' TYR . . . . . 0.528 ' HH ' ' N ' ' A' ' 2' ' ' ILE . 79.8 t80 -48.86 141.91 6.99 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 126.623 1.969 . . . . 0.0 115.438 -177.166 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 24.1 p -136.77 137.2 22.86 Favored Pre-proline 0 N--CA 1.472 0.659 0 C-N-CA 126.084 1.753 . . . . 0.0 109.247 168.322 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -77.06 162.47 31.77 Favored 'Trans proline' 0 N--CA 1.459 -0.531 0 C-N-CA 123.358 2.705 . . . . 0.0 110.915 173.989 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 52.3 mtpt . . . . . 0 CA--C 1.547 0.858 0 N-CA-C 114.057 1.132 . . . . 0.0 114.057 -177.779 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 10.0 tp . . . . . 0 N--CA 1.478 0.96 0 N-CA-C 113.265 0.839 . . . . 0.0 113.265 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 10.6 p -69.53 -38.76 77.46 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 C-N-CA 123.534 0.734 . . . . 0.0 112.503 -171.185 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 21.3 pm0 -72.51 -2.51 19.95 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 123.964 0.906 . . . . 0.0 113.333 174.855 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -105.17 -57.46 2.03 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.77 1.228 . . . . 0.0 110.417 172.23 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 21.4 m -68.22 -28.33 67.15 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 114.58 1.326 . . . . 0.0 114.58 -175.462 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 73.5 m -73.62 -47.15 42.43 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-N 119.644 1.111 . . . . 0.0 111.078 170.941 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 27.4 m -71.3 -37.17 71.84 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 126.538 1.935 . . . . 0.0 112.291 -170.737 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 48.2 m -137.2 167.7 21.05 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 125.326 1.45 . . . . 0.0 111.572 -176.313 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 39.2 mt -63.31 132.88 29.29 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 O-C-N 121.289 -0.882 . . . . 0.0 109.958 170.774 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 7.1 p -135.12 156.63 48.67 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.179 0.992 . . . . 0.0 112.635 176.254 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 34.2 t -108.79 160.83 15.66 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 126.138 1.775 . . . . 0.0 111.558 -175.229 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 23.7 mt -57.46 -28.01 62.98 Favored 'General case' 0 N--CA 1.469 0.504 0 O-C-N 121.62 -0.675 . . . . 0.0 111.838 173.17 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 85.9 t80 -61.85 -31.16 71.4 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 124.237 1.015 . . . . 0.0 113.665 173.06 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 34.5 mt-30 -79.16 -32.0 44.17 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.725 0.81 . . . . 0.0 111.015 174.381 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 55.0 mt -67.58 -41.14 84.62 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.36 0.664 . . . . 0.0 112.255 171.578 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -55.31 -33.15 63.06 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 124.866 1.266 . . . . 0.0 113.099 175.184 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 17.3 t30 -61.27 -26.5 67.81 Favored 'General case' 0 CA--C 1.547 0.839 0 N-CA-C 113.141 0.793 . . . . 0.0 113.141 176.811 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 49.2 m-85 -99.6 -1.77 37.31 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.409 1.484 . . . . 0.0 114.168 -179.293 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 73.5 m -67.26 151.03 48.23 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 120.867 -1.146 . . . . 0.0 112.957 173.202 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 90.0 m-20 . . . . . 0 C--O 1.252 1.208 0 C-N-CA 124.376 1.07 . . . . 0.0 111.95 169.754 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 43.8 p90 . . . . . 0 N--CA 1.487 1.378 0 CA-C-O 119.11 -0.471 . . . . 0.0 110.7 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 15.4 m -77.78 63.94 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.444 0 C-N-CA 125.513 1.525 . . . . 0.0 112.914 -173.17 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 38.8 t30 -157.87 109.7 2.31 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.917 1.687 . . . . 0.0 109.654 -175.35 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 2.6 mm-40 -168.09 175.65 6.51 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 125.291 1.436 . . . . 0.0 110.713 -169.626 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 49.0 m-70 -68.22 134.73 50.91 Favored 'General case' 0 CA--C 1.544 0.728 0 O-C-N 120.7 -1.25 . . . . 0.0 109.485 168.017 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 76.4 mt -135.31 126.89 28.87 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 125.631 1.572 . . . . 0.0 109.119 176.083 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.7 t -143.76 150.16 38.19 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 113.093 0.775 . . . . 0.0 113.093 -174.041 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 54.98 -128.27 43.14 Favored Glycine 0 N--CA 1.469 0.86 0 C-N-CA 124.68 1.133 . . . . 0.0 113.059 173.755 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 15.8 m -54.78 -36.17 64.61 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.518 1.127 . . . . 0.0 113.282 177.832 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 73.9 m-70 -76.76 -29.21 56.02 Favored 'General case' 0 CA--C 1.539 0.526 0 O-C-N 120.895 -1.128 . . . . 0.0 113.036 178.061 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 56.3 tp -69.54 -44.75 70.3 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 118.888 0.767 . . . . 0.0 110.689 169.908 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 25.3 t -60.22 -43.72 93.93 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.981 0 C-N-CA 124.904 1.282 . . . . 0.0 111.017 175.027 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -59.45 -50.44 73.92 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 125.142 1.377 . . . . 0.0 111.45 172.317 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.59 -40.75 97.91 Favored 'General case' 0 CA--C 1.537 0.466 0 O-C-N 121.397 -0.815 . . . . 0.0 111.978 179.683 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 40.0 mt -61.27 -42.66 99.02 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 123.661 0.784 . . . . 0.0 111.683 173.771 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 19.3 m-85 -61.97 -42.0 98.63 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-N 119.885 1.221 . . . . 0.0 112.678 172.702 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 9.0 mp -68.3 -42.39 79.5 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 118.613 0.642 . . . . 0.0 112.145 178.676 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 54.5 t -71.19 -45.31 71.7 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 C-N-CA 123.622 0.769 . . . . 0.0 111.809 -179.806 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 43.9 m -89.33 -20.01 24.57 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 114.027 1.121 . . . . 0.0 114.027 -173.023 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 66.91 -149.52 51.35 Favored Glycine 0 CA--C 1.532 1.132 0 C-N-CA 124.544 1.068 . . . . 0.0 113.078 177.956 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -61.26 -23.3 65.56 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 125.248 1.419 . . . . 0.0 113.531 -177.062 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 78.2 mtp85 -64.14 -29.44 70.56 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.34 1.056 . . . . 0.0 112.921 177.441 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.42 -169.69 54.64 Favored Glycine 0 CA--C 1.531 1.093 0 C-N-CA 124.464 1.031 . . . . 0.0 113.14 -175.238 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 54.9 p90 -147.07 157.71 43.7 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.503 1.121 . . . . 0.0 113.684 -171.164 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 60.1 t80 -88.77 147.36 24.49 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.89 1.676 . . . . 0.0 109.869 169.192 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 65.1 t80 -151.02 139.92 20.92 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.816 0.846 . . . . 0.0 111.997 -175.975 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 15.4 t -168.12 141.51 2.65 Favored Pre-proline 0 N--CA 1.472 0.65 0 C-N-CA 126.421 1.889 . . . . 0.0 109.681 -178.318 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -87.8 -163.69 0.17 Allowed 'Trans proline' 0 CA--C 1.54 0.819 0 C-N-CA 124.15 3.234 . . . . 0.0 111.821 178.099 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 39.8 ttmt . . . . . 0 CA--C 1.544 0.734 0 C-N-CA 124.861 1.264 . . . . 0.0 113.924 -175.407 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . 0.495 ' N ' ' HG1' ' B' ' 27' ' ' THR . 12.4 tt . . . . . 0 N--CA 1.482 1.174 0 N-CA-C 113.687 0.995 . . . . 0.0 113.687 . . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 5.4 p -63.11 -27.92 44.08 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 O-C-N 121.518 -0.738 . . . . 0.0 112.92 178.901 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -72.14 -11.97 60.98 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 123.633 0.773 . . . . 0.0 112.833 176.27 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 22.6 tt0 -95.16 -66.49 0.91 Allowed 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 123.855 0.862 . . . . 0.0 109.144 169.165 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 57.0 m -68.94 -26.73 65.22 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 115.797 1.777 . . . . 0.0 115.797 -168.803 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 15.4 t -84.14 -43.26 15.18 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 119.631 1.105 . . . . 0.0 111.179 176.696 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 24.2 m -69.4 -32.33 71.27 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 126.116 1.766 . . . . 0.0 112.609 -179.245 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 91.8 p -147.26 169.12 20.07 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.946 1.298 . . . . 0.0 112.498 -174.967 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 38.7 mt -64.73 134.14 29.58 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.864 0 O-C-N 120.935 -1.103 . . . . 0.0 110.52 174.144 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 9.7 p -133.34 177.37 7.74 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 125.079 1.351 . . . . 0.0 111.195 169.907 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.4 t -139.69 167.33 22.35 Favored 'General case' 0 N--CA 1.466 0.366 0 O-C-N 120.927 -1.108 . . . . 0.0 112.786 179.433 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 46.8 mt -62.59 -30.11 71.09 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.445 1.098 . . . . 0.0 112.71 -169.658 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 83.3 t80 -63.61 -28.14 69.72 Favored 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 172.918 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 60.9 mt-30 -82.83 -23.18 33.86 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 123.84 0.856 . . . . 0.0 111.674 175.804 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 47.7 mt -67.83 -43.57 79.27 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 118.905 0.775 . . . . 0.0 110.742 171.661 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -56.13 -24.99 44.36 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 113.894 1.072 . . . . 0.0 113.894 175.707 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 29.4 t30 -60.47 -27.83 67.86 Favored 'General case' 0 CA--C 1.548 0.871 0 CA-C-N 119.628 1.104 . . . . 0.0 113.072 175.242 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.406 ' CD1' HD12 ' A' ' 2' ' ' ILE . 89.1 m-85 -96.71 2.33 51.92 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.505 1.522 . . . . 0.0 112.874 177.865 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 70.4 m -98.55 161.03 13.89 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.973 1.309 . . . . 0.0 112.535 177.357 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 75.7 m-20 . . . . . 0 C--O 1.25 1.126 0 C-N-CA 123.629 0.772 . . . . 0.0 112.355 175.911 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 55.0 t80 . . . . . 0 N--CA 1.491 1.609 0 N-CA-C 110.077 -0.342 . . . . 0.0 110.077 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 15.4 m -64.27 144.61 14.55 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 O-C-N 121.05 -1.031 . . . . 0.0 111.864 176.303 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 5.3 t30 54.49 60.29 3.64 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 125.517 1.527 . . . . 0.0 113.268 174.419 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 29.8 mm-40 -145.69 171.05 15.3 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 125.853 1.661 . . . . 0.0 111.601 -178.852 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 25.3 m-70 -81.02 143.19 32.68 Favored 'General case' 0 CA--C 1.545 0.776 0 O-C-N 120.956 -1.09 . . . . 0.0 109.607 167.356 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 67.0 mt -140.73 130.45 24.26 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 126.123 1.769 . . . . 0.0 109.148 175.26 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.6 t -135.68 144.31 45.9 Favored 'General case' 0 N--CA 1.472 0.645 0 O-C-N 121.53 -0.731 . . . . 0.0 112.784 -174.826 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 49.78 -123.33 13.11 Favored Glycine 0 N--CA 1.471 1.0 0 C-N-CA 125.287 1.423 . . . . 0.0 114.043 170.955 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 20.2 m -55.12 -38.25 67.94 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.322 1.049 . . . . 0.0 112.55 177.92 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 1.4 t-80 -70.04 -34.2 72.94 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 120.881 -1.137 . . . . 0.0 111.748 179.023 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 43.2 tp -69.99 -41.43 74.4 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 123.889 0.876 . . . . 0.0 111.507 173.653 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 55.0 t -62.15 -42.69 96.08 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 124.755 1.222 . . . . 0.0 110.91 173.313 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -64.39 -41.22 96.78 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.596 0.759 . . . . 0.0 112.233 173.071 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.1 -42.84 99.62 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 119.661 1.119 . . . . 0.0 111.792 174.977 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 26.2 mt -59.36 -44.75 92.67 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 123.362 0.665 . . . . 0.0 111.893 173.166 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 6.1 m-85 -57.76 -48.32 79.99 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.605 0.762 . . . . 0.0 112.208 172.999 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 7.9 mp -67.87 -41.27 83.11 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 123.704 0.801 . . . . 0.0 112.321 -178.077 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 61.5 t -74.33 -46.77 42.95 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.693 0 CA-C-N 118.188 0.449 . . . . 0.0 111.774 -177.061 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 86.3 m -99.96 -25.95 14.15 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 114.178 1.177 . . . . 0.0 114.178 -169.931 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 55.05 -121.64 22.79 Favored Glycine 0 CA--C 1.531 1.051 0 C-N-CA 124.386 0.993 . . . . 0.0 113.477 169.85 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -62.18 -22.9 66.28 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.721 1.608 . . . . 0.0 113.365 -177.073 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 24.6 mmm180 -62.31 -37.34 85.2 Favored 'General case' 0 N--CA 1.472 0.674 0 O-C-N 121.438 -0.788 . . . . 0.0 112.255 175.848 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.2 164.91 9.04 Favored Glycine 0 CA--C 1.535 1.296 0 C-N-CA 124.462 1.029 . . . . 0.0 112.911 -171.105 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 54.7 p90 -146.99 155.09 41.98 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.467 1.107 . . . . 0.0 113.689 -172.483 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 53.7 t80 -105.38 84.17 2.06 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.659 1.584 . . . . 0.0 109.672 175.197 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 66.5 t80 -68.12 140.18 56.19 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.675 -0.641 . . . . 0.0 111.11 172.632 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 27' ' ' THR . . . . . 0.495 ' HG1' ' N ' ' A' ' 2' ' ' ILE . 15.7 p -133.29 119.22 15.31 Favored Pre-proline 0 CA--C 1.539 0.543 0 C-N-CA 125.132 1.373 . . . . 0.0 110.647 179.583 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -77.58 -179.13 5.14 Favored 'Trans proline' 0 CA--C 1.538 0.7 0 C-N-CA 123.287 2.658 . . . . 0.0 111.023 173.944 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 28.9 ttpp . . . . . 0 CA--C 1.548 0.882 0 C-N-CA 124.258 1.023 . . . . 0.0 112.804 170.725 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 7.8 tp . . . . . 0 N--CA 1.48 1.069 0 N-CA-C 113.039 0.755 . . . . 0.0 113.039 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 10.0 p -66.85 -34.9 72.99 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.19 0 CA-C-N 119.873 1.215 . . . . 0.0 111.297 179.962 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -69.38 -11.46 60.84 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.941 1.296 . . . . 0.0 113.535 172.103 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 27.2 tt0 -91.07 -61.18 1.72 Allowed 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 123.681 0.792 . . . . 0.0 108.973 168.751 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 59.9 m -66.31 -21.5 66.27 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 114.647 1.351 . . . . 0.0 114.647 -169.961 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 7.6 t -86.87 -19.1 29.41 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 124.592 1.157 . . . . 0.0 113.008 176.232 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 34.4 m -104.11 -45.96 4.58 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 125.996 1.719 . . . . 0.0 111.28 -174.816 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 66.9 m -120.89 178.1 4.85 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 127.26 2.224 . . . . 0.0 110.11 177.087 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 10.7 tt -84.28 137.13 21.41 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 O-C-N 120.679 -1.263 . . . . 0.0 110.708 178.178 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.8 m -106.75 172.5 6.78 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 125.249 1.419 . . . . 0.0 111.586 176.989 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 34.6 t -122.13 149.17 43.96 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 125.32 1.448 . . . . 0.0 112.08 176.98 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 82.6 mt -60.08 -29.12 68.36 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 121.422 -0.799 . . . . 0.0 111.747 171.076 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 79.1 t80 -63.98 -28.15 69.61 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 113.272 0.842 . . . . 0.0 113.272 173.776 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 90.3 mt-30 -76.26 -37.68 57.27 Favored 'General case' 0 CA--C 1.534 0.328 0 O-C-N 121.621 -0.675 . . . . 0.0 110.466 172.689 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 31.7 mt -64.09 -40.33 96.0 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 118.668 0.667 . . . . 0.0 112.13 175.181 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -54.92 -34.26 62.97 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.297 1.039 . . . . 0.0 113.309 171.631 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 -69.03 -21.43 64.12 Favored 'General case' 0 CA--C 1.549 0.912 0 O-C-N 121.309 -0.869 . . . . 0.0 113.158 179.005 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 75.0 m-85 -96.45 -0.96 48.38 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.186 1.394 . . . . 0.0 114.009 175.758 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 72.7 m -71.31 150.32 45.25 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 119.237 0.926 . . . . 0.0 112.88 173.565 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 . . . . . 0 C--O 1.255 1.383 0 C-N-CA 125.259 1.424 . . . . 0.0 112.762 176.243 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 46.2 t80 . . . . . 0 N--CA 1.486 1.365 0 CA-C-O 119.752 -0.166 . . . . 0.0 111.398 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 21.0 t 74.98 -57.29 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.325 0 C-N-CA 128.321 2.648 . . . . 0.0 111.114 -175.996 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 25.1 m120 -111.99 134.99 53.2 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.729 1.212 . . . . 0.0 112.326 177.864 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -151.63 155.52 38.56 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 125.28 1.432 . . . . 0.0 111.646 -175.569 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 95.4 m-70 -93.15 133.37 36.4 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 108.004 -1.109 . . . . 0.0 108.004 166.148 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 84.0 mt -143.52 134.71 25.78 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 124.687 1.195 . . . . 0.0 110.538 -170.972 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.6 t -149.49 132.41 16.13 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 123.399 0.68 . . . . 0.0 111.883 -175.107 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 58.65 -124.41 36.46 Favored Glycine 0 N--CA 1.472 1.047 0 C-N-CA 124.356 0.979 . . . . 0.0 112.861 177.295 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.8 m -52.02 -37.77 54.54 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.789 1.236 . . . . 0.0 112.827 177.454 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 40.8 m80 -66.21 -40.18 90.16 Favored 'General case' 0 CA--C 1.543 0.684 0 O-C-N 121.084 -1.01 . . . . 0.0 111.582 -179.143 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 53.3 tp -66.86 -41.62 87.01 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.056 0.942 . . . . 0.0 111.171 174.636 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 40.1 t -62.63 -43.06 98.21 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 C-N-CA 124.337 1.055 . . . . 0.0 111.457 175.313 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -61.05 -49.33 77.81 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.565 0.746 . . . . 0.0 111.259 173.797 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.99 -42.15 98.83 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 123.493 0.717 . . . . 0.0 111.501 -179.397 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 29.9 mt -57.37 -52.11 66.7 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 118.613 -0.708 . . . . 0.0 111.339 173.561 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -66.87 -31.83 72.7 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 120.118 1.326 . . . . 0.0 112.484 -178.627 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 79.5 mt -69.64 -39.09 77.33 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 123.903 0.881 . . . . 0.0 112.475 174.82 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 42.4 t -70.73 -44.6 76.24 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 C-N-CA 123.904 0.882 . . . . 0.0 111.954 175.285 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 59.2 m -80.52 -26.45 38.11 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 113.575 0.954 . . . . 0.0 113.575 -174.399 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 71.1 -147.81 43.42 Favored Glycine 0 CA--C 1.532 1.097 0 C-N-CA 124.437 1.018 . . . . 0.0 111.535 -173.256 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -63.24 -14.99 55.62 Favored 'General case' 0 CA--C 1.544 0.732 0 N-CA-C 114.451 1.278 . . . . 0.0 114.451 -178.559 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 59.1 mtm180 -65.36 -35.59 81.43 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.891 1.277 . . . . 0.0 112.742 177.092 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.04 -178.69 51.0 Favored Glycine 0 CA--C 1.533 1.202 0 C-N-CA 124.234 0.921 . . . . 0.0 113.611 -172.852 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 45.7 p90 -124.99 165.86 17.38 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.791 1.636 . . . . 0.0 112.709 -175.056 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 34.6 t80 -142.19 41.99 1.65 Allowed 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 126.669 1.987 . . . . 0.0 110.081 -179.281 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -64.59 156.08 31.12 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 124.685 1.194 . . . . 0.0 114.161 -177.79 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 22.9 p -122.68 67.22 29.39 Favored Pre-proline 0 N--CA 1.48 1.062 0 C-N-CA 125.041 1.336 . . . . 0.0 112.807 -170.618 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -72.76 157.23 52.29 Favored 'Trans proline' 0 C--N 1.348 0.509 0 C-N-CA 123.103 2.536 . . . . 0.0 111.672 176.237 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 94.1 mttt . . . . . 0 N--CA 1.476 0.835 0 C-N-CA 129.114 2.965 . . . . 0.0 112.455 172.075 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 17.2 tt . . . . . 0 N--CA 1.483 1.221 0 N-CA-C 115.972 1.841 . . . . 0.0 115.972 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 3.7 p -58.88 -29.54 40.86 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 CA-C-N 120.413 1.46 . . . . 0.0 112.17 173.399 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -73.04 -10.4 59.76 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.567 1.147 . . . . 0.0 112.693 177.033 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -99.74 -58.92 1.81 Allowed 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 124.387 1.075 . . . . 0.0 109.115 168.831 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 90.8 m -62.46 -29.85 70.82 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 115.085 1.513 . . . . 0.0 115.085 -172.74 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 8.1 t -87.93 -27.52 22.08 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 123.829 0.851 . . . . 0.0 112.562 179.188 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 23.1 m -90.47 -34.51 15.56 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 126.251 1.821 . . . . 0.0 111.992 -175.418 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.7 t -145.65 -163.68 1.78 Allowed 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 126.356 1.862 . . . . 0.0 110.18 178.654 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 17.8 mm -80.35 146.1 8.11 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 C-N-CA 124.927 1.291 . . . . 0.0 110.713 173.598 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 18.1 p -135.1 170.43 15.91 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.31 1.444 . . . . 0.0 111.886 169.433 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 74.7 m -124.89 153.43 42.64 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.184 1.394 . . . . 0.0 112.627 -170.05 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 43.1 mt -60.36 -31.65 70.53 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 113.619 0.97 . . . . 0.0 113.619 -173.87 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 91.9 t80 -62.43 -31.63 72.36 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 123.886 0.874 . . . . 0.0 113.243 172.909 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 68.5 mt-30 -75.44 -34.94 61.02 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.754 0.822 . . . . 0.0 110.53 176.014 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 57.9 mt -64.05 -48.17 77.32 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 123.334 0.654 . . . . 0.0 110.938 173.344 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -56.35 -28.87 60.42 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.802 1.241 . . . . 0.0 113.715 176.06 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 27.7 t30 -58.25 -26.97 63.55 Favored 'General case' 0 CA--C 1.546 0.823 0 O-C-N 120.931 -1.105 . . . . 0.0 113.523 178.3 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -97.86 -2.81 39.99 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.284 1.434 . . . . 0.0 113.606 179.614 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 80.3 m -82.83 161.3 22.0 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.456 1.103 . . . . 0.0 113.022 177.698 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 16.5 t-20 . . . . . 0 C--O 1.253 1.257 0 C-N-CA 124.911 1.284 . . . . 0.0 113.453 -175.727 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 36.9 p90 . . . . . 0 N--CA 1.487 1.402 0 N-CA-C 111.914 0.338 . . . . 0.0 111.914 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 49.0 t 71.69 -58.68 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.342 0 C-N-CA 128.463 2.705 . . . . 0.0 113.871 171.431 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 34.6 m120 -78.48 125.46 29.39 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.388 1.475 . . . . 0.0 111.911 -174.71 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -150.79 159.94 44.2 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.281 1.032 . . . . 0.0 112.165 -179.352 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 86.2 m-70 -97.71 136.31 38.25 Favored 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 107.066 -1.457 . . . . 0.0 107.066 165.365 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 87.0 mt -147.2 137.2 23.17 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.505 1.122 . . . . 0.0 110.814 -177.16 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.8 t -152.38 138.76 18.51 Favored 'General case' 0 N--CA 1.47 0.559 0 O-C-N 121.318 -0.864 . . . . 0.0 113.024 -177.901 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 58.32 -128.16 46.91 Favored Glycine 0 N--CA 1.47 0.965 0 C-N-CA 124.35 0.976 . . . . 0.0 113.334 174.303 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.7 m -55.25 -32.54 62.41 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.528 1.131 . . . . 0.0 113.046 176.993 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 25.0 m80 -69.85 -41.41 74.93 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 121.16 -0.962 . . . . 0.0 111.325 177.328 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 64.1 tp -64.89 -45.92 83.91 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.132 0.973 . . . . 0.0 110.782 173.763 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 38.6 t -57.55 -46.31 86.13 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.928 0 C-N-CA 124.717 1.207 . . . . 0.0 111.229 175.494 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -64.84 -42.99 94.48 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.429 0.691 . . . . 0.0 111.811 176.0 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.22 -41.62 98.56 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 121.574 -0.704 . . . . 0.0 112.21 176.766 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -56.66 -46.79 80.86 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.533 0.733 . . . . 0.0 110.963 173.51 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 31.6 m-85 -65.37 -36.51 84.22 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 113.453 0.909 . . . . 0.0 113.453 175.534 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 77.9 mt -71.31 -42.34 68.74 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 118.98 0.809 . . . . 0.0 112.684 177.4 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 54.8 t -72.07 -47.82 52.73 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.726 0 C-N-CA 124.334 1.054 . . . . 0.0 111.292 -177.885 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 81.4 m -93.75 -9.63 36.99 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 114.243 1.201 . . . . 0.0 114.243 -174.734 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 70.82 -154.33 52.12 Favored Glycine 0 CA--C 1.532 1.122 0 C-N-CA 124.998 1.285 . . . . 0.0 112.929 177.387 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -64.03 -9.07 13.92 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.972 1.309 . . . . 0.0 114.335 176.252 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 14.6 ttp180 -61.53 -30.99 70.99 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.668 1.587 . . . . 0.0 113.038 179.195 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 82.09 173.97 49.21 Favored Glycine 0 CA--C 1.53 1.024 0 C-N-CA 125.31 1.433 . . . . 0.0 114.17 174.639 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 23.4 p90 -151.16 155.22 38.43 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.26 1.424 . . . . 0.0 113.42 -176.159 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 74.9 t80 -90.99 -29.85 17.15 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.367 1.067 . . . . 0.0 113.71 -170.924 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 85.3 t80 -70.21 153.32 43.23 Favored 'General case' 0 CA--C 1.546 0.808 0 N-CA-C 114.915 1.45 . . . . 0.0 114.915 -170.266 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 24.3 p -136.02 142.75 41.4 Favored Pre-proline 0 N--CA 1.476 0.829 0 C-N-CA 126.903 2.081 . . . . 0.0 108.784 169.045 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -70.29 124.29 10.73 Favored 'Trans proline' 0 C--N 1.35 0.619 0 C-N-CA 122.78 2.32 . . . . 0.0 111.099 -170.658 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 25.3 mmmt . . . . . 0 CA--C 1.546 0.807 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 -178.198 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . 0.443 HG22 ' H ' ' B' ' 27' ' ' THR . 9.0 tp . . . . . 0 N--CA 1.483 1.204 0 N-CA-C 113.626 0.973 . . . . 0.0 113.626 . . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 5.0 p -63.74 -26.92 41.79 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 O-C-N 121.088 -1.008 . . . . 0.0 112.982 176.651 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 65.4 tt0 -72.05 -13.61 61.64 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.857 1.263 . . . . 0.0 112.351 175.154 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 31.9 tt0 -104.97 -45.32 4.58 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.223 1.409 . . . . 0.0 110.946 176.269 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 29.7 m -80.95 -25.91 37.03 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 115.502 1.667 . . . . 0.0 115.502 -175.672 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 49.4 t -87.99 -55.25 3.84 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 120.249 1.386 . . . . 0.0 112.6 -173.416 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 25.9 p -77.86 -20.23 53.41 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 125.471 1.508 . . . . 0.0 113.371 -176.574 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.4 t -132.83 -173.36 3.16 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.533 1.533 . . . . 0.0 111.257 171.723 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 71.0 mt -87.5 139.72 16.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 124.785 1.234 . . . . 0.0 110.209 178.241 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.3 p -131.26 153.8 49.14 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 122.081 0.943 . . . . 0.0 112.125 169.424 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 41.5 t -95.24 153.91 17.44 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 125.802 1.641 . . . . 0.0 112.77 -178.695 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 11.1 mp -58.99 -27.85 65.79 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 121.466 -0.771 . . . . 0.0 111.613 169.305 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 74.5 t80 -62.41 -31.72 72.45 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 123.884 0.873 . . . . 0.0 113.093 171.729 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 35.4 mt-30 -77.28 -42.39 37.15 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 123.961 0.905 . . . . 0.0 110.49 174.34 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 80.7 mt -56.71 -52.72 63.85 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 123.764 0.826 . . . . 0.0 111.612 174.565 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -60.54 -34.66 74.45 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 123.841 0.857 . . . . 0.0 112.854 178.428 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -71.38 -32.19 68.18 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 123.688 0.795 . . . . 0.0 112.627 175.483 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -72.8 -43.4 62.8 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.117 0.967 . . . . 0.0 111.811 175.284 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 87.9 m -55.49 136.35 49.94 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 125.695 1.598 . . . . 0.0 112.229 170.92 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 4.4 p30 . . . . . 0 C--O 1.252 1.237 0 C-N-CA 126.945 2.098 . . . . 0.0 112.882 -171.399 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 82.7 m-85 . . . . . 0 N--CA 1.485 1.307 0 N-CA-C 111.125 0.046 . . . . 0.0 111.125 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 57.4 t -66.77 137.59 24.55 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 C-N-CA 123.723 0.809 . . . . 0.0 109.334 171.884 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -158.48 150.48 21.48 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.451 1.101 . . . . 0.0 112.504 -170.64 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -175.85 176.9 1.75 Allowed 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 125.994 1.718 . . . . 0.0 110.703 -178.277 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 53.9 m-70 -77.94 135.72 37.88 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 124.5 1.12 . . . . 0.0 109.672 166.155 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 49.5 mt -141.81 135.82 30.02 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 126.607 1.963 . . . . 0.0 109.779 175.731 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 2.1 t -139.27 145.23 38.91 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 -174.315 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 50.21 -125.02 19.48 Favored Glycine 0 N--CA 1.471 0.976 0 C-N-CA 125.102 1.334 . . . . 0.0 114.277 169.957 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 18.9 m -55.65 -37.24 67.98 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.777 1.231 . . . . 0.0 113.09 178.223 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 70.3 m-70 -74.69 -30.29 61.51 Favored 'General case' 0 CA--C 1.541 0.599 0 O-C-N 120.79 -1.194 . . . . 0.0 112.79 176.99 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 39.2 tp -68.38 -44.68 74.62 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 118.805 0.73 . . . . 0.0 111.296 169.687 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 53.4 t -60.0 -46.21 94.43 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.014 0 C-N-CA 124.023 0.929 . . . . 0.0 110.919 173.993 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -58.61 -47.18 85.21 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 125.038 1.335 . . . . 0.0 111.869 174.33 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.53 -46.39 88.61 Favored 'General case' 0 CA--C 1.532 0.271 0 O-C-N 121.674 -0.641 . . . . 0.0 111.799 176.731 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 28.7 mt -54.84 -45.81 74.54 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 123.837 0.855 . . . . 0.0 111.138 175.788 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 11.0 m-85 -60.61 -51.51 69.11 Favored 'General case' 0 CA--C 1.544 0.722 0 O-C-N 121.041 -1.037 . . . . 0.0 112.819 173.972 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 91.9 mt -68.67 -40.23 80.26 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.133 0.973 . . . . 0.0 113.348 -175.395 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 54.3 t -73.58 -43.98 54.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 124.858 1.263 . . . . 0.0 111.365 -177.209 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 69.3 m -87.93 -27.91 21.84 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 114.705 1.372 . . . . 0.0 114.705 -170.147 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 56.17 -121.56 24.33 Favored Glycine 0 CA--C 1.531 1.045 0 C-N-CA 124.114 0.864 . . . . 0.0 112.799 174.575 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 3.7 pm0 -64.78 -14.62 59.69 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.809 1.643 . . . . 0.0 115.045 -177.064 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 61.1 mtp85 -62.77 -28.43 69.98 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 119.012 0.824 . . . . 0.0 112.655 172.621 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.84 133.05 1.57 Allowed Glycine 0 CA--C 1.53 1.014 0 C-N-CA 125.023 1.297 . . . . 0.0 110.661 -170.59 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -78.17 164.26 25.1 Favored 'General case' 0 CA--C 1.536 0.441 0 O-C-N 122.05 -0.676 . . . . 0.0 112.601 -177.697 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 53.4 t80 -155.75 134.63 11.99 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.398 1.079 . . . . 0.0 110.573 170.706 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 40.6 t80 -135.68 146.37 47.72 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 125.834 1.654 . . . . 0.0 111.849 -175.988 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 27' ' ' THR . . . . . 0.443 ' H ' HG22 ' A' ' 2' ' ' ILE . 27.1 p -141.32 139.68 19.43 Favored Pre-proline 0 CA--C 1.544 0.727 0 C-N-CA 126.108 1.763 . . . . 0.0 110.43 175.721 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -84.7 -177.43 2.87 Favored 'Trans proline' 0 CA--C 1.539 0.759 0 C-N-CA 124.01 3.14 . . . . 0.0 112.55 -174.744 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 33.0 ttpt . . . . . 0 CA--C 1.551 1.016 0 C-N-CA 126.437 1.895 . . . . 0.0 112.921 174.855 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 9.0 tp . . . . . 0 N--CA 1.485 1.283 0 N-CA-C 114.971 1.471 . . . . 0.0 114.971 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 6.3 p -64.96 -24.72 36.1 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 O-C-N 121.342 -0.849 . . . . 0.0 112.985 178.855 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -75.93 0.28 18.92 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 124.067 0.947 . . . . 0.0 112.319 175.466 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 31.9 tt0 -124.46 -48.21 1.83 Allowed 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.221 1.408 . . . . 0.0 111.216 174.992 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 17.1 m -71.02 -27.39 63.64 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 114.736 1.384 . . . . 0.0 114.736 179.735 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 12.3 t -83.79 -42.07 16.88 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 119.492 1.042 . . . . 0.0 111.449 179.295 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 19.7 p -76.8 -33.94 57.97 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 126.955 2.102 . . . . 0.0 112.911 -177.159 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 73.8 m -134.27 170.8 15.16 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.468 1.507 . . . . 0.0 111.885 179.827 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 58.7 mt -68.47 136.12 27.08 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 O-C-N 120.8 -1.188 . . . . 0.0 110.13 170.833 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.0 p -133.07 162.98 30.28 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.462 1.105 . . . . 0.0 112.975 175.167 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 6.2 t -128.76 172.7 11.01 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 125.479 1.511 . . . . 0.0 112.566 -175.983 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.479 HD22 ' H ' ' A' ' 13' ' ' LEU . 1.9 mm? -59.03 -31.65 69.03 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.133 1.373 . . . . 0.0 113.1 -169.855 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 87.9 t80 -63.5 -33.5 75.71 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 123.608 0.763 . . . . 0.0 113.008 175.951 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 38.0 mt-30 -76.55 -33.7 58.54 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 124.295 1.038 . . . . 0.0 110.683 176.616 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 80.8 mt -68.31 -52.81 29.39 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.871 0.868 . . . . 0.0 111.387 174.038 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -63.95 -21.47 66.5 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 113.56 0.948 . . . . 0.0 113.56 -179.026 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.3 t30 -68.69 -33.32 73.76 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 123.877 0.871 . . . . 0.0 112.618 174.876 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 9.1 m-85 -88.52 -14.34 37.99 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 114.302 1.223 . . . . 0.0 114.302 -179.086 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 91.7 m -71.53 160.34 32.88 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.692 0.797 . . . . 0.0 112.936 170.988 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 7.1 p-10 . . . . . 0 C--O 1.254 1.299 0 C-N-CA 126.895 2.078 . . . . 0.0 113.356 179.675 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 67.5 m-85 . . . . . 0 N--CA 1.484 1.261 0 CA-C-O 117.898 -1.048 . . . . 0.0 108.743 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 80.2 t -68.62 -36.37 74.25 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.38 0 CA-C-N 120.861 1.664 . . . . 0.0 109.475 168.625 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 51.7 p-10 -65.48 149.02 50.74 Favored 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 125.458 1.503 . . . . 0.0 112.291 168.515 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -162.14 165.3 27.24 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.13 0.972 . . . . 0.0 111.253 -171.441 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 34.0 m-70 -74.86 143.29 43.93 Favored 'General case' 0 CA--C 1.55 0.979 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 164.412 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 40.6 mt -142.97 137.73 29.58 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 125.773 1.629 . . . . 0.0 109.208 174.722 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 3.4 t -145.62 148.76 33.45 Favored 'General case' 0 N--CA 1.47 0.574 0 O-C-N 121.367 -0.833 . . . . 0.0 112.581 -176.2 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 52.89 -128.91 38.03 Favored Glycine 0 N--CA 1.473 1.133 0 C-N-CA 125.08 1.324 . . . . 0.0 114.018 172.141 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 26.7 m -56.87 -38.17 72.36 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.182 0.993 . . . . 0.0 113.03 -178.717 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 69.7 m-70 -73.13 -30.19 63.43 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 119.308 0.958 . . . . 0.0 112.839 177.529 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 51.1 tp -68.5 -45.77 71.42 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 118.881 0.764 . . . . 0.0 111.119 170.85 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 73.8 t -63.94 -42.3 95.33 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 CA-C-N 118.489 0.586 . . . . 0.0 111.351 176.435 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -56.3 -49.54 74.0 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.991 1.317 . . . . 0.0 111.502 171.018 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.38 -43.77 98.3 Favored 'General case' 0 CA--C 1.536 0.423 0 O-C-N 121.547 -0.721 . . . . 0.0 111.448 177.48 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 21.3 mt -58.24 -44.32 88.22 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 123.626 0.771 . . . . 0.0 111.535 176.516 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 14.8 m-85 -63.03 -45.36 92.65 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 119.107 0.867 . . . . 0.0 112.755 174.116 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 9.0 mp -72.75 -41.17 65.41 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 123.799 0.839 . . . . 0.0 113.063 -176.512 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 55.5 t -70.5 -43.48 77.9 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 C-N-CA 124.644 1.178 . . . . 0.0 110.934 -177.741 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 68.7 m -79.82 -15.95 56.42 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 113.412 0.893 . . . . 0.0 113.412 -178.565 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 59.12 -120.72 23.94 Favored Glycine 0 N--CA 1.469 0.884 0 C-N-CA 125.09 1.328 . . . . 0.0 113.427 168.842 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -59.93 -24.07 64.05 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.409 1.484 . . . . 0.0 113.418 -178.332 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 79.9 mtp180 -63.83 -30.36 71.46 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.084 0.954 . . . . 0.0 112.276 173.331 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.22 -155.19 51.38 Favored Glycine 0 CA--C 1.534 1.257 0 C-N-CA 124.461 1.029 . . . . 0.0 111.495 -168.904 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 58.3 t80 -149.36 148.01 29.0 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.431 1.492 . . . . 0.0 109.969 174.923 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 46.6 t80 -159.06 64.69 0.41 Allowed 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 124.234 1.014 . . . . 0.0 111.631 -169.28 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 67.7 t80 -156.97 155.92 32.12 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.713 1.605 . . . . 0.0 111.116 176.336 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 22.9 p -118.96 99.88 50.92 Favored Pre-proline 0 N--CA 1.475 0.785 0 C-N-CA 125.428 1.491 . . . . 0.0 110.557 -179.825 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -63.61 170.44 8.37 Favored 'Trans proline' 0 CA--C 1.539 0.768 0 C-N-CA 123.528 2.819 . . . . 0.0 113.441 173.842 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt . . . . . 0 N--CA 1.478 0.927 0 N-CA-C 114.172 1.175 . . . . 0.0 114.172 -178.384 . . . . . . . . 0 0 . 1 . 031 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 6.3 tp . . . . . 0 N--CA 1.487 1.379 0 N-CA-C 110.116 -0.327 . . . . 0.0 110.116 . . . . . . . . . 0 0 . 1 . 031 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 7.2 p -61.09 -32.41 52.64 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 O-C-N 121.408 -0.808 . . . . 0.0 112.335 179.46 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.7 pm0 -73.15 -18.98 61.22 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.371 1.068 . . . . 0.0 113.505 175.421 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 25.5 tp60 -88.74 -44.05 10.83 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.226 1.01 . . . . 0.0 110.3 172.445 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 21.4 m -78.82 -32.1 46.11 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 115.254 1.575 . . . . 0.0 115.254 -177.37 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 42.6 t -93.16 -59.24 2.08 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-N 119.825 1.193 . . . . 0.0 112.12 -175.487 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 19.2 m -67.84 -44.58 76.87 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.746 1.218 . . . . 0.0 110.62 -176.525 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.3 t -103.04 -163.16 0.97 Allowed 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.623 1.169 . . . . 0.0 110.832 169.119 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 82.0 mt -109.21 138.91 34.25 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 125.835 1.654 . . . . 0.0 109.471 -179.001 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 10.2 p -129.87 170.54 13.77 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.779 0.832 . . . . 0.0 113.149 173.565 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 81.9 p -120.22 167.13 12.58 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 125.962 1.705 . . . . 0.0 112.562 -175.43 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 51.0 mt -62.16 -30.94 71.4 Favored 'General case' 0 CA--C 1.539 0.554 0 O-C-N 121.751 -0.593 . . . . 0.0 111.954 173.989 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 89.7 t80 -64.81 -36.72 85.25 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 121.416 -0.802 . . . . 0.0 112.739 171.891 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -70.82 -26.16 63.18 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 118.632 -0.699 . . . . 0.0 111.815 173.011 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 74.4 mt -73.95 -43.62 57.62 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 119.423 1.01 . . . . 0.0 112.182 169.728 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -55.51 -34.87 65.02 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 123.575 0.75 . . . . 0.0 112.777 175.11 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 15.1 t30 -58.81 -27.77 65.38 Favored 'General case' 0 CA--C 1.55 0.969 0 N-CA-C 113.679 0.992 . . . . 0.0 113.679 176.551 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 49.9 m-85 -98.3 0.44 45.59 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 125.482 1.513 . . . . 0.0 113.751 179.339 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 37.9 t -75.37 167.74 21.32 Favored 'General case' 0 CA--C 1.544 0.745 0 O-C-N 120.846 -1.159 . . . . 0.0 112.116 169.917 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 25.9 m120 . . . . . 0 C--O 1.251 1.177 0 C-N-CA 126.356 1.862 . . . . 0.0 112.094 177.643 . . . . . . . . 0 0 . 1 . 031 nuclear nobuild core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 33.9 t80 . . . . . 0 N--CA 1.487 1.399 0 CA-C-O 117.985 -1.007 . . . . 0.0 110.106 . . . . . . . . . 0 0 . 1 . 031 nuclear nobuild core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 4.8 p -173.75 102.84 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 C-N-CA 126.601 1.96 . . . . 0.0 107.793 178.13 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 10.4 m120 -144.8 135.77 24.88 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.623 1.169 . . . . 0.0 111.292 -167.156 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 2.8 mm-40 -161.48 170.04 20.69 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.842 1.257 . . . . 0.0 112.542 -177.27 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 86.5 m-70 -86.04 135.02 33.8 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.327 1.051 . . . . 0.0 109.647 167.62 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 82.5 mt -139.85 119.38 13.1 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 125.892 1.677 . . . . 0.0 109.926 178.576 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 72.1 m -123.29 130.63 53.0 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 124.911 1.284 . . . . 0.0 112.243 -174.352 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 56.31 -120.65 20.74 Favored Glycine 0 N--CA 1.472 1.072 0 C-N-CA 124.729 1.156 . . . . 0.0 113.733 169.344 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 22.2 m -54.24 -33.24 57.98 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 124.562 1.145 . . . . 0.0 112.912 177.459 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 34.7 m80 -71.24 -41.11 70.54 Favored 'General case' 0 CA--C 1.539 0.551 0 O-C-N 120.895 -1.128 . . . . 0.0 111.34 178.07 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 60.4 tp -63.79 -45.27 90.44 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 123.637 0.775 . . . . 0.0 111.024 172.648 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 31.8 t -60.33 -46.12 95.43 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 C-N-CA 124.33 1.052 . . . . 0.0 110.77 177.808 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -63.87 -45.92 87.27 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 123.198 0.599 . . . . 0.0 111.767 176.409 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.27 -42.18 96.58 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 118.638 0.654 . . . . 0.0 111.897 179.235 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 27.1 tp -66.14 -37.75 86.46 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.075 0.95 . . . . 0.0 111.292 178.825 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 11.8 m-85 -64.67 -42.97 94.99 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 119.248 0.931 . . . . 0.0 112.448 169.109 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 70.2 mt -63.88 -39.09 93.38 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 119.08 0.855 . . . . 0.0 112.226 177.872 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 39.3 t -68.59 -45.55 81.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 124.052 0.941 . . . . 0.0 112.212 174.353 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 16.8 t -84.96 -23.21 28.85 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 114.238 1.199 . . . . 0.0 114.238 -171.915 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 77.38 -157.59 46.44 Favored Glycine 0 CA--C 1.533 1.165 0 C-N-CA 124.857 1.217 . . . . 0.0 112.372 -174.845 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -69.36 -10.86 59.83 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.034 1.334 . . . . 0.0 114.44 -175.083 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 71.1 mtm-85 -67.7 -25.56 65.74 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.698 1.199 . . . . 0.0 113.883 -175.975 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.17 155.18 12.36 Favored Glycine 0 CA--C 1.533 1.204 0 C-N-CA 124.856 1.217 . . . . 0.0 112.74 -175.02 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 22.2 p90 -115.15 170.89 8.03 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.64 1.576 . . . . 0.0 112.619 -177.591 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 45.2 p90 -108.74 152.06 25.36 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.705 1.202 . . . . 0.0 110.003 167.41 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 49.9 t80 -156.98 144.94 19.28 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 123.563 0.745 . . . . 0.0 112.742 -169.59 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 53.8 m -141.1 134.32 14.55 Favored Pre-proline 0 N--CA 1.473 0.707 0 C-N-CA 126.268 1.827 . . . . 0.0 108.361 173.755 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_endo -76.0 -170.48 0.86 Allowed 'Trans proline' 0 CA--C 1.542 0.91 0 C-N-CA 123.261 2.641 . . . . 0.0 111.896 178.339 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 28.4 ttpp . . . . . 0 CA--C 1.544 0.724 0 N-CA-C 114.489 1.292 . . . . 0.0 114.489 -175.336 . . . . . . . . 0 0 . 1 . 032 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 19.5 tt . . . . . 0 N--CA 1.481 1.092 0 N-CA-C 114.498 1.296 . . . . 0.0 114.498 . . . . . . . . . 0 0 . 1 . 032 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 58.0 t -67.68 -39.45 82.17 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.099 0 C-N-CA 123.712 0.805 . . . . 0.0 111.977 -168.16 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.7 pm0 -75.24 -35.49 61.42 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.436 1.094 . . . . 0.0 111.928 171.464 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 11.0 tp60 -74.26 -43.72 55.78 Favored 'General case' 0 CA--C 1.537 0.471 0 O-C-N 121.363 -0.835 . . . . 0.0 111.962 -172.396 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 33.3 m -65.58 -21.08 66.56 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 123.706 0.802 . . . . 0.0 113.072 172.947 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 48.7 t -91.49 -45.75 8.36 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 118.701 0.682 . . . . 0.0 112.09 -178.622 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 49.2 p -76.33 -20.59 57.11 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 125.234 1.413 . . . . 0.0 113.838 179.932 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 7.8 t -143.63 -167.82 2.68 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.733 1.213 . . . . 0.0 110.991 173.653 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 70.3 mt -93.55 132.23 38.29 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 C-N-CA 124.689 1.196 . . . . 0.0 109.052 172.953 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 27.0 p -114.46 164.74 13.55 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.364 1.066 . . . . 0.0 113.305 178.238 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 36.8 t -94.69 152.52 18.41 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 124.802 1.241 . . . . 0.0 112.813 -175.855 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 48.7 mt -60.82 -30.64 70.21 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 121.457 -0.777 . . . . 0.0 111.84 173.724 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 90.9 t80 -60.84 -36.81 80.08 Favored 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 171.788 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 64.6 mt-30 -70.32 -44.56 67.98 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.322 0.649 . . . . 0.0 110.061 176.886 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 98.6 mt -57.77 -42.98 85.2 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.7 0.8 . . . . 0.0 111.958 176.667 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -72.12 -35.09 69.04 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 113.981 1.104 . . . . 0.0 113.981 175.276 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -72.66 -34.77 67.45 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 119.104 0.865 . . . . 0.0 112.958 -177.628 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 27.5 m-85 -80.75 -5.83 57.66 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 113.741 1.015 . . . . 0.0 113.741 173.868 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 8.3 t -76.8 173.32 11.82 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 123.961 0.905 . . . . 0.0 112.785 172.401 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 . . . . . 0 C--O 1.253 1.268 0 C-N-CA 125.363 1.465 . . . . 0.0 114.022 -175.403 . . . . . . . . 0 0 . 1 . 032 nuclear nobuild core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 54.9 p90 . . . . . 0 N--CA 1.483 1.193 0 N-CA-C 111.232 0.086 . . . . 0.0 111.232 . . . . . . . . . 0 0 . 1 . 032 nuclear nobuild core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 17.5 m -71.28 145.97 12.12 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.33 0 C-N-CA 123.909 0.884 . . . . 0.0 112.334 -177.308 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 58.91 70.71 0.63 Allowed 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 125.546 1.538 . . . . 0.0 110.98 178.803 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -141.96 166.12 25.59 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 126.869 2.068 . . . . 0.0 110.228 -168.713 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 24.3 m-70 -68.08 131.87 46.21 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 165.008 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 74.9 mt -140.24 115.75 10.06 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 126.224 1.81 . . . . 0.0 109.072 -173.615 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 78.2 m -121.57 143.82 49.08 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.084 1.353 . . . . 0.0 111.544 -178.649 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 48.62 -124.12 11.46 Favored Glycine 0 N--CA 1.473 1.118 0 C-N-CA 125.298 1.428 . . . . 0.0 114.529 169.338 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 18.7 m -53.6 -39.89 65.26 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.444 1.098 . . . . 0.0 113.338 178.559 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 18.6 t60 -72.4 -31.23 65.35 Favored 'General case' 0 CA--C 1.543 0.677 0 O-C-N 120.971 -1.08 . . . . 0.0 112.058 179.655 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 50.3 tp -67.17 -42.87 83.53 Favored 'General case' 0 C--O 1.224 -0.253 0 O-C-N 121.503 -0.748 . . . . 0.0 110.924 168.885 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 77.2 t -60.81 -43.45 95.45 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 CA-C-N 119.029 0.831 . . . . 0.0 111.241 175.983 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 67.2 mt-10 -54.75 -50.91 67.24 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 118.927 0.785 . . . . 0.0 111.087 171.166 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.02 -44.4 92.68 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.681 0.792 . . . . 0.0 112.11 -177.821 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 33.1 mt -56.22 -48.01 77.32 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 124.169 0.988 . . . . 0.0 110.892 176.338 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 14.2 m-85 -65.41 -43.77 89.53 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 119.074 0.852 . . . . 0.0 112.851 177.201 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 76.9 mt -66.85 -42.93 84.87 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 123.608 0.763 . . . . 0.0 112.552 -179.87 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 71.0 t -77.14 -36.65 24.86 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 C-N-CA 124.557 1.143 . . . . 0.0 111.602 -176.741 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 49.8 t -77.57 -31.48 53.17 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 113.875 1.065 . . . . 0.0 113.875 178.017 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 76.95 -140.37 24.78 Favored Glycine 0 CA--C 1.531 1.054 0 C-N-CA 124.072 0.844 . . . . 0.0 112.886 178.041 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 3.6 pm0 -66.46 -16.67 64.29 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 115.416 1.635 . . . . 0.0 115.416 -169.499 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 49.2 mtm180 -62.74 -37.24 85.82 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 118.785 0.721 . . . . 0.0 112.106 174.957 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.62 139.15 1.51 Allowed Glycine 0 CA--C 1.531 1.07 0 C-N-CA 125.809 1.671 . . . . 0.0 113.147 179.139 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 50.1 t80 -71.48 156.86 38.96 Favored 'General case' 0 CA--C 1.545 0.762 0 O-C-N 122.066 -0.667 . . . . 0.0 112.494 177.701 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 89.7 t80 -156.42 -32.29 0.09 Allowed 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 114.723 1.379 . . . . 0.0 114.723 -168.882 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 79.1 t80 -60.78 131.53 50.99 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.281 1.033 . . . . 0.0 113.285 -176.102 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 39.7 p -74.74 145.92 82.38 Favored Pre-proline 0 N--CA 1.477 0.899 0 O-C-N 121.27 -0.894 . . . . 0.0 111.697 -176.807 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -73.32 137.84 26.47 Favored 'Trans proline' 0 N--CA 1.456 -0.706 0 C-N-CA 122.955 2.437 . . . . 0.0 111.332 -178.537 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 45.3 mmtm . . . . . 0 CA--C 1.546 0.809 0 N-CA-C 113.628 0.973 . . . . 0.0 113.628 -177.69 . . . . . . . . 0 0 . 1 . 033 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 7.1 tp . . . . . 0 N--CA 1.488 1.45 0 N-CA-C 110.399 -0.223 . . . . 0.0 110.399 . . . . . . . . . 0 0 . 1 . 033 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 48.4 t -59.21 -35.91 60.29 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 C-N-CA 124.188 0.995 . . . . 0.0 110.957 178.437 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 13.0 pm0 -69.67 -9.28 53.66 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.79 1.236 . . . . 0.0 114.047 177.207 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 25.7 tt0 -99.68 -66.41 0.91 Allowed 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.17 0.988 . . . . 0.0 109.152 169.505 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 50.8 m -71.99 -26.53 62.27 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 115.464 1.654 . . . . 0.0 115.464 -168.928 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 13.4 t -85.43 -44.54 12.66 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 119.304 0.956 . . . . 0.0 110.992 176.924 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 27.3 m -65.63 -40.13 92.21 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 126.086 1.754 . . . . 0.0 111.893 -179.743 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 67.3 m -138.25 172.25 13.19 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.232 1.413 . . . . 0.0 112.0 -174.866 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 43.4 mt -64.98 136.17 27.1 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 O-C-N 120.748 -1.22 . . . . 0.0 110.179 170.666 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 9.6 p -134.51 176.72 8.37 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.235 1.414 . . . . 0.0 111.673 170.793 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 22.9 t -138.03 161.78 35.83 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.556 1.143 . . . . 0.0 112.708 -179.936 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.499 HD22 ' H ' ' A' ' 13' ' ' LEU . 1.2 mm? -61.18 -28.88 69.45 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.927 1.291 . . . . 0.0 111.783 -179.932 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 79.9 t80 -63.27 -24.25 67.78 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.68 1.192 . . . . 0.0 113.439 172.954 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 62.8 mt-30 -85.1 -37.43 20.28 Favored 'General case' 0 N--CA 1.469 0.517 0 O-C-N 121.549 -0.719 . . . . 0.0 110.638 171.884 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 27.5 mt -60.97 -33.33 73.04 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 118.965 0.802 . . . . 0.0 113.001 175.532 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.7 mm-40 -50.93 -30.97 16.23 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 124.637 1.175 . . . . 0.0 113.714 169.175 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 -73.93 -19.86 60.55 Favored 'General case' 0 CA--C 1.546 0.82 0 O-C-N 121.09 -1.006 . . . . 0.0 113.101 177.037 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 79.9 m-85 -93.35 -7.19 45.45 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.593 1.557 . . . . 0.0 113.191 176.944 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 33.1 m -74.16 136.44 42.87 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.477 1.111 . . . . 0.0 109.236 167.598 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 9.3 p30 . . . . . 0 C--O 1.253 1.268 0 CA-C-O 118.026 -0.988 . . . . 0.0 113.364 179.293 . . . . . . . . 0 0 . 1 . 033 nuclear nobuild core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 63.7 m-85 . . . . . 0 N--CA 1.488 1.464 0 CA-C-O 119.051 -0.5 . . . . 0.0 110.299 . . . . . . . . . 0 0 . 1 . 033 nuclear nobuild core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 27.6 m -61.02 -34.71 61.07 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.367 0 CA-C-N 119.97 1.259 . . . . 0.0 112.616 179.227 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 24.6 m120 -83.87 120.42 26.05 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.429 1.091 . . . . 0.0 109.737 168.93 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 5.4 tt0 -166.76 163.47 16.52 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 124.172 0.989 . . . . 0.0 111.646 -177.014 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 26.4 m-70 -77.48 142.5 39.11 Favored 'General case' 0 CA--C 1.548 0.87 0 N-CA-C 107.631 -1.248 . . . . 0.0 107.631 163.932 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 58.5 mt -139.72 132.53 29.15 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 125.719 1.607 . . . . 0.0 108.557 175.251 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.6 t -144.04 149.33 36.5 Favored 'General case' 0 N--CA 1.47 0.569 0 O-C-N 121.439 -0.788 . . . . 0.0 112.391 -175.054 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.32 -128.01 43.19 Favored Glycine 0 N--CA 1.469 0.855 0 C-N-CA 124.702 1.144 . . . . 0.0 113.515 172.611 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 27.2 p -53.41 -44.99 69.17 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.437 1.095 . . . . 0.0 112.923 177.363 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 12.8 m-70 -67.38 -31.27 71.39 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 120.941 -1.099 . . . . 0.0 113.352 179.255 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 40.6 tp -70.53 -44.34 67.73 Favored 'General case' 0 N--CA 1.466 0.343 0 O-C-N 121.616 -0.677 . . . . 0.0 110.892 171.517 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 54.0 t -59.02 -43.04 88.03 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 C-N-CA 123.585 0.754 . . . . 0.0 111.168 173.692 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -59.43 -44.5 92.9 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 123.864 0.866 . . . . 0.0 111.819 172.229 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.53 -42.44 99.52 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-N 119.062 0.846 . . . . 0.0 111.982 176.467 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -58.48 -46.04 87.45 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 118.79 0.723 . . . . 0.0 111.599 173.162 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 9.5 m-85 -59.12 -46.09 89.23 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 119.024 0.829 . . . . 0.0 112.339 174.28 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 67.8 mt -68.13 -39.64 82.66 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.196 0.998 . . . . 0.0 112.495 -178.229 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 71.9 t -72.23 -53.49 19.54 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 C-N-CA 123.629 0.772 . . . . 0.0 111.213 177.249 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 65.5 m -79.64 -31.69 41.55 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 113.579 0.955 . . . . 0.0 113.579 -170.729 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.5 -133.97 41.76 Favored Glycine 0 CA--C 1.528 0.871 0 C-N-CA 124.094 0.854 . . . . 0.0 111.815 178.09 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -65.32 -14.57 61.09 Favored 'General case' 0 CA--C 1.543 0.673 0 N-CA-C 114.633 1.346 . . . . 0.0 114.633 -179.632 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 88.0 mtm180 -66.43 -40.03 89.25 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 118.775 0.716 . . . . 0.0 112.216 177.981 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.93 170.74 45.0 Favored Glycine 0 CA--C 1.536 1.377 0 C-N-CA 124.225 0.917 . . . . 0.0 112.67 -168.795 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 54.6 p90 -148.03 166.49 27.6 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 114.835 1.42 . . . . 0.0 114.835 -169.272 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -99.65 141.78 32.0 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.495 1.518 . . . . 0.0 110.418 168.49 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 34.7 t80 -158.24 129.54 6.55 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.049 1.34 . . . . 0.0 111.47 177.893 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 29.5 p -149.22 154.51 39.11 Favored Pre-proline 0 N--CA 1.476 0.863 0 C-N-CA 126.403 1.881 . . . . 0.0 110.613 170.556 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_endo -72.05 176.63 8.16 Favored 'Trans proline' 0 C--N 1.354 0.839 0 C-N-CA 124.272 3.315 . . . . 0.0 112.434 178.154 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 77.8 mttt . . . . . 0 CA--C 1.544 0.739 0 N-CA-C 114.43 1.27 . . . . 0.0 114.43 -169.6 . . . . . . . . 0 0 . 1 . 034 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 12.1 tt . . . . . 0 N--CA 1.481 1.088 0 N-CA-C 115.676 1.732 . . . . 0.0 115.676 . . . . . . . . . 0 0 . 1 . 034 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 2.7 p -64.46 -29.86 48.56 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.193 0 CA-C-N 120.187 1.358 . . . . 0.0 112.735 175.396 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -73.8 -36.4 64.99 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 118.501 0.591 . . . . 0.0 111.394 173.08 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 32.1 tt0 -76.94 -57.96 3.55 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 124.75 1.22 . . . . 0.0 111.952 -174.988 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 21.0 m -67.14 -21.5 65.82 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 113.892 1.071 . . . . 0.0 113.892 -177.27 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 8.1 t -87.82 -30.15 20.43 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.804 0.841 . . . . 0.0 112.702 179.949 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 28.9 m -88.47 -46.49 9.08 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 125.095 1.358 . . . . 0.0 110.949 177.359 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 49.1 m -113.39 167.66 10.38 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 125.714 1.606 . . . . 0.0 111.473 -176.482 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 62.9 mt -75.08 137.17 23.53 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 O-C-N 120.96 -1.088 . . . . 0.0 108.705 170.429 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.4 p -132.87 173.34 11.49 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.61 1.164 . . . . 0.0 112.816 178.01 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 23.2 t -131.88 166.29 21.94 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 125.313 1.445 . . . . 0.0 112.459 -175.67 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 60.0 mt -57.64 -29.16 64.34 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.781 1.233 . . . . 0.0 112.455 177.94 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 86.9 t80 -61.03 -31.31 70.95 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 124.387 1.075 . . . . 0.0 113.317 173.584 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 33.4 mt-30 -79.19 -33.3 44.02 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 123.731 0.812 . . . . 0.0 110.856 175.309 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 88.2 mt -63.61 -42.72 98.2 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 118.779 0.718 . . . . 0.0 111.553 171.728 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -56.38 -34.81 67.05 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.676 0.79 . . . . 0.0 113.027 174.698 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 17.3 t30 -64.14 -26.63 68.62 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 113.109 0.781 . . . . 0.0 113.109 179.76 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 54.7 m-85 -98.37 1.67 47.2 Favored 'General case' 0 CA--C 1.551 1.007 0 C-N-CA 125.363 1.465 . . . . 0.0 113.826 179.475 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 46.4 t -84.53 174.11 10.28 Favored 'General case' 0 CA--C 1.55 0.942 0 C-N-CA 124.886 1.274 . . . . 0.0 111.223 168.151 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 8.3 p30 . . . . . 0 C--O 1.253 1.251 0 C-N-CA 125.177 1.391 . . . . 0.0 112.042 170.535 . . . . . . . . 0 0 . 1 . 034 nuclear nobuild core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 15.2 t80 . . . . . 0 N--CA 1.488 1.439 0 CA-C-O 118.912 -0.566 . . . . 0.0 110.03 . . . . . . . . . 0 0 . 1 . 034 nuclear nobuild core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 30.2 m -65.06 -22.44 31.39 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.341 0 CA-C-N 120.621 1.555 . . . . 0.0 114.433 -174.431 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 23.0 m120 -78.75 118.76 21.13 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.589 1.155 . . . . 0.0 111.545 176.773 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 16.7 tt0 -162.81 164.68 26.05 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.804 1.242 . . . . 0.0 111.096 -179.808 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 97.5 m-70 -79.02 146.62 33.23 Favored 'General case' 0 CA--C 1.544 0.726 0 O-C-N 120.782 -1.199 . . . . 0.0 110.058 167.9 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 83.5 mt -141.24 133.43 27.96 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 125.039 1.335 . . . . 0.0 110.075 175.525 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 5.0 t -153.47 143.26 21.95 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 121.526 -0.734 . . . . 0.0 112.211 -177.319 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 60.36 -133.38 50.37 Favored Glycine 0 CA--C 1.531 1.069 0 C-N-CA 124.377 0.989 . . . . 0.0 112.981 177.375 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.0 m -54.84 -32.76 60.92 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 124.676 1.19 . . . . 0.0 113.16 178.473 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 20.1 m80 -67.71 -43.82 79.15 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.225 -0.922 . . . . 0.0 111.182 177.874 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 59.2 tp -65.1 -44.37 89.04 Favored 'General case' 0 C--N 1.342 0.262 0 C-N-CA 123.587 0.755 . . . . 0.0 111.244 174.072 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 41.0 t -60.45 -45.56 96.64 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 124.173 0.989 . . . . 0.0 110.925 178.431 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -62.98 -47.33 83.63 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 123.469 0.708 . . . . 0.0 111.597 175.65 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.8 -41.9 97.81 Favored 'General case' 0 CA--C 1.542 0.649 0 O-C-N 121.391 -0.818 . . . . 0.0 112.326 179.439 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 30.8 tp -66.76 -37.61 84.96 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.176 0.99 . . . . 0.0 111.086 178.776 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 11.6 m-85 -65.91 -40.93 91.94 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 119.395 0.998 . . . . 0.0 112.45 169.523 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 65.1 mt -64.13 -41.14 97.33 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 119.178 0.899 . . . . 0.0 112.155 176.891 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 41.2 t -70.34 -44.14 77.75 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.954 0 C-N-CA 123.4 0.68 . . . . 0.0 112.468 175.31 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 9.5 t -80.52 -18.29 48.96 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 113.757 1.021 . . . . 0.0 113.757 -175.81 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 71.8 -149.65 45.08 Favored Glycine 0 CA--C 1.527 0.838 0 C-N-CA 125.495 1.521 . . . . 0.0 112.897 174.506 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -62.96 -22.04 66.52 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.21 1.404 . . . . 0.0 113.182 -175.993 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 88.3 mtm-85 -64.46 -33.66 76.39 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.021 0.929 . . . . 0.0 113.126 -179.553 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.29 141.47 0.87 Allowed Glycine 0 CA--C 1.531 1.065 0 C-N-CA 125.323 1.44 . . . . 0.0 112.071 -172.524 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 32.8 p90 -76.06 153.0 36.71 Favored 'General case' 0 CA--C 1.542 0.67 0 O-C-N 121.636 -0.92 . . . . 0.0 113.199 -178.11 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 78.3 t80 -84.97 -24.7 28.19 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.073 1.349 . . . . 0.0 112.641 -179.012 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 52.0 t80 -63.22 158.33 20.35 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 126.42 1.888 . . . . 0.0 115.085 -177.128 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 17.7 p -137.88 132.52 17.25 Favored Pre-proline 0 N--CA 1.471 0.615 0 C-N-CA 126.274 1.83 . . . . 0.0 108.765 168.315 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -79.57 162.33 24.71 Favored 'Trans proline' 0 N--CA 1.46 -0.483 0 C-N-CA 122.936 2.424 . . . . 0.0 111.948 -177.057 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 59.5 mtpt . . . . . 0 CA--C 1.547 0.86 0 C-N-CA 124.872 1.269 . . . . 0.0 114.41 179.956 . . . . . . . . 0 0 . 1 . 035 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . 0.409 ' HB ' ' CD2' ' A' ' 19' ' ' TYR . 7.7 tp . . . . . 0 N--CA 1.476 0.842 0 N-CA-C 114.716 1.376 . . . . 0.0 114.716 . . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 11.0 p -58.81 -57.1 12.65 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 N-CA-C 112.878 0.696 . . . . 0.0 112.878 -168.44 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 67.0 mt-10 -73.33 -30.23 63.2 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 119.854 1.206 . . . . 0.0 112.205 177.013 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 26.5 tt0 -62.59 -32.62 73.65 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.957 0.903 . . . . 0.0 112.114 -178.934 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 62.0 m -94.61 -27.05 16.11 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 114.505 1.298 . . . . 0.0 114.505 170.701 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 60.8 m -72.37 -64.81 0.87 Allowed 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 120.229 1.377 . . . . 0.0 112.181 178.99 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 40.4 p -87.8 -15.29 37.31 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.131 0.972 . . . . 0.0 113.538 -171.523 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 68.6 m -122.03 167.78 12.71 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.967 1.307 . . . . 0.0 111.72 171.86 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 72.3 mt -79.61 135.35 25.75 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 124.275 1.03 . . . . 0.0 109.352 173.753 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 11.9 p -130.69 163.83 26.37 Favored 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 113.905 1.076 . . . . 0.0 113.905 178.15 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 35.1 t -111.23 159.3 18.03 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.99 1.716 . . . . 0.0 112.346 179.726 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 53.6 mt -60.47 -27.97 67.96 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.81 0.844 . . . . 0.0 111.555 174.108 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 85.9 t80 -62.24 -30.56 71.19 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.283 1.033 . . . . 0.0 113.088 172.456 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 68.3 mt-30 -81.55 -31.06 32.85 Favored 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 123.548 0.739 . . . . 0.0 110.969 174.877 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 66.3 mt -63.74 -43.15 97.35 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 118.968 0.804 . . . . 0.0 111.494 169.657 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -55.98 -35.26 66.55 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.665 1.186 . . . . 0.0 113.526 175.025 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -60.31 -31.08 69.93 Favored 'General case' 0 CA--C 1.547 0.836 0 O-C-N 121.505 -0.747 . . . . 0.0 112.38 178.112 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.409 ' CD2' ' HB ' ' A' ' 2' ' ' ILE . 92.0 m-85 -103.39 10.11 37.52 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.762 1.225 . . . . 0.0 114.163 -177.721 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 76.0 m -73.46 150.74 41.41 Favored 'General case' 0 N--CA 1.468 0.452 0 O-C-N 121.462 -0.774 . . . . 0.0 110.977 167.89 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 21.9 t-20 . . . . . 0 C--O 1.254 1.318 0 C-N-CA 124.385 1.074 . . . . 0.0 113.132 176.336 . . . . . . . . 0 0 . 1 . 035 nuclear nobuild core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 83.1 m-85 . . . . . 0 N--CA 1.487 1.376 0 CA-C-O 117.993 -1.003 . . . . 0.0 110.916 . . . . . . . . . 0 0 . 1 . 035 nuclear nobuild core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 8.7 p -66.39 145.97 13.53 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.276 0 CA-C-N 120.576 1.534 . . . . 0.0 112.051 179.67 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 2.2 t30 58.57 63.8 1.61 Allowed 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 126.177 1.791 . . . . 0.0 111.311 175.874 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 -151.87 160.87 43.39 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.943 0.897 . . . . 0.0 111.83 -169.528 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 68.5 m-70 -76.59 138.14 39.95 Favored 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 164.824 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 66.3 mt -142.37 123.26 14.39 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 126.018 1.727 . . . . 0.0 108.759 177.484 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 5.6 t -141.36 149.92 41.77 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 121.36 -0.837 . . . . 0.0 112.729 -175.082 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.69 -128.42 44.86 Favored Glycine 0 N--CA 1.47 0.916 0 C-N-CA 124.261 0.934 . . . . 0.0 112.718 174.964 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.5 m -53.63 -37.98 63.61 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.681 1.192 . . . . 0.0 112.986 176.782 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 42.4 m-70 -70.59 -35.59 73.11 Favored 'General case' 0 CA--C 1.539 0.521 0 O-C-N 120.977 -1.077 . . . . 0.0 112.242 179.421 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 44.2 tp -67.62 -40.98 84.66 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 123.297 0.639 . . . . 0.0 111.28 171.724 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 25.5 t -59.52 -46.79 92.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 124.338 1.055 . . . . 0.0 111.266 172.789 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -61.19 -46.19 91.48 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 123.773 0.829 . . . . 0.0 111.567 175.077 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.06 -41.06 99.37 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 121.61 -0.681 . . . . 0.0 112.017 179.021 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 43.6 mt -65.92 -40.3 91.34 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 118.487 -0.768 . . . . 0.0 111.81 175.1 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 16.6 m-85 -61.57 -38.78 88.75 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 120.381 1.446 . . . . 0.0 112.765 171.41 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 76.4 mt -68.09 -44.54 76.01 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.801 0.84 . . . . 0.0 112.297 176.422 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 55.2 t -74.07 -45.68 47.57 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 C-N-CA 123.479 0.712 . . . . 0.0 112.232 -179.027 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 49.6 m -84.58 -26.59 27.86 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 113.786 1.032 . . . . 0.0 113.786 -173.789 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 71.81 -149.21 44.4 Favored Glycine 0 CA--C 1.531 1.076 0 C-N-CA 124.576 1.084 . . . . 0.0 112.092 -174.435 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -62.28 -19.82 63.64 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.116 1.366 . . . . 0.0 113.419 -178.815 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 62.7 mtm180 -58.79 -35.55 73.0 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.536 1.134 . . . . 0.0 113.21 178.495 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.68 -173.09 55.32 Favored Glycine 0 CA--C 1.53 1.011 0 C-N-CA 124.282 0.944 . . . . 0.0 113.199 -172.333 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 37.6 p90 -146.69 162.79 37.76 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 126.078 1.751 . . . . 0.0 112.571 -169.114 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 61.6 m-85 -89.95 -27.67 19.66 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 114.193 1.182 . . . . 0.0 114.193 -177.042 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 4.1 t80 57.03 31.46 19.95 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 125.059 1.344 . . . . 0.0 113.183 -179.633 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 38.4 m -47.17 123.12 8.16 Favored Pre-proline 0 CA--C 1.543 0.682 0 C-N-CA 126.276 1.83 . . . . 0.0 112.324 -168.959 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_exo -61.35 178.05 0.69 Allowed 'Trans proline' 0 C--N 1.352 0.714 0 C-N-CA 124.754 3.636 . . . . 0.0 115.292 179.216 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 17.3 ptmt . . . . . 0 CA--C 1.547 0.842 0 N-CA-C 114.956 1.465 . . . . 0.0 114.956 174.801 . . . . . . . . 0 0 . 1 . 036 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 19.1 tt . . . . . 0 N--CA 1.478 0.946 0 CA-C-O 118.936 -0.554 . . . . 0.0 112.44 . . . . . . . . . 0 0 . 1 . 036 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 72.2 t -56.31 -58.73 4.24 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 123.743 0.817 . . . . 0.0 111.878 -169.289 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . 0.42 ' CD ' ' H ' ' A' ' 4' ' ' GLU . 0.8 OUTLIER -81.47 -20.47 40.18 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 -179.526 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 11.9 tp60 -69.2 -43.95 73.11 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 119.413 1.006 . . . . 0.0 111.338 177.268 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 46.8 m -67.23 -26.7 66.72 Favored 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 172.732 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 77.5 m -71.83 -56.54 5.55 Favored 'General case' 0 CA--C 1.543 0.675 0 O-C-N 121.016 -1.052 . . . . 0.0 111.193 172.985 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 46.6 p -75.16 -22.79 57.85 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 125.264 1.426 . . . . 0.0 113.98 -170.715 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 6.2 t -144.13 178.99 7.49 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 122.641 1.21 . . . . 0.0 112.411 175.586 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 17.6 mm -70.19 129.49 34.38 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.676 0 C-N-CA 125.439 1.496 . . . . 0.0 109.188 174.353 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 10.2 p -128.54 155.87 44.19 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.157 0.983 . . . . 0.0 112.448 174.576 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 75.3 p -103.84 164.04 11.95 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 114.946 1.462 . . . . 0.0 114.946 -169.741 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 10.5 mp -65.39 -27.56 68.65 Favored 'General case' 0 CA--C 1.539 0.551 0 O-C-N 121.185 -0.947 . . . . 0.0 111.651 172.09 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 89.6 t80 -64.52 -34.05 77.32 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 121.653 -0.654 . . . . 0.0 112.568 170.788 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 67.2 mt-30 -72.6 -39.52 67.25 Favored 'General case' 0 N--CA 1.47 0.543 0 O-C-N 121.62 -0.675 . . . . 0.0 111.289 171.581 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 94.5 mt -61.22 -43.73 98.41 Favored 'General case' 0 CA--C 1.545 0.757 0 CA-C-N 119.322 0.965 . . . . 0.0 111.727 174.089 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 40.0 mm-40 -55.5 -40.82 72.22 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 125.538 1.535 . . . . 0.0 112.806 171.551 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 17.0 t-20 -63.46 -23.02 67.22 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 113.419 0.896 . . . . 0.0 113.419 -177.965 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 64.2 m-85 -102.22 3.26 38.11 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 125.455 1.502 . . . . 0.0 114.194 176.785 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 85.2 m -66.64 146.77 54.12 Favored 'General case' 0 CA--C 1.544 0.732 0 O-C-N 121.235 -0.916 . . . . 0.0 110.402 167.934 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 . . . . . 0 C--O 1.255 1.386 0 C-N-CA 124.758 1.223 . . . . 0.0 113.083 -174.511 . . . . . . . . 0 0 . 1 . 036 nuclear nobuild core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 72.1 m-85 . . . . . 0 N--CA 1.484 1.238 0 CA-C-O 119.39 -0.338 . . . . 0.0 110.725 . . . . . . . . . 0 0 . 1 . 036 nuclear nobuild core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 13.4 p -84.36 115.97 27.3 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.012 0 C-N-CA 123.834 0.854 . . . . 0.0 111.08 -178.134 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -174.0 143.68 0.95 Allowed 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.566 1.546 . . . . 0.0 111.978 -171.956 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 29.3 mm-40 -154.58 169.27 24.24 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 125.503 1.521 . . . . 0.0 111.017 -174.307 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 51.5 m-70 -77.91 135.13 37.82 Favored 'General case' 0 CA--C 1.548 0.868 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 166.273 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 86.1 mt -140.54 124.75 17.57 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 125.404 1.482 . . . . 0.0 109.273 -179.485 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 5.2 t -142.21 142.41 32.65 Favored 'General case' 0 N--CA 1.469 0.494 0 O-C-N 121.485 -0.76 . . . . 0.0 112.84 -174.908 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 56.94 -126.61 42.42 Favored Glycine 0 CA--C 1.53 1.005 0 C-N-CA 124.598 1.094 . . . . 0.0 113.148 175.527 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 22.1 p -54.68 -38.07 66.52 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.411 1.085 . . . . 0.0 112.934 176.46 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 20.3 t-160 -68.95 -36.39 77.88 Favored 'General case' 0 CA--C 1.543 0.701 0 O-C-N 120.832 -1.168 . . . . 0.0 111.55 179.235 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 58.9 tp -67.99 -43.18 79.48 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 123.524 0.73 . . . . 0.0 111.361 172.083 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 28.8 t -59.26 -45.82 92.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 C-N-CA 124.31 1.044 . . . . 0.0 110.769 175.517 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -63.57 -44.05 95.23 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 118.621 0.646 . . . . 0.0 112.106 174.385 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.36 -41.71 94.24 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 119.254 0.934 . . . . 0.0 112.096 176.619 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 58.1 mt -63.58 -41.61 98.35 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 123.419 0.687 . . . . 0.0 111.749 174.546 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 14.0 m-85 -59.04 -45.94 89.49 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 119.761 1.164 . . . . 0.0 112.445 171.247 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 9.0 mp -67.55 -43.78 79.86 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.785 0.834 . . . . 0.0 112.35 -179.626 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 52.7 t -70.93 -49.37 50.44 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 CA-C-N 118.549 0.613 . . . . 0.0 111.456 -179.959 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 63.3 m -77.35 -33.23 55.43 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 113.371 0.878 . . . . 0.0 113.371 -174.189 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 65.36 -135.4 36.51 Favored Glycine 0 CA--C 1.529 0.907 0 C-N-CA 124.211 0.91 . . . . 0.0 111.781 178.573 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -64.09 -15.33 59.39 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 114.287 1.218 . . . . 0.0 114.287 -179.398 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 89.3 mtm180 -67.17 -36.6 82.14 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.896 0.878 . . . . 0.0 112.596 177.622 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.99 -177.41 50.23 Favored Glycine 0 CA--C 1.533 1.172 0 C-N-CA 124.391 0.996 . . . . 0.0 112.406 -169.657 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 46.5 p90 -159.85 174.45 14.43 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 125.058 1.343 . . . . 0.0 113.556 -172.039 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 27.9 t80 -142.89 125.03 15.35 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.189 0.996 . . . . 0.0 110.206 168.761 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 48.7 p90 -90.31 132.22 35.67 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 124.989 1.315 . . . . 0.0 112.096 -179.121 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 64.1 m -122.85 122.82 27.0 Favored Pre-proline 0 N--CA 1.479 0.996 0 C-N-CA 123.887 0.875 . . . . 0.0 111.648 -172.585 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_endo -91.46 177.56 1.89 Allowed 'Trans proline' 0 CA--C 1.539 0.767 0 C-N-CA 125.126 3.884 . . . . 0.0 112.263 172.959 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 88.8 tttt . . . . . 0 N--CA 1.474 0.763 0 C-N-CA 126.08 1.752 . . . . 0.0 113.805 174.896 . . . . . . . . 0 0 . 1 . 037 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . 0.461 ' N ' ' HG1' ' B' ' 27' ' ' THR . 19.1 tt . . . . . 0 N--CA 1.481 1.082 0 N-CA-C 113.629 0.974 . . . . 0.0 113.629 . . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 55.9 t -57.54 -29.38 33.84 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 172.805 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -89.96 -35.48 15.54 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 118.978 0.808 . . . . 0.0 112.463 169.656 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -69.27 -41.21 77.18 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 121.84 -0.538 . . . . 0.0 112.299 -171.93 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.3 m -74.75 -21.98 59.04 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 113.118 0.784 . . . . 0.0 113.118 172.174 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 17.1 t -89.38 -46.81 8.45 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.427 0.691 . . . . 0.0 112.489 -171.585 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 85.7 m -82.72 -44.35 15.74 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 125.393 1.477 . . . . 0.0 111.326 178.039 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 68.8 m -106.09 172.95 6.53 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 124.4 1.08 . . . . 0.0 111.813 177.53 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 22.6 mm -73.91 144.55 12.41 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 O-C-N 120.89 -1.131 . . . . 0.0 110.108 171.285 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 11.8 p -134.9 -177.03 4.44 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 113.751 1.019 . . . . 0.0 113.751 170.601 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 79.3 p -147.76 164.58 33.17 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 125.382 1.473 . . . . 0.0 112.5 -169.172 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 10.9 mp -61.89 -29.33 70.13 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 121.416 -0.803 . . . . 0.0 112.423 -177.416 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 90.3 t80 -63.01 -37.0 85.45 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 123.44 0.696 . . . . 0.0 112.483 172.773 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 58.6 mt-30 -74.9 -36.56 62.23 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 123.786 0.835 . . . . 0.0 111.052 175.461 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 94.9 mt -61.83 -48.48 80.38 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 118.728 0.695 . . . . 0.0 111.279 172.97 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 19.6 mm-40 -60.97 -34.56 74.95 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.208 1.003 . . . . 0.0 113.268 176.691 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 17.0 t30 -57.76 -28.01 63.56 Favored 'General case' 0 CA--C 1.547 0.85 0 O-C-N 121.013 -1.054 . . . . 0.0 113.028 178.209 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 71.0 m-85 -103.08 6.89 38.88 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.183 1.393 . . . . 0.0 113.906 177.445 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 98.9 m -92.27 160.64 15.05 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.134 0.974 . . . . 0.0 112.994 171.12 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 . . . . . 0 C--O 1.253 1.267 0 N-CA-C 113.55 0.944 . . . . 0.0 113.55 -173.078 . . . . . . . . 0 0 . 1 . 037 nuclear nobuild core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 62.5 t80 . . . . . 0 N--CA 1.488 1.456 0 N-CA-C 110.175 -0.305 . . . . 0.0 110.175 . . . . . . . . . 0 0 . 1 . 037 nuclear nobuild core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 9.4 p -66.23 145.99 13.52 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.2 0 O-C-N 121.344 -0.847 . . . . 0.0 111.891 179.119 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 1.9 t30 61.33 58.63 2.11 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.186 1.394 . . . . 0.0 111.288 177.091 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -150.43 164.17 36.57 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.022 1.329 . . . . 0.0 110.473 -176.088 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 97.7 m-70 -80.08 145.54 32.38 Favored 'General case' 0 CA--C 1.549 0.908 0 O-C-N 121.224 -0.923 . . . . 0.0 111.044 170.658 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 80.8 mt -142.57 139.71 31.47 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.988 1.715 . . . . 0.0 110.069 173.78 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.0 t -151.65 145.77 25.32 Favored 'General case' 0 N--CA 1.471 0.604 0 O-C-N 121.316 -0.865 . . . . 0.0 112.056 -177.345 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 54.42 -124.22 30.5 Favored Glycine 0 CA--C 1.529 0.964 0 C-N-CA 124.549 1.071 . . . . 0.0 113.385 172.829 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 71.8 p -55.09 -35.61 64.77 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 124.892 1.277 . . . . 0.0 113.463 177.458 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 4.2 m80 -75.52 -37.18 60.25 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 121.503 -0.748 . . . . 0.0 111.112 -179.078 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 54.3 tp -64.98 -45.38 85.9 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 123.437 0.695 . . . . 0.0 111.308 171.573 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 22.2 t -59.37 -46.81 92.28 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.913 0 C-N-CA 124.747 1.219 . . . . 0.0 111.275 175.555 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -63.61 -43.52 96.63 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.315 0.646 . . . . 0.0 111.767 177.105 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.17 -44.35 96.81 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.35 0.66 . . . . 0.0 111.837 176.65 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 44.4 mt -58.76 -43.66 90.41 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 123.024 0.53 . . . . 0.0 111.635 175.808 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 20.4 m-85 -63.95 -43.68 95.1 Favored 'General case' 0 CA--C 1.544 0.717 0 O-C-N 121.343 -0.848 . . . . 0.0 112.629 174.2 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 76.5 mt -67.44 -41.28 85.0 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 123.674 0.79 . . . . 0.0 112.641 179.589 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 61.6 t -73.55 -46.96 46.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 124.359 1.064 . . . . 0.0 111.58 -178.159 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 58.8 m -98.9 -16.47 18.8 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 115.389 1.626 . . . . 0.0 115.389 -169.312 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 73.97 -148.5 39.73 Favored Glycine 0 CA--C 1.531 1.061 0 C-N-CA 124.309 0.957 . . . . 0.0 113.431 177.896 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 2.9 pm0 -67.02 -11.42 56.99 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.633 1.573 . . . . 0.0 114.541 -176.35 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 40.2 mtp180 -57.71 -36.03 71.45 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 125.02 1.328 . . . . 0.0 112.789 172.359 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.5 175.48 30.77 Favored Glycine 0 CA--C 1.529 0.928 0 C-N-CA 124.288 0.947 . . . . 0.0 113.663 -176.935 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 37.6 p90 -120.52 153.45 36.67 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.967 1.307 . . . . 0.0 113.064 -176.801 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 57.1 m-85 -127.59 38.55 4.03 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 127.74 2.416 . . . . 0.0 109.327 -179.119 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.84 151.1 43.27 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.899 1.68 . . . . 0.0 115.348 -170.405 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' B' B ' 27' ' ' THR . . . . . 0.461 ' HG1' ' N ' ' A' ' 2' ' ' ILE . 18.9 p -97.86 134.79 21.92 Favored Pre-proline 0 N--CA 1.473 0.7 0 C-N-CA 124.72 1.208 . . . . 0.0 111.76 -175.215 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -76.55 173.84 13.82 Favored 'Trans proline' 0 C--N 1.351 0.68 0 C-N-CA 124.442 3.428 . . . . 0.0 112.17 -175.093 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.546 0.794 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 173.619 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 10.8 tp . . . . . 0 N--CA 1.487 1.389 0 N-CA-C 113.951 1.093 . . . . 0.0 113.951 . . . . . . . . . 0 0 . 1 . 038 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 6.4 t -70.11 -21.11 23.49 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.276 0 C-N-CA 124.593 1.157 . . . . 0.0 112.682 -179.819 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -86.98 -48.03 8.46 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 123.784 0.834 . . . . 0.0 109.227 167.789 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 33.5 tt0 -65.33 -43.47 90.82 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 124.968 1.307 . . . . 0.0 113.87 -167.569 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 67.2 m -73.83 -12.7 60.76 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 113.545 0.942 . . . . 0.0 113.545 173.959 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 15.1 t -104.66 -43.55 5.1 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.955 1.302 . . . . 0.0 113.353 -168.863 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 81.5 p -85.84 -28.36 24.5 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 124.951 1.3 . . . . 0.0 112.279 175.328 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 5.5 t -126.39 -169.55 2.04 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.319 1.447 . . . . 0.0 111.035 170.107 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 6.5 tt -98.37 147.73 6.56 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.513 0 C-N-CA 125.08 1.352 . . . . 0.0 110.719 177.353 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 17.5 p -133.63 150.36 51.58 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 113.889 1.07 . . . . 0.0 113.889 -178.698 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 34.2 t -91.59 160.92 15.15 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 125.826 1.65 . . . . 0.0 112.276 178.195 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 10.0 mp -59.09 -29.18 67.16 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.357 1.063 . . . . 0.0 111.54 171.303 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 94.6 t80 -60.99 -37.72 83.47 Favored 'General case' 0 CA--C 1.54 0.56 0 O-C-N 121.55 -0.719 . . . . 0.0 112.786 171.546 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 37.0 mt-30 -74.73 -38.33 62.3 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 123.413 0.685 . . . . 0.0 110.45 177.618 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 95.5 mt -60.71 -43.77 97.4 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 123.467 0.707 . . . . 0.0 111.795 173.579 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -68.63 -35.28 77.09 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 113.518 0.932 . . . . 0.0 113.518 173.314 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -63.68 -32.18 73.58 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-N 119.535 1.061 . . . . 0.0 113.105 -177.627 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 41.4 m-85 -86.61 -1.97 58.11 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 124.786 1.234 . . . . 0.0 113.89 172.491 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 6.5 t -86.95 172.44 10.03 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 124.27 1.028 . . . . 0.0 112.542 171.47 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 19.8 m120 . . . . . 0 C--O 1.253 1.265 0 C-N-CA 125.68 1.592 . . . . 0.0 112.878 176.564 . . . . . . . . 0 0 . 1 . 038 nuclear nobuild core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 65.2 m-85 . . . . . 0 N--CA 1.489 1.51 0 N-CA-C 111.343 0.127 . . . . 0.0 111.343 . . . . . . . . . 0 0 . 1 . 038 nuclear nobuild core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 32.6 m -76.13 -6.11 8.32 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.388 0 C-N-CA 124.65 1.18 . . . . 0.0 114.08 -179.829 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 4.0 m120 -63.37 146.37 53.67 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.739 1.216 . . . . 0.0 113.036 -174.399 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 44.2 mt-30 -142.4 157.92 44.26 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.159 1.384 . . . . 0.0 111.868 -177.833 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 84.9 m-70 -95.03 126.47 40.39 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 108.166 -1.05 . . . . 0.0 108.166 167.197 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 54.5 mt -144.58 138.68 27.63 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 125.137 1.375 . . . . 0.0 109.862 -172.395 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 1.8 t -154.99 151.99 29.13 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 123.358 0.663 . . . . 0.0 111.664 -179.169 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 57.69 -133.11 52.8 Favored Glycine 0 CA--C 1.532 1.106 0 C-N-CA 124.336 0.969 . . . . 0.0 113.434 175.303 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 23.3 p -54.22 -43.22 70.62 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.734 1.214 . . . . 0.0 112.968 179.03 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 15.7 m-70 -67.15 -32.37 73.42 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 120.848 -1.157 . . . . 0.0 112.912 179.446 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 57.4 tp -68.91 -41.88 77.61 Favored 'General case' 0 N--CA 1.468 0.438 0 O-C-N 121.742 -0.599 . . . . 0.0 111.473 170.343 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 55.6 t -60.39 -44.59 96.4 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 CA-C-N 118.813 0.733 . . . . 0.0 110.864 175.457 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -58.4 -50.67 72.83 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 123.879 0.872 . . . . 0.0 111.354 172.049 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.91 -42.36 99.76 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.705 0.802 . . . . 0.0 112.432 -177.677 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 60.5 mt -57.73 -45.5 85.71 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 119.035 0.834 . . . . 0.0 111.087 175.399 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 25.8 m-85 -66.96 -41.0 87.65 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 118.868 0.758 . . . . 0.0 112.763 176.152 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 75.8 mt -67.42 -43.99 79.84 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 123.808 0.843 . . . . 0.0 112.417 178.793 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 67.7 t -76.68 -38.83 31.06 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 124.417 1.087 . . . . 0.0 111.749 -175.923 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 28.8 t -80.86 -26.22 37.1 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 113.266 0.839 . . . . 0.0 113.266 178.665 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 79.2 -153.85 38.12 Favored Glycine 0 CA--C 1.528 0.881 0 C-N-CA 124.731 1.158 . . . . 0.0 112.78 179.311 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -61.35 -14.29 26.23 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 115.196 1.554 . . . . 0.0 115.196 -174.228 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 49.8 mtp180 -54.22 -48.64 70.85 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 125.159 1.384 . . . . 0.0 112.24 171.192 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.74 145.85 0.9 Allowed Glycine 0 CA--C 1.533 1.21 0 C-N-CA 125.217 1.389 . . . . 0.0 112.604 -174.881 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 14.9 p90 -98.08 166.48 11.4 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 123.924 0.89 . . . . 0.0 112.2 175.797 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 69.9 t80 -151.87 119.36 6.03 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.356 1.462 . . . . 0.0 109.295 170.314 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 54.7 t80 -161.53 148.06 14.27 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 124.142 0.977 . . . . 0.0 112.39 -172.519 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 38.2 m -86.2 117.19 68.28 Favored Pre-proline 0 N--CA 1.474 0.733 0 C-N-CA 125.191 1.397 . . . . 0.0 109.639 178.103 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -74.63 165.58 31.26 Favored 'Trans proline' 0 CA--C 1.537 0.645 0 C-N-CA 123.375 2.717 . . . . 0.0 111.869 -176.84 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 64.4 pttt . . . . . 0 N--CA 1.477 0.894 0 N-CA-C 114.23 1.196 . . . . 0.0 114.23 -176.597 . . . . . . . . 0 0 . 1 . 039 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 8.5 tp . . . . . 0 N--CA 1.484 1.269 0 N-CA-C 116.257 1.947 . . . . 0.0 116.257 . . . . . . . . . 0 0 . 1 . 039 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 67.6 t -68.71 -43.49 82.99 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 CA-C-N 118.619 0.645 . . . . 0.0 112.253 -171.896 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -75.45 -38.22 59.82 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 118.109 0.413 . . . . 0.0 111.505 170.372 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 52.3 tt0 -67.24 -43.53 81.73 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 125.129 1.372 . . . . 0.0 113.587 -171.058 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 41.6 m -70.04 -20.4 63.25 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 173.166 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 23.1 t -99.36 -38.2 8.93 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 118.929 0.786 . . . . 0.0 112.592 -171.972 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 67.5 p -86.74 -20.46 27.64 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 125.496 1.518 . . . . 0.0 113.416 176.412 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.5 t -138.88 -170.68 2.91 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.238 1.415 . . . . 0.0 110.725 174.361 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 78.0 mt -91.58 135.31 27.38 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 C-N-CA 124.884 1.273 . . . . 0.0 108.987 176.229 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 15.2 p -121.97 -176.11 3.26 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.217 1.007 . . . . 0.0 112.016 172.189 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 95.7 p -143.48 165.39 27.68 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 125.046 1.339 . . . . 0.0 112.294 -172.671 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 43.0 mt -58.17 -33.23 69.01 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.238 0.615 . . . . 0.0 112.106 177.731 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 71.9 t80 -65.75 -28.94 69.4 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.139 0.976 . . . . 0.0 113.23 174.25 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 54.2 mt-30 -80.1 -32.7 39.15 Favored 'General case' 0 CA--C 1.538 0.483 0 O-C-N 121.509 -0.744 . . . . 0.0 111.321 173.175 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 91.0 mt -65.94 -44.32 85.43 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 118.888 0.767 . . . . 0.0 111.495 171.763 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.0 mm-40 -52.14 -38.04 56.31 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 125.661 1.584 . . . . 0.0 112.959 172.648 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.9 t30 -62.05 -24.38 67.05 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 113.373 0.879 . . . . 0.0 113.373 -178.64 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 79.0 m-85 -105.6 12.63 30.99 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.441 1.496 . . . . 0.0 113.929 179.456 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 78.3 m -82.14 164.58 21.2 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 123.855 0.862 . . . . 0.0 110.722 167.201 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 13.8 m120 . . . . . 0 C--O 1.254 1.295 0 CA-C-O 118.243 -0.884 . . . . 0.0 112.432 170.917 . . . . . . . . 0 0 . 1 . 039 nuclear nobuild core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 47.9 t80 . . . . . 0 N--CA 1.486 1.351 0 CA-C-O 119.705 -0.188 . . . . 0.0 110.612 . . . . . . . . . 0 0 . 1 . 039 nuclear nobuild core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 27.6 m -64.35 -24.4 35.58 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 N-CA-C 114.513 1.301 . . . . 0.0 114.513 -173.147 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 16.8 m120 -128.19 127.74 43.49 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 126.167 1.787 . . . . 0.0 109.095 169.825 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 3.3 tt0 -169.92 166.35 9.43 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 119.139 0.881 . . . . 0.0 112.948 -170.283 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 99.4 m-70 -85.97 142.74 28.58 Favored 'General case' 0 CA--C 1.549 0.931 0 N-CA-C 108.412 -0.959 . . . . 0.0 108.412 164.198 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 75.9 mt -145.73 126.75 14.6 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 126.092 1.757 . . . . 0.0 109.477 176.098 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 92.4 m -124.92 146.04 49.54 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 125.135 1.374 . . . . 0.0 111.253 179.474 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 45.95 -122.11 5.71 Favored Glycine 0 N--CA 1.473 1.127 0 C-N-CA 125.314 1.435 . . . . 0.0 115.021 168.568 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 67.8 p -52.42 -40.11 61.78 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 125.034 1.334 . . . . 0.0 113.301 -179.931 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 2.2 m80 -70.84 -37.92 73.18 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.217 -0.927 . . . . 0.0 111.019 -177.933 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 60.6 tp -66.11 -45.0 82.66 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.346 0.658 . . . . 0.0 111.49 171.915 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 53.2 t -61.54 -43.42 96.89 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 C-N-CA 123.802 0.841 . . . . 0.0 110.99 178.766 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -65.58 -41.66 92.64 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 118.767 0.712 . . . . 0.0 112.332 173.016 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.76 -41.79 96.14 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 119.667 1.122 . . . . 0.0 112.111 174.938 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 54.8 mt -61.21 -44.24 97.6 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 123.524 0.729 . . . . 0.0 111.317 173.627 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 13.9 m-30 -58.86 -43.41 90.84 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 119.495 1.043 . . . . 0.0 112.025 175.138 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 8.3 mp -67.46 -45.45 75.94 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 124.083 0.953 . . . . 0.0 112.427 177.28 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 45.5 t -69.4 -48.71 65.62 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 C-N-CA 123.351 0.661 . . . . 0.0 111.637 -178.506 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 62.6 m -70.6 -39.0 74.06 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 118.53 0.605 . . . . 0.0 112.281 -176.936 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.58 -137.76 42.38 Favored Glycine 0 CA--C 1.527 0.815 0 C-N-CA 124.281 0.944 . . . . 0.0 112.347 176.863 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -63.94 -15.84 60.09 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 114.549 1.314 . . . . 0.0 114.549 -177.861 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 91.6 mtm180 -67.1 -35.13 79.13 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 123.818 0.847 . . . . 0.0 112.727 175.994 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 94.44 154.2 30.8 Favored Glycine 0 CA--C 1.533 1.212 0 C-N-CA 125.34 1.448 . . . . 0.0 113.322 -172.401 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 53.7 p90 -93.41 153.84 18.28 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 125.946 1.698 . . . . 0.0 111.326 176.962 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 20.4 t80 -144.06 21.12 1.76 Allowed 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 124.302 1.041 . . . . 0.0 112.953 -173.483 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 17.3 p90 -65.89 147.25 53.66 Favored 'General case' 0 CA--C 1.55 0.951 0 O-C-N 120.715 -1.241 . . . . 0.0 113.181 178.067 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' B' B ' 27' ' ' THR . . . . . 0.583 ' H ' ' CD ' ' B' ' 28' ' ' PRO . 74.3 p -139.81 -26.98 0.01 OUTLIER Pre-proline 0 N--CA 1.479 1.009 0 CA-C-O 115.532 -2.175 . . . . 0.0 116.105 178.436 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . 0.583 ' CD ' ' H ' ' B' ' 27' ' ' THR . 94.5 Cg_exo -54.72 144.61 64.41 Favored 'Trans proline' 0 C--N 1.361 1.201 0 C-N-CA 122.969 2.446 . . . . 0.0 114.277 -177.207 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 58.0 tttt . . . . . 0 CA--C 1.557 1.235 0 C-N-CA 127.818 2.447 . . . . 0.0 116.509 178.992 . . . . . . . . 0 0 . 1 . 040 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 10.3 tp . . . . . 0 N--CA 1.481 1.109 0 N-CA-C 113.997 1.11 . . . . 0.0 113.997 . . . . . . . . . 0 0 . 1 . 040 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 9.9 p -64.82 -34.49 70.59 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.295 0 CA-C-N 119.54 1.064 . . . . 0.0 112.587 -176.338 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 26.6 pt-20 -71.57 -3.69 22.82 Favored 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 113.95 1.092 . . . . 0.0 113.95 174.472 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 53.6 tp60 -104.05 -58.62 1.85 Allowed 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.165 0.986 . . . . 0.0 109.042 167.906 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 58.9 m -68.99 -25.99 64.79 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 114.701 1.371 . . . . 0.0 114.701 -169.524 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 11.7 t -80.85 -39.89 25.76 Favored 'General case' 0 N--CA 1.472 0.631 0 O-C-N 121.57 -0.706 . . . . 0.0 112.22 -175.744 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 24.5 p -95.1 -31.09 13.72 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 126.238 1.815 . . . . 0.0 112.686 -177.498 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 10.7 t -129.35 -169.75 2.16 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.975 1.71 . . . . 0.0 110.761 178.27 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 33.2 mm -87.92 146.71 5.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 C-N-CA 125.049 1.34 . . . . 0.0 111.273 -174.381 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 4.1 m -124.27 159.23 30.69 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 122.637 1.208 . . . . 0.0 114.006 170.742 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 17.7 t -130.78 157.23 43.4 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 127.598 2.359 . . . . 0.0 110.533 173.884 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 17.5 mt -59.7 -26.05 65.28 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 114.284 1.216 . . . . 0.0 114.284 -169.552 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 92.7 t80 -59.8 -33.69 72.06 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 121.548 -0.72 . . . . 0.0 112.572 173.227 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 68.3 mt-30 -78.88 -32.48 45.91 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.768 1.227 . . . . 0.0 111.122 179.376 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -63.02 -50.48 70.51 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.755 0.822 . . . . 0.0 109.681 170.489 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -60.33 -33.54 72.54 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 113.499 0.925 . . . . 0.0 113.499 178.308 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 19.1 t-20 -61.16 -24.0 65.97 Favored 'General case' 0 CA--C 1.548 0.889 0 N-CA-C 114.146 1.165 . . . . 0.0 114.146 -177.577 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 58.7 m-85 -106.73 3.84 27.06 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.612 1.565 . . . . 0.0 114.132 179.081 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 89.4 m -84.34 165.75 17.99 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.112 0.965 . . . . 0.0 113.422 173.652 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.252 1.228 0 C-N-CA 125.28 1.432 . . . . 0.0 110.731 -176.342 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 78.4 t80 . . . . . 0 N--CA 1.489 1.495 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 . . . . . . . . . 0 0 . 1 . 040 nuclear nobuild core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 14.3 p -67.93 131.04 33.48 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.246 0 CA-C-N 119.085 0.857 . . . . 0.0 111.796 -176.294 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 19.1 t30 -166.83 102.15 0.56 Allowed 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.142 1.777 . . . . 0.0 108.143 -169.843 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -163.78 167.05 21.39 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 123.483 0.713 . . . . 0.0 111.664 -166.545 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 96.2 m-70 -70.79 146.18 49.91 Favored 'General case' 0 CA--C 1.549 0.916 0 O-C-N 121.06 -1.025 . . . . 0.0 111.489 168.918 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 74.5 mt -145.2 134.27 22.67 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 125.768 1.627 . . . . 0.0 109.848 174.113 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 5.5 t -148.08 153.11 38.47 Favored 'General case' 0 N--CA 1.47 0.553 0 O-C-N 121.198 -0.938 . . . . 0.0 112.76 179.366 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 54.18 -128.18 40.54 Favored Glycine 0 N--CA 1.471 0.99 0 C-N-CA 124.635 1.112 . . . . 0.0 113.54 172.68 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 76.4 p -53.13 -37.08 61.49 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 125.036 1.335 . . . . 0.0 113.065 177.436 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 5.3 m80 -74.88 -36.41 62.27 Favored 'General case' 0 CA--C 1.54 0.581 0 O-C-N 121.486 -0.759 . . . . 0.0 111.24 -178.851 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 56.1 tp -67.61 -43.99 79.11 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 123.304 0.642 . . . . 0.0 111.48 172.646 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 46.8 t -59.85 -46.65 93.54 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 C-N-CA 124.351 1.06 . . . . 0.0 110.659 175.437 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -63.3 -42.97 99.08 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.154 0.582 . . . . 0.0 111.462 175.561 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.15 -42.13 98.0 Favored 'General case' 0 CA--C 1.536 0.415 0 O-C-N 121.255 -0.903 . . . . 0.0 112.166 176.999 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 43.5 mt -59.08 -42.67 90.97 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 118.796 0.725 . . . . 0.0 111.219 175.736 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 36.9 m-85 -68.64 -37.4 79.66 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 113.554 0.946 . . . . 0.0 113.554 173.796 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 65.2 mt -67.77 -42.75 81.24 Favored 'General case' 0 N--CA 1.473 0.715 0 O-C-N 121.066 -1.021 . . . . 0.0 112.178 176.663 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 74.6 t -72.26 -48.92 46.3 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 124.484 1.114 . . . . 0.0 111.27 -179.271 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 61.9 m -97.82 -7.99 29.33 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 114.702 1.371 . . . . 0.0 114.702 -169.777 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 83.37 -161.32 38.99 Favored Glycine 0 N--CA 1.469 0.864 0 C-N-CA 125.451 1.501 . . . . 0.0 113.179 179.627 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 2.9 pm0 -63.92 -12.39 36.67 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.445 1.498 . . . . 0.0 114.167 -178.879 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 57.8 mtm180 -57.4 -38.16 73.84 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 124.923 1.289 . . . . 0.0 112.675 171.607 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 69.83 -150.47 49.27 Favored Glycine 0 CA--C 1.532 1.095 0 C-N-CA 124.171 0.891 . . . . 0.0 112.326 -172.302 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 53.5 p90 -141.42 155.81 45.84 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.988 1.315 . . . . 0.0 113.226 -170.206 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 74.2 t80 -90.03 -25.71 20.68 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.649 1.18 . . . . 0.0 113.12 -175.989 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 63.2 t80 -65.71 148.77 51.22 Favored 'General case' 0 CA--C 1.543 0.676 0 N-CA-C 114.765 1.395 . . . . 0.0 114.765 -173.034 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 20.8 p -115.66 114.92 42.0 Favored Pre-proline 0 N--CA 1.476 0.85 0 C-N-CA 126.042 1.737 . . . . 0.0 109.511 171.962 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -57.25 136.25 75.18 Favored 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 123.632 2.888 . . . . 0.0 112.719 178.279 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 19.9 ptmt . . . . . 0 CA--C 1.545 0.757 0 N-CA-C 114.004 1.112 . . . . 0.0 114.004 -178.478 . . . . . . . . 0 0 . 1 . 041 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . 0.534 ' N ' ' HG1' ' B' ' 27' ' ' THR . 18.1 tt . . . . . 0 N--CA 1.48 1.074 0 N-CA-C 114.675 1.361 . . . . 0.0 114.675 . . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 4.9 p -61.68 -26.91 41.02 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 C-N-CA 123.747 0.819 . . . . 0.0 112.411 178.827 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -73.0 -5.08 36.43 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.17 0.988 . . . . 0.0 112.649 177.099 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 24.2 tt0 -113.78 -56.64 2.38 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.265 1.026 . . . . 0.0 110.06 170.441 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 12.4 m -67.36 -24.1 65.67 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 115.393 1.627 . . . . 0.0 115.393 -173.361 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 34.5 t -91.73 -47.95 7.08 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 119.608 1.095 . . . . 0.0 112.214 -178.977 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 5.3 t -71.19 -29.95 65.8 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.429 1.092 . . . . 0.0 113.131 -178.946 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.2 t -131.76 -173.36 3.11 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.855 1.262 . . . . 0.0 111.231 175.758 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 61.8 mt -84.03 140.56 15.98 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 C-N-CA 124.639 1.176 . . . . 0.0 109.885 177.209 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 12.9 p -136.38 154.89 50.68 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 122.207 1.003 . . . . 0.0 113.165 170.136 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 8.4 t -119.04 173.09 7.11 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 126.047 1.739 . . . . 0.0 111.776 178.823 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 62.9 mt -56.46 -33.81 66.28 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.255 1.422 . . . . 0.0 112.946 -171.13 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 90.5 t80 -60.89 -34.61 74.9 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 123.817 0.847 . . . . 0.0 112.784 175.121 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -79.09 -28.84 43.08 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 124.527 1.131 . . . . 0.0 111.036 177.927 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 58.8 mt -67.29 -50.16 61.43 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 123.356 0.662 . . . . 0.0 110.404 170.466 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -63.9 -27.04 68.88 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.067 0.947 . . . . 0.0 113.147 178.129 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 17.6 t30 -61.35 -35.23 76.87 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 124.319 1.048 . . . . 0.0 113.292 -179.376 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 26.0 m-85 -81.21 -24.64 37.31 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 113.652 0.982 . . . . 0.0 113.652 177.479 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 69.2 m -71.83 149.34 45.33 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.051 1.34 . . . . 0.0 112.502 -178.689 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.251 1.165 0 C-N-CA 128.112 2.565 . . . . 0.0 112.439 -172.309 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 80.2 m-85 . . . . . 0 N--CA 1.487 1.4 0 CA-C-O 119.599 -0.238 . . . . 0.0 111.142 . . . . . . . . . 0 0 . 1 . 041 nuclear nobuild core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 22.7 t 86.82 -58.6 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.287 0 C-N-CA 129.077 2.951 . . . . 0.0 110.264 177.064 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 16.1 p-10 -86.03 104.06 15.29 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 123.317 0.647 . . . . 0.0 109.402 168.828 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -146.06 171.08 15.42 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.136 1.374 . . . . 0.0 111.412 -169.099 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 48.2 m-70 -80.82 138.64 36.23 Favored 'General case' 0 CA--C 1.549 0.912 0 O-C-N 121.044 -1.035 . . . . 0.0 108.923 167.113 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 30.8 mt -138.9 135.61 34.63 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 125.778 1.631 . . . . 0.0 109.335 175.305 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 1.8 t -141.63 148.82 39.8 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 -174.65 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 53.95 -135.37 43.2 Favored Glycine 0 N--CA 1.47 0.94 0 C-N-CA 124.765 1.174 . . . . 0.0 114.127 169.94 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 5.6 m -59.12 -26.3 64.58 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 177.008 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -70.24 -36.89 74.79 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 120.239 1.381 . . . . 0.0 111.77 174.123 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 53.1 tp -70.33 -42.11 72.34 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.058 0.943 . . . . 0.0 111.675 172.763 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 78.2 t -60.65 -42.52 92.13 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.888 0 C-N-CA 123.096 0.558 . . . . 0.0 110.628 174.381 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -67.77 -39.17 84.16 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.855 0.862 . . . . 0.0 112.301 175.239 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -57.96 -42.27 84.66 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 121.359 -0.838 . . . . 0.0 111.234 171.633 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 6.7 mp -65.36 -39.07 91.87 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 118.815 0.734 . . . . 0.0 112.137 173.787 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 22.0 m-30 -59.66 -39.91 86.02 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-N 119.71 1.141 . . . . 0.0 112.08 174.372 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 88.4 mt -74.34 -51.27 15.63 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.58 1.152 . . . . 0.0 111.961 178.145 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 76.2 t -75.79 -37.07 34.71 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 C-N-CA 124.221 1.008 . . . . 0.0 112.133 -171.43 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 72.2 m -105.89 19.41 20.58 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.496 1.119 . . . . 0.0 113.695 -176.2 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -58.06 -29.05 61.88 Favored Glycine 0 CA--C 1.535 1.296 0 CA-C-N 119.149 0.886 . . . . 0.0 113.97 -179.268 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -94.38 -33.36 13.19 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.93 1.292 . . . . 0.0 112.979 172.475 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 35.6 mmt180 -68.93 -28.62 66.82 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 124.156 0.982 . . . . 0.0 113.284 178.948 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 86.08 107.25 0.75 Allowed Glycine 0 CA--C 1.529 0.957 0 N-CA-C 108.81 -1.716 . . . . 0.0 108.81 -167.293 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 13.4 p90 -74.23 152.92 39.64 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 -177.466 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 86.6 t80 -151.34 80.12 1.3 Allowed 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 125.142 1.377 . . . . 0.0 108.702 177.452 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 43.4 p90 -79.89 141.69 35.88 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.285 1.434 . . . . 0.0 112.859 -176.443 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' B' B ' 27' ' ' THR . . . . . 0.534 ' HG1' ' N ' ' A' ' 2' ' ' ILE . 27.9 p -134.61 66.87 70.69 Favored Pre-proline 0 N--CA 1.477 0.9 0 C-N-CA 125.179 1.391 . . . . 0.0 113.142 -176.406 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -73.34 139.08 28.46 Favored 'Trans proline' 0 C--N 1.351 0.701 0 C-N-CA 123.06 2.507 . . . . 0.0 109.461 168.487 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 78.2 tttt . . . . . 0 CA--C 1.541 0.621 0 N-CA-C 113.26 0.837 . . . . 0.0 113.26 -170.24 . . . . . . . . 0 0 . 1 . 042 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 3.8 tt . . . . . 0 N--CA 1.48 1.069 0 N-CA-C 115.051 1.5 . . . . 0.0 115.051 . . . . . . . . . 0 0 . 1 . 042 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 3.9 p -62.03 -29.05 45.61 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.349 0 CA-C-N 121.325 1.875 . . . . 0.0 110.968 179.249 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -65.6 -10.37 34.97 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 126.254 1.822 . . . . 0.0 113.519 174.592 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 36.9 tt0 -111.29 -53.01 2.75 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.334 1.454 . . . . 0.0 109.9 169.152 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 85.2 m -60.73 -31.52 70.82 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 114.265 1.209 . . . . 0.0 114.265 -173.267 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 8.7 t -91.24 -20.82 21.51 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 113.253 0.835 . . . . 0.0 113.253 -173.894 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 30.0 p -104.14 -27.44 12.07 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 126.368 1.867 . . . . 0.0 112.715 179.988 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 10.3 t -144.01 -165.94 2.24 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.895 2.078 . . . . 0.0 110.163 -177.943 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 29.2 mm -87.65 144.23 9.66 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 C-N-CA 124.963 1.305 . . . . 0.0 110.804 178.082 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.8 p -138.44 179.07 6.68 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.518 1.527 . . . . 0.0 110.65 168.966 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 7.4 t -152.49 166.96 30.35 Favored 'General case' 0 N--CA 1.474 0.755 0 O-C-N 120.733 -1.23 . . . . 0.0 113.925 -174.045 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 26.9 mt -61.11 -34.48 75.02 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.647 1.579 . . . . 0.0 112.286 -170.625 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 87.1 t80 -60.74 -28.08 68.42 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.454 1.102 . . . . 0.0 112.993 175.553 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 41.8 mt-30 -82.96 -38.35 22.84 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 123.748 0.819 . . . . 0.0 111.23 173.276 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 84.9 mt -61.31 -34.5 75.34 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.908 0.883 . . . . 0.0 112.608 177.017 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -54.72 -32.21 59.33 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 113.423 0.898 . . . . 0.0 113.423 171.857 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 16.5 t-20 -68.18 -19.1 64.75 Favored 'General case' 0 CA--C 1.547 0.834 0 CA-C-N 118.92 0.782 . . . . 0.0 113.073 179.469 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 97.4 m-85 -98.1 4.55 49.13 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.568 1.547 . . . . 0.0 113.659 178.347 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 17.5 t -77.41 173.9 11.43 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 124.903 1.281 . . . . 0.0 111.312 168.481 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.049 0 C-N-CA 125.105 1.362 . . . . 0.0 111.531 169.634 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 75.8 m-85 . . . . . 0 N--CA 1.487 1.392 0 N-CA-C 107.757 -1.201 . . . . 0.0 107.757 . . . . . . . . . 0 0 . 1 . 042 nuclear nobuild core ' B' B ' 2' ' ' VAL . . . . . 0.47 HG12 ' H ' ' B' ' 3' ' ' ASN . 4.2 t 69.28 176.9 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.706 0 C-N-CA 125.42 1.488 . . . . 0.0 108.934 -168.167 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . 0.47 ' H ' HG12 ' B' ' 2' ' ' VAL . 7.2 p30 -62.24 131.9 50.94 Favored 'General case' 0 CA--C 1.546 0.811 0 O-C-N 120.357 -1.464 . . . . 0.0 111.533 174.523 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 70.4 mt-30 -160.75 173.42 15.44 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.968 1.307 . . . . 0.0 111.032 -169.345 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 99.3 m-70 -87.49 139.24 30.75 Favored 'General case' 0 CA--C 1.549 0.915 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 165.093 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 5.0 mp -143.03 145.48 32.95 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 124.969 1.308 . . . . 0.0 111.116 177.717 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 1.8 t -156.35 151.3 26.2 Favored 'General case' 0 N--CA 1.468 0.445 0 O-C-N 121.212 -0.93 . . . . 0.0 112.022 178.935 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 53.52 -129.49 40.9 Favored Glycine 0 N--CA 1.472 1.053 0 C-N-CA 124.326 0.965 . . . . 0.0 114.044 172.625 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.5 m -57.16 -31.99 65.95 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 124.481 1.113 . . . . 0.0 113.79 178.854 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -71.42 -38.08 71.42 Favored 'General case' 0 CA--C 1.544 0.737 0 O-C-N 120.983 -1.073 . . . . 0.0 111.492 176.164 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 42.4 tp -67.85 -41.29 83.14 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 123.485 0.714 . . . . 0.0 110.844 174.183 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 40.4 t -59.31 -45.86 92.88 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.975 0 C-N-CA 124.542 1.137 . . . . 0.0 111.306 172.599 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -63.09 -43.51 98.31 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.456 0.702 . . . . 0.0 111.447 177.033 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -65.13 -39.85 93.62 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 121.35 -0.844 . . . . 0.0 112.406 177.075 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 48.7 mt -61.18 -42.54 98.75 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 118.521 0.6 . . . . 0.0 111.351 174.098 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 17.0 m-85 -62.26 -41.54 98.54 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 119.079 0.854 . . . . 0.0 112.613 172.291 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 73.3 mt -67.25 -43.12 82.7 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 123.668 0.787 . . . . 0.0 112.193 178.498 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 55.1 t -72.53 -44.55 61.17 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 C-N-CA 123.896 0.878 . . . . 0.0 112.384 -179.149 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 35.5 t -82.86 -24.98 32.99 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 113.397 0.888 . . . . 0.0 113.397 -177.914 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 74.35 -155.23 48.59 Favored Glycine 0 CA--C 1.529 0.962 0 C-N-CA 124.65 1.119 . . . . 0.0 112.422 -178.334 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -62.69 -12.16 21.87 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 114.455 1.279 . . . . 0.0 114.455 179.471 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 56.1 mtp85 -61.3 -31.04 70.87 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.939 1.296 . . . . 0.0 112.683 175.007 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.39 139.48 1.5 Allowed Glycine 0 CA--C 1.533 1.218 0 C-N-CA 125.56 1.552 . . . . 0.0 112.945 -178.706 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 7.1 p90 -74.7 160.61 30.55 Favored 'General case' 0 CA--C 1.541 0.626 0 O-C-N 121.933 -0.745 . . . . 0.0 112.97 177.48 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 76.8 t80 -91.24 -27.67 18.3 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 125.21 1.404 . . . . 0.0 112.79 175.352 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 18.3 t80 -117.44 139.8 50.42 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 126.196 1.799 . . . . 0.0 113.069 -170.99 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 26.2 p -110.57 155.28 42.39 Favored Pre-proline 0 N--CA 1.478 0.926 0 C-N-CA 125.149 1.38 . . . . 0.0 108.54 167.509 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_exo -50.82 129.16 26.64 Favored 'Trans proline' 0 C--N 1.351 0.696 0 C-N-CA 123.558 2.839 . . . . 0.0 112.636 -177.06 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 7.0 mtmp? . . . . . 0 N--CA 1.482 1.159 0 C-N-CA 128.272 2.629 . . . . 0.0 113.452 179.946 . . . . . . . . 0 0 . 1 . 043 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 11.7 pt . . . . . 0 N--CA 1.487 1.392 0 N-CA-C 114.347 1.24 . . . . 0.0 114.347 . . . . . . . . . 0 0 . 1 . 043 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 7.1 p -57.84 -34.14 47.45 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 C-N-CA 124.973 1.309 . . . . 0.0 112.695 -174.977 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -70.38 -47.82 59.1 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 118.252 0.478 . . . . 0.0 110.863 172.172 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -71.2 -43.9 66.47 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.674 0.789 . . . . 0.0 111.837 -171.414 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 67.8 m -58.92 -28.34 66.12 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 123.991 0.916 . . . . 0.0 112.415 172.932 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 8.7 t -83.09 -54.33 5.12 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.706 0.803 . . . . 0.0 111.466 -178.86 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 81.3 p -77.66 -21.66 51.82 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 124.517 1.127 . . . . 0.0 113.739 -177.03 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.7 t -143.49 -165.39 2.08 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.386 1.474 . . . . 0.0 111.126 -178.508 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 37.6 mt -99.39 132.82 44.09 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 C-N-CA 125.295 1.438 . . . . 0.0 109.887 -174.531 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 7.8 p -132.8 159.19 40.48 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.247 1.019 . . . . 0.0 112.858 178.962 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 77.3 p -108.94 163.39 13.34 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 114.661 1.356 . . . . 0.0 114.661 -169.687 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 75.2 mt -59.55 -30.26 68.5 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 121.398 -0.814 . . . . 0.0 112.567 174.781 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 94.0 t80 -63.79 -33.43 75.64 Favored 'General case' 0 N--CA 1.473 0.688 0 O-C-N 121.383 -0.823 . . . . 0.0 112.603 173.802 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 58.3 mt-30 -74.1 -37.5 64.12 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 123.414 0.685 . . . . 0.0 110.868 173.617 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 41.2 mt -60.8 -43.74 97.76 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 118.336 0.516 . . . . 0.0 112.156 171.465 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -59.07 -38.91 80.55 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.033 0.933 . . . . 0.0 112.538 172.465 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 -65.1 -22.68 66.98 Favored 'General case' 0 CA--C 1.552 1.048 0 O-C-N 121.436 -0.79 . . . . 0.0 112.981 174.368 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -90.58 -1.81 57.88 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 125.953 1.701 . . . . 0.0 114.271 173.482 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 78.2 m -71.95 158.84 35.27 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 119.973 1.26 . . . . 0.0 112.112 171.418 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 . . . . . 0 C--O 1.255 1.35 0 C-N-CA 125.155 1.382 . . . . 0.0 113.497 179.669 . . . . . . . . 0 0 . 1 . 043 nuclear nobuild core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . 0.25 48.7 p90 . . . . . 0 N--CA 1.481 1.12 0 CA-C-O 117.107 -1.425 . . . . 0.0 113.267 . . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 3.5 p -176.29 -51.47 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 CA-C-N 121.228 1.831 . . . . 0.0 113.512 178.066 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 63.7 t30 -120.48 99.76 6.75 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 123.945 0.898 . . . . 0.0 110.158 -169.84 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 8.5 mt-30 -143.45 168.38 19.98 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 124.795 1.238 . . . . 0.0 113.056 -166.255 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 26.2 m-70 -77.54 135.34 38.19 Favored 'General case' 0 CA--C 1.549 0.926 0 N-CA-C 108.339 -0.985 . . . . 0.0 108.339 166.159 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 87.8 mt -144.1 128.51 17.93 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 125.961 1.704 . . . . 0.0 109.343 177.874 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 5.6 t -145.8 145.29 30.74 Favored 'General case' 0 N--CA 1.469 0.504 0 O-C-N 121.335 -0.853 . . . . 0.0 112.174 -179.495 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.08 -125.85 36.99 Favored Glycine 0 N--CA 1.469 0.842 0 C-N-CA 124.395 0.998 . . . . 0.0 113.354 175.926 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 28.9 p -56.4 -35.79 68.16 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.763 1.225 . . . . 0.0 113.448 178.487 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 94.8 m-70 -68.26 -39.71 82.11 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 120.78 -1.2 . . . . 0.0 111.945 176.872 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 38.4 tp -68.13 -42.7 79.8 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 123.734 0.813 . . . . 0.0 111.308 174.41 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 40.9 t -61.37 -42.21 92.82 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.973 0 C-N-CA 124.095 0.958 . . . . 0.0 111.315 174.878 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -63.93 -44.9 91.47 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 123.829 0.852 . . . . 0.0 111.528 174.537 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.79 -39.33 91.31 Favored 'General case' 0 CA--C 1.541 0.599 0 O-C-N 121.466 -0.771 . . . . 0.0 112.117 175.988 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 70.1 mt -66.08 -40.05 90.54 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 118.526 -0.749 . . . . 0.0 112.194 174.039 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 19.4 m-85 -60.18 -40.42 89.94 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 120.363 1.438 . . . . 0.0 112.236 170.943 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 81.0 mt -68.07 -44.69 75.73 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.632 0.773 . . . . 0.0 112.47 177.336 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 53.0 t -73.46 -47.82 44.03 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 123.725 0.81 . . . . 0.0 112.181 -179.258 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 56.7 m -80.84 -32.07 35.26 Favored 'General case' 0 N--CA 1.47 0.544 0 N-CA-C 113.227 0.825 . . . . 0.0 113.227 -174.205 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 66.75 -138.34 35.33 Favored Glycine 0 CA--C 1.53 1.0 0 C-N-CA 124.137 0.875 . . . . 0.0 111.999 -177.934 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -62.26 -21.39 65.15 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 124.775 1.23 . . . . 0.0 113.258 -178.684 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 89.4 mtm180 -61.79 -35.75 79.08 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.151 0.981 . . . . 0.0 112.939 178.326 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.68 -175.73 49.39 Favored Glycine 0 CA--C 1.533 1.21 0 C-N-CA 124.131 0.872 . . . . 0.0 113.033 -171.232 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 2.0 p90 -130.03 167.68 17.91 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.146 1.378 . . . . 0.0 114.48 -170.442 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 58.1 t80 -93.38 1.53 56.87 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 127.303 2.241 . . . . 0.0 113.125 176.837 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 76.7 t80 -52.05 141.46 18.2 Favored 'General case' 0 CA--C 1.546 0.798 0 N-CA-C 115.753 1.761 . . . . 0.0 115.753 -171.902 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -162.97 127.37 1.96 Allowed Pre-proline 0 N--CA 1.47 0.573 0 C-N-CA 127.347 2.259 . . . . 0.0 108.0 170.463 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -70.5 145.66 53.47 Favored 'Trans proline' 0 C--N 1.35 0.641 0 C-N-CA 123.2 2.6 . . . . 0.0 113.434 -169.033 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 35.9 mmtm . . . . . 0 CA--C 1.55 0.952 0 C-N-CA 125.579 1.552 . . . . 0.0 113.056 173.481 . . . . . . . . 0 0 . 1 . 044 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . 0.576 ' N ' ' HG1' ' B' ' 27' ' ' THR . 9.6 tp . . . . . 0 N--CA 1.475 0.795 0 N-CA-C 113.647 0.981 . . . . 0.0 113.647 . . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 41.5 t -68.49 -35.33 70.03 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.107 0 CA-C-N 120.02 1.282 . . . . 0.0 111.092 -172.625 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.3 pm0 -69.97 -9.9 56.74 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 113.64 0.978 . . . . 0.0 113.64 174.884 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 60.5 mt-30 -93.96 -58.48 2.23 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 118.706 0.684 . . . . 0.0 109.199 169.716 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 86.7 m -76.42 -27.93 56.44 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 115.689 1.736 . . . . 0.0 115.689 -169.395 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 16.3 t -85.41 -49.51 8.05 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 118.404 0.547 . . . . 0.0 110.726 179.65 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 15.3 m -64.75 -38.23 90.29 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 126.248 1.819 . . . . 0.0 111.924 -178.197 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 65.8 m -142.92 -176.0 4.73 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 125.592 1.557 . . . . 0.0 111.405 -173.898 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 95.6 mt -79.38 122.77 35.27 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 O-C-N 120.252 -1.53 . . . . 0.0 108.174 168.057 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 20.8 p -100.77 157.08 16.97 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.934 0.893 . . . . 0.0 111.407 170.627 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 37.5 t -79.97 152.9 29.25 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 120.948 -1.095 . . . . 0.0 112.067 175.51 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.432 HD22 ' H ' ' A' ' 13' ' ' LEU . 2.6 mm? -62.11 -28.43 69.62 Favored 'General case' 0 CA--C 1.543 0.709 0 O-C-N 121.038 -1.039 . . . . 0.0 110.721 170.77 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.7 t80 -66.8 -30.96 71.28 Favored 'General case' 0 CA--C 1.542 0.654 0 O-C-N 121.324 -0.86 . . . . 0.0 112.996 170.435 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 94.7 mt-30 -76.16 -33.96 59.37 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 121.453 -0.779 . . . . 0.0 110.879 175.361 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 93.9 mt -59.2 -49.87 76.19 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 119.192 0.906 . . . . 0.0 110.19 168.479 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -62.79 -29.5 70.75 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 114.249 1.203 . . . . 0.0 114.249 176.48 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -63.01 -24.83 68.1 Favored 'General case' 0 CA--C 1.548 0.868 0 CA-C-N 119.527 1.058 . . . . 0.0 113.012 -179.306 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 52.9 m-85 -95.15 2.95 55.16 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.427 1.491 . . . . 0.0 113.624 173.732 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 95.4 m -103.76 124.72 49.41 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 121.218 -0.926 . . . . 0.0 112.966 179.753 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.252 1.225 0 C-N-CA 127.254 2.221 . . . . 0.0 112.843 -169.262 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 45.6 p90 . . . . . 0 N--CA 1.485 1.294 0 CA-C-O 119.745 -0.169 . . . . 0.0 110.887 . . . . . . . . . 0 0 . 1 . 044 nuclear nobuild core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 22.4 m -138.03 151.14 25.08 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 C-N-CA 124.983 1.313 . . . . 0.0 111.093 171.638 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 60.8 t30 -77.92 179.69 6.58 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 124.233 1.013 . . . . 0.0 111.61 170.447 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 15.8 mp0 -107.68 169.89 8.32 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.828 1.651 . . . . 0.0 110.914 177.838 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 15.1 m-70 -71.28 139.62 50.05 Favored 'General case' 0 CA--C 1.545 0.763 0 O-C-N 121.376 -0.827 . . . . 0.0 109.013 167.481 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 73.7 mt -135.03 126.23 28.09 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 125.478 1.511 . . . . 0.0 108.875 179.699 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.6 t -144.36 150.02 37.1 Favored 'General case' 0 N--CA 1.47 0.538 0 O-C-N 121.691 -0.63 . . . . 0.0 112.02 -176.903 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 56.83 -128.79 47.94 Favored Glycine 0 CA--C 1.529 0.908 0 C-N-CA 124.344 0.973 . . . . 0.0 113.588 174.244 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 26.5 p -56.43 -37.48 70.27 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.853 1.261 . . . . 0.0 113.044 177.516 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 68.4 m-70 -73.51 -29.26 62.37 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 119.615 1.098 . . . . 0.0 112.689 177.452 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 39.5 tp -71.93 -42.42 66.7 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 121.144 -0.973 . . . . 0.0 111.402 170.654 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 21.7 t -57.64 -47.91 84.48 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 C-N-CA 124.285 1.034 . . . . 0.0 110.896 171.286 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -58.37 -47.56 83.42 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.542 1.537 . . . . 0.0 111.677 174.589 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.86 -43.68 98.14 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 118.671 0.669 . . . . 0.0 112.21 177.778 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 44.8 mt -61.04 -42.75 99.06 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 118.619 0.645 . . . . 0.0 111.454 176.384 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 16.8 m-85 -61.22 -45.28 95.22 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.046 0.839 . . . . 0.0 112.491 172.776 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 78.2 mt -68.06 -42.6 80.21 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.788 0.835 . . . . 0.0 112.966 -179.5 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 54.6 t -73.99 -44.69 50.44 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 124.524 1.13 . . . . 0.0 111.606 -178.079 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 65.9 m -99.71 -18.93 17.01 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 114.984 1.475 . . . . 0.0 114.984 -169.896 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 61.72 -133.07 47.11 Favored Glycine 0 CA--C 1.533 1.158 0 CA-C-N 118.973 0.806 . . . . 0.0 112.633 177.571 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 5.3 pm0 -66.93 -11.97 58.05 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.7 1.6 . . . . 0.0 115.223 -176.799 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 69.8 mtp180 -60.22 -38.01 82.05 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.859 0.863 . . . . 0.0 112.478 176.134 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.62 166.62 9.6 Favored Glycine 0 CA--C 1.536 1.362 0 C-N-CA 124.087 0.851 . . . . 0.0 112.364 -170.393 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 47.6 p90 -130.83 147.79 52.53 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.019 1.328 . . . . 0.0 112.98 -174.479 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 39.4 t80 -94.37 91.43 6.68 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 125.789 1.636 . . . . 0.0 109.457 172.424 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 15.9 t80 -71.36 127.81 33.82 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 121.718 -0.614 . . . . 0.0 111.597 -177.156 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' B' B ' 27' ' ' THR . . . . . 0.576 ' HG1' ' N ' ' A' ' 2' ' ' ILE . 3.9 p -136.83 108.02 9.06 Favored Pre-proline 0 N--CA 1.477 0.908 0 C-N-CA 124.974 1.31 . . . . 0.0 110.394 -172.934 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -81.87 170.96 13.51 Favored 'Trans proline' 0 C--N 1.355 0.881 0 C-N-CA 124.481 3.454 . . . . 0.0 113.654 -170.355 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 27.4 mtpp . . . . . 0 N--CA 1.478 0.937 0 C-N-CA 124.529 1.132 . . . . 0.0 113.917 176.064 . . . . . . . . 0 0 . 1 . 045 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 20.1 tt . . . . . 0 N--CA 1.483 1.219 0 N-CA-C 112.474 0.546 . . . . 0.0 112.474 . . . . . . . . . 0 0 . 1 . 045 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . 0.562 HG21 ' HA ' ' B' ' 28' ' ' PRO . 58.0 t -58.74 -44.92 91.18 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.058 0 C-N-CA 124.367 1.067 . . . . 0.0 110.408 -177.003 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.0 pm0 -66.63 -11.31 53.08 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.633 1.573 . . . . 0.0 113.819 177.671 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 26.3 mm100 -95.27 -53.11 3.9 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.457 1.103 . . . . 0.0 109.561 168.833 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 84.8 m -61.06 -34.91 75.64 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.939 1.296 . . . . 0.0 114.153 -174.749 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 72.7 m -72.79 -46.08 55.17 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 121.244 -0.91 . . . . 0.0 111.147 174.995 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 21.7 m -77.15 -32.33 56.23 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 126.723 2.009 . . . . 0.0 112.849 -170.442 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.4 t -150.91 -168.96 3.25 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 126.069 1.748 . . . . 0.0 110.865 -176.167 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 62.5 mt -79.45 136.08 24.35 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 O-C-N 120.681 -1.262 . . . . 0.0 110.322 175.658 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.6 p -127.28 160.69 30.56 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.311 1.044 . . . . 0.0 112.402 173.731 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 33.5 t -101.26 154.02 19.12 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 114.194 1.183 . . . . 0.0 114.194 -168.848 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 32.2 mt -62.21 -30.64 71.23 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.139 0.976 . . . . 0.0 111.702 174.121 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 87.5 t80 -61.6 -34.72 76.12 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 123.695 0.798 . . . . 0.0 112.716 171.985 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 58.8 mt-30 -72.1 -43.74 64.31 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.423 0.689 . . . . 0.0 109.797 176.363 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 95.3 mt -57.23 -49.45 76.0 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 122.979 0.512 . . . . 0.0 111.734 174.411 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -62.77 -28.35 69.92 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 113.243 0.831 . . . . 0.0 113.243 178.166 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -81.19 -38.94 26.24 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 124.221 1.008 . . . . 0.0 112.942 179.039 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 20.7 m-85 -84.58 -6.46 59.37 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 114.55 1.315 . . . . 0.0 114.55 179.64 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 39.4 t -70.72 174.38 6.05 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 124.45 1.1 . . . . 0.0 112.07 168.076 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 14.6 t-20 . . . . . 0 C--O 1.251 1.178 0 C-N-CA 125.304 1.442 . . . . 0.0 113.313 -176.645 . . . . . . . . 0 0 . 1 . 045 nuclear nobuild core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 34.1 t80 . . . . . 0 N--CA 1.487 1.381 0 CA-C-O 119.884 -0.103 . . . . 0.0 111.017 . . . . . . . . . 0 0 . 1 . 045 nuclear nobuild core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 19.1 t -79.37 -19.92 12.6 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.362 0 O-C-N 120.784 -1.198 . . . . 0.0 113.049 -169.75 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 24.2 t30 -60.92 94.85 0.03 OUTLIER 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 125.586 1.554 . . . . 0.0 111.424 174.955 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -153.03 -170.69 3.7 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 126.415 1.886 . . . . 0.0 110.516 -168.804 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 19.9 m-70 -75.3 146.26 41.14 Favored 'General case' 0 CA--C 1.546 0.814 0 O-C-N 120.846 -1.159 . . . . 0.0 109.54 167.442 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 61.2 mt -146.5 133.02 19.73 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 126.535 1.934 . . . . 0.0 109.201 174.874 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.1 t -145.46 150.47 36.56 Favored 'General case' 0 N--CA 1.468 0.438 0 O-C-N 121.189 -0.944 . . . . 0.0 113.013 179.928 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 57.04 -129.99 50.29 Favored Glycine 0 N--CA 1.469 0.884 0 C-N-CA 124.929 1.252 . . . . 0.0 113.864 172.4 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 17.4 p -54.72 -43.28 72.46 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 124.348 1.059 . . . . 0.0 112.409 175.566 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -65.48 -34.83 79.19 Favored 'General case' 0 CA--C 1.542 0.666 0 O-C-N 121.117 -0.989 . . . . 0.0 112.256 178.919 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 62.2 tp -67.34 -44.87 78.03 Favored 'General case' 0 C--O 1.222 -0.371 0 CA-C-O 118.033 -0.984 . . . . 0.0 111.259 171.203 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 54.3 t -62.24 -43.41 97.93 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.078 0 CA-C-N 119.643 1.111 . . . . 0.0 111.25 178.975 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.1 mm-40 -60.79 -51.28 70.01 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 123.689 0.795 . . . . 0.0 111.224 173.8 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.89 -43.44 92.9 Favored 'General case' 0 CA--C 1.534 0.339 0 O-C-N 121.551 -0.718 . . . . 0.0 111.934 -177.5 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 62.0 tp -55.25 -47.14 75.85 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 125.339 1.456 . . . . 0.0 111.184 177.697 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -72.69 -39.34 67.12 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 119.134 0.879 . . . . 0.0 112.365 177.996 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 74.9 mt -66.92 -41.21 87.44 Favored 'General case' 0 N--CA 1.474 0.754 0 CA-C-N 118.95 0.796 . . . . 0.0 112.816 179.845 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 54.7 t -68.39 -34.86 68.17 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 C-N-CA 124.992 1.317 . . . . 0.0 111.566 176.33 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 42.7 t -80.97 -34.07 33.38 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 114.261 1.208 . . . . 0.0 114.261 -179.15 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 86.03 -145.34 20.64 Favored Glycine 0 CA--C 1.533 1.182 0 C-N-CA 125.197 1.38 . . . . 0.0 113.42 179.786 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -59.27 -22.75 61.63 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 126.232 1.813 . . . . 0.0 114.593 -169.593 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 71.3 mtp180 -52.33 -38.33 58.36 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 125.419 1.487 . . . . 0.0 113.176 175.496 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.04 148.84 3.02 Favored Glycine 0 CA--C 1.533 1.186 0 C-N-CA 125.101 1.334 . . . . 0.0 112.263 -174.085 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 27.2 p90 -71.56 168.29 17.92 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 113.993 1.108 . . . . 0.0 113.993 -175.079 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 73.5 t80 -136.96 -60.34 0.69 Allowed 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.854 1.262 . . . . 0.0 111.96 -177.486 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 15.6 t80 -74.16 114.15 12.17 Favored 'General case' 0 CA--C 1.546 0.814 0 O-C-N 121.75 -0.594 . . . . 0.0 112.373 -172.672 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 23.3 p -78.29 155.43 79.37 Favored Pre-proline 0 N--CA 1.48 1.029 0 C-N-CA 125.85 1.66 . . . . 0.0 112.167 -178.686 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . 0.562 ' HA ' HG21 ' A' ' 3' ' ' VAL . 60.1 Cg_endo -73.27 108.04 2.52 Favored 'Trans proline' 0 C--N 1.352 0.723 0 C-N-CA 123.537 2.825 . . . . 0.0 111.47 -176.88 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt . . . . . 0 CA--C 1.541 0.629 0 N-CA-C 114.223 1.194 . . . . 0.0 114.223 -169.69 . . . . . . . . 0 0 . 1 . 046 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 11.3 tt . . . . . 0 N--CA 1.479 0.988 0 N-CA-C 113.042 0.756 . . . . 0.0 113.042 . . . . . . . . . 0 0 . 1 . 046 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 9.8 p -68.78 -28.12 38.58 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 O-C-N 121.64 -0.662 . . . . 0.0 111.827 -176.596 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 37.2 mp0 -68.75 -12.9 61.99 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 123.853 0.861 . . . . 0.0 113.045 173.018 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 5.5 tp60 -97.99 -58.35 2.0 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.022 0.929 . . . . 0.0 110.347 169.199 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 34.7 m -70.77 -27.13 63.69 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 114.675 1.361 . . . . 0.0 114.675 -170.095 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 10.6 t -81.28 -38.8 26.24 Favored 'General case' 0 N--CA 1.472 0.646 0 O-C-N 120.868 -1.145 . . . . 0.0 111.105 175.288 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 28.7 m -69.61 -38.99 77.49 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 126.881 2.072 . . . . 0.0 112.586 -177.614 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 21.5 m -143.52 166.41 24.88 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 124.711 1.205 . . . . 0.0 111.304 -178.035 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 70.0 mt -58.93 128.78 20.2 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 O-C-N 121.129 -0.982 . . . . 0.0 109.326 169.447 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 15.1 p -120.37 154.6 34.86 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 122.066 0.936 . . . . 0.0 112.29 175.926 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 47.4 t -98.01 153.85 18.1 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 124.497 1.119 . . . . 0.0 112.621 -174.103 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 10.7 mp -61.61 -26.94 68.3 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.861 0.864 . . . . 0.0 111.503 174.21 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 93.5 t80 -59.31 -37.92 78.95 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 123.574 0.75 . . . . 0.0 112.669 169.582 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 68.9 mt-30 -75.62 -39.81 57.3 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 124.155 0.982 . . . . 0.0 110.567 178.418 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 78.6 mt -58.68 -53.76 54.71 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.128 0.971 . . . . 0.0 111.201 172.702 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -66.13 -30.34 70.82 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 -179.98 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 20.1 t30 -66.15 -33.03 74.84 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 118.927 0.785 . . . . 0.0 112.326 172.678 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -73.96 -33.23 63.8 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.03 0.932 . . . . 0.0 112.652 172.856 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 87.5 m -71.17 177.15 3.97 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 125.451 1.5 . . . . 0.0 114.655 176.866 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 31.2 m120 . . . . . 0 C--O 1.256 1.431 0 C-N-CA 125.549 1.54 . . . . 0.0 112.021 170.44 . . . . . . . . 0 0 . 1 . 046 nuclear nobuild core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 41.2 t80 . . . . . 0 N--CA 1.487 1.41 0 CA-C-O 119.549 -0.262 . . . . 0.0 111.044 . . . . . . . . . 0 0 . 1 . 046 nuclear nobuild core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 27.4 m -75.32 -36.37 36.08 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.42 0 O-C-N 121.209 -0.932 . . . . 0.0 113.366 -174.785 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -84.02 104.63 14.24 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.673 1.189 . . . . 0.0 108.022 169.268 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -169.73 -177.11 2.58 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.712 1.205 . . . . 0.0 110.336 -167.905 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 26.2 m-70 -71.83 136.74 47.14 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 164.472 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 84.4 mt -138.84 128.83 25.21 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 126.142 1.777 . . . . 0.0 109.176 -179.831 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.3 t -141.48 133.67 27.89 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 112.77 0.656 . . . . 0.0 112.77 -171.407 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 60.05 -126.88 42.81 Favored Glycine 0 CA--C 1.528 0.845 0 C-N-CA 124.361 0.982 . . . . 0.0 113.241 175.059 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 18.8 m -55.21 -32.81 62.53 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.281 1.032 . . . . 0.0 113.069 177.769 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 32.4 m80 -68.46 -39.0 81.58 Favored 'General case' 0 CA--C 1.542 0.662 0 O-C-N 121.043 -1.036 . . . . 0.0 111.732 177.465 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 32.1 tp -71.38 -41.26 69.87 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 124.255 1.022 . . . . 0.0 111.086 175.618 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 64.5 t -60.74 -43.29 94.86 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 123.597 0.759 . . . . 0.0 110.953 173.004 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -64.66 -41.77 95.86 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 123.643 0.777 . . . . 0.0 111.922 174.305 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.37 -45.26 94.14 Favored 'General case' 0 CA--C 1.535 0.399 0 O-C-N 121.568 -0.708 . . . . 0.0 111.483 174.396 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 51.6 mt -58.69 -44.1 90.19 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 123.627 0.771 . . . . 0.0 111.838 174.893 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 4.6 m-85 -56.01 -50.77 69.96 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.514 0.726 . . . . 0.0 112.126 172.593 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 8.4 mp -71.03 -42.23 69.79 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 123.522 0.729 . . . . 0.0 112.649 -176.573 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 69.2 t -76.02 -40.19 37.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 C-N-CA 124.624 1.17 . . . . 0.0 111.886 -174.224 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 58.5 m -95.61 -18.21 20.74 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 113.697 0.999 . . . . 0.0 113.697 -174.828 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 62.45 -140.32 46.19 Favored Glycine 0 CA--C 1.532 1.136 0 C-N-CA 124.761 1.172 . . . . 0.0 114.073 168.928 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -68.22 -13.95 62.62 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 124.951 1.3 . . . . 0.0 114.153 -174.111 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 57.0 mtm-85 -67.68 -26.08 66.01 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 123.867 0.867 . . . . 0.0 112.663 176.662 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.2 168.38 44.21 Favored Glycine 0 CA--C 1.531 1.051 0 C-N-CA 125.059 1.314 . . . . 0.0 112.908 -171.458 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 39.9 p90 -135.02 170.6 15.66 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.267 1.427 . . . . 0.0 112.437 -179.199 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 65.6 t80 -129.52 148.87 51.46 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.344 1.458 . . . . 0.0 110.169 172.021 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 63.2 t80 -156.8 125.21 5.7 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.743 1.217 . . . . 0.0 110.956 -174.437 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 50.3 m -152.17 124.41 3.92 Favored Pre-proline 0 N--CA 1.474 0.753 0 C-N-CA 124.869 1.268 . . . . 0.0 109.782 177.534 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -84.39 161.44 12.97 Favored 'Trans proline' 0 CA--C 1.536 0.618 0 C-N-CA 123.937 3.091 . . . . 0.0 111.056 169.401 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 58.2 tptt . . . . . 0 CA--C 1.546 0.794 0 C-N-CA 124.308 1.043 . . . . 0.0 113.245 177.522 . . . . . . . . 0 0 . 1 . 047 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 19.4 tt . . . . . 0 N--CA 1.479 0.995 0 N-CA-C 112.756 0.651 . . . . 0.0 112.756 . . . . . . . . . 0 0 . 1 . 047 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 13.4 p -63.07 -31.91 54.31 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.129 0 CA-C-N 119.156 0.889 . . . . 0.0 112.523 -176.177 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 6.0 pm0 -72.46 -5.09 34.29 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.854 1.261 . . . . 0.0 113.618 175.768 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 47.2 tp60 -107.82 -52.83 2.71 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.257 1.423 . . . . 0.0 109.211 168.183 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 95.3 m -59.59 -35.1 73.63 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 114.238 1.199 . . . . 0.0 114.238 -175.423 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 19.0 t -82.74 -33.11 27.56 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 113.14 0.793 . . . . 0.0 113.14 -172.689 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 27.5 p -100.48 -26.85 13.71 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 126.388 1.875 . . . . 0.0 112.875 -175.701 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.7 t -138.98 -160.74 1.1 Allowed 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 126.114 1.766 . . . . 0.0 110.137 179.632 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 72.1 mt -97.81 140.03 18.8 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.71 0 O-C-N 120.546 -1.347 . . . . 0.0 110.109 -177.535 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 15.1 p -134.51 161.85 33.91 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 124.595 1.158 . . . . 0.0 112.66 173.983 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 60.1 p -109.16 165.64 11.45 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 115.174 1.546 . . . . 0.0 115.174 -170.647 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 11.0 mp -65.3 -30.25 71.09 Favored 'General case' 0 N--CA 1.47 0.549 0 O-C-N 121.454 -0.779 . . . . 0.0 111.726 171.831 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 80.1 t80 -63.63 -31.73 72.99 Favored 'General case' 0 CA--C 1.543 0.698 0 O-C-N 121.462 -0.774 . . . . 0.0 112.717 172.54 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 84.9 mt-30 -75.4 -36.34 60.86 Favored 'General case' 0 CA--C 1.537 0.46 0 O-C-N 121.483 -0.761 . . . . 0.0 111.495 172.593 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 86.7 mt -62.11 -42.11 98.9 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 119.374 0.988 . . . . 0.0 111.866 171.778 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -58.61 -27.11 64.37 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.748 1.219 . . . . 0.0 113.807 176.856 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.8 t30 -59.24 -28.01 66.3 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-N 119.125 0.875 . . . . 0.0 113.27 179.155 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 82.2 m-85 -100.55 6.98 44.33 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.508 1.523 . . . . 0.0 113.959 -178.522 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 54.2 m -89.39 153.42 20.86 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.194 0.998 . . . . 0.0 112.573 172.814 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.254 1.313 0 C-N-CA 126.589 1.956 . . . . 0.0 112.349 178.679 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . 0.263 12.0 p90 . . . . . 0 N--CA 1.486 1.352 0 CA-C-O 118.45 -0.786 . . . . 0.0 110.591 . . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 73.1 t -82.36 142.58 13.45 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.287 0 CA-C-N 120.203 1.365 . . . . 0.0 110.079 171.541 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -158.14 147.5 19.57 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 126.039 1.736 . . . . 0.0 112.551 177.57 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -162.54 170.62 18.32 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.825 1.25 . . . . 0.0 111.644 -170.304 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 96.6 m-70 -80.01 139.3 37.04 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 108.334 -0.988 . . . . 0.0 108.334 165.389 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 83.1 mt -148.76 133.81 18.19 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 125.24 1.416 . . . . 0.0 110.367 -179.581 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.6 t -152.36 147.64 26.54 Favored 'General case' 0 N--CA 1.473 0.693 0 O-C-N 121.112 -0.993 . . . . 0.0 113.078 178.183 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 57.88 -129.97 50.32 Favored Glycine 0 CA--C 1.528 0.861 0 C-N-CA 124.517 1.056 . . . . 0.0 112.79 176.174 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.4 m -54.29 -32.36 56.18 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 124.784 1.233 . . . . 0.0 113.335 177.46 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 24.0 m80 -70.81 -41.06 72.09 Favored 'General case' 0 CA--C 1.539 0.52 0 O-C-N 121.33 -0.857 . . . . 0.0 111.628 178.24 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 52.2 tp -67.84 -44.84 76.25 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 123.796 0.839 . . . . 0.0 110.52 174.395 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 25.6 t -56.37 -44.94 81.29 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.99 0 C-N-CA 124.499 1.12 . . . . 0.0 111.22 173.804 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -63.99 -41.77 97.41 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.174 0.59 . . . . 0.0 111.903 174.376 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.34 -41.0 98.21 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 118.881 0.764 . . . . 0.0 112.495 176.05 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -60.6 -46.26 90.93 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 119.234 0.925 . . . . 0.0 111.047 171.084 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 21.5 m-85 -61.81 -34.86 76.68 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 119.978 1.263 . . . . 0.0 113.137 176.117 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 71.9 mt -70.71 -43.99 67.84 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 123.783 0.833 . . . . 0.0 112.195 175.359 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 72.0 t -75.86 -40.9 39.31 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 CA-C-N 118.634 0.652 . . . . 0.0 112.021 -178.057 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 50.8 m -85.2 -23.31 28.35 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 114.011 1.115 . . . . 0.0 114.011 -179.104 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 79.53 -162.47 47.47 Favored Glycine 0 CA--C 1.53 0.999 0 C-N-CA 124.85 1.214 . . . . 0.0 112.673 -173.801 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -61.98 -11.84 15.44 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 125.053 1.341 . . . . 0.0 114.513 -178.58 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 87.9 mtm180 -60.02 -27.54 66.99 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 125.04 1.336 . . . . 0.0 113.537 173.786 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.05 -167.01 54.2 Favored Glycine 0 CA--C 1.533 1.182 0 C-N-CA 124.224 0.916 . . . . 0.0 112.05 -169.727 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 22.9 p90 -138.94 157.65 45.64 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.713 1.205 . . . . 0.0 113.969 -169.871 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 59.4 t80 -87.66 -14.46 39.91 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 126.265 1.826 . . . . 0.0 113.098 174.029 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 18.4 t80 -54.2 143.97 21.31 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 125.285 1.434 . . . . 0.0 113.562 178.27 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 15.3 t -153.89 141.21 13.46 Favored Pre-proline 0 CA--C 1.541 0.632 0 C-N-CA 127.382 2.273 . . . . 0.0 108.335 172.717 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -68.65 152.95 74.27 Favored 'Trans proline' 0 C--N 1.35 0.631 0 C-N-CA 122.637 2.225 . . . . 0.0 112.708 -171.923 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.549 0.942 0 N-CA-C 114.691 1.367 . . . . 0.0 114.691 -174.432 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 11.0 tp . . . . . 0 N--CA 1.485 1.297 0 N-CA-C 114.031 1.123 . . . . 0.0 114.031 . . . . . . . . . 0 0 . 1 . 048 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 70.3 t -57.53 -52.87 51.73 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.331 0 C-N-CA 124.622 1.169 . . . . 0.0 110.096 -177.876 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 25.6 pt-20 -66.55 0.76 2.05 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 125.468 1.507 . . . . 0.0 114.968 -179.098 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 17.9 tt0 -115.9 -50.81 2.67 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 119.097 0.862 . . . . 0.0 111.365 168.725 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 58.8 m -60.97 -28.41 68.98 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 114.283 1.216 . . . . 0.0 114.283 -177.565 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 87.8 m -73.1 -31.02 64.08 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 179.331 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 29.4 p -112.05 -44.83 3.37 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 125.579 1.552 . . . . 0.0 112.527 -169.055 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 63.2 m -101.99 168.15 9.59 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 125.908 1.683 . . . . 0.0 111.054 172.854 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 7.0 tt -81.57 132.31 31.82 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 O-C-N 120.822 -1.174 . . . . 0.0 109.151 170.865 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 17.0 p -121.61 158.65 28.14 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.447 1.099 . . . . 0.0 112.441 -176.133 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 34.1 t -98.08 151.93 19.85 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 124.322 1.049 . . . . 0.0 112.763 -173.923 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 39.8 mt -59.68 -29.7 68.26 Favored 'General case' 0 N--CA 1.471 0.585 0 O-C-N 121.632 -0.668 . . . . 0.0 111.46 171.597 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.6 t80 -62.23 -32.36 73.02 Favored 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 113.147 0.795 . . . . 0.0 113.147 172.231 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 64.9 mt-30 -78.08 -34.0 50.48 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 123.617 0.767 . . . . 0.0 111.084 175.558 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 81.5 mt -60.38 -47.88 84.17 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 118.639 0.654 . . . . 0.0 110.753 169.876 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -62.0 -32.32 72.78 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 175.191 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 15.5 t30 -59.23 -33.01 70.49 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 119.464 1.029 . . . . 0.0 113.03 179.446 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 67.6 m-85 -92.99 -0.63 57.16 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.708 1.203 . . . . 0.0 113.925 177.283 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 92.9 m -82.9 154.25 24.69 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 121.249 -0.907 . . . . 0.0 112.907 173.131 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.25 1.082 0 C-N-CA 125.819 1.648 . . . . 0.0 112.908 -176.646 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 65.8 m-85 . . . . . 0 N--CA 1.488 1.447 0 CA-C-O 118.617 -0.706 . . . . 0.0 109.403 . . . . . . . . . 0 0 . 1 . 048 nuclear nobuild core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 5.9 m -82.58 83.81 1.69 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 CA-C-N 120.149 1.34 . . . . 0.0 110.079 175.127 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 27.9 m120 -124.88 140.71 52.68 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.092 1.357 . . . . 0.0 112.462 -170.869 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -148.06 160.78 42.51 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.45 1.5 . . . . 0.0 111.99 -178.804 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 90.7 m-70 -99.49 130.05 45.71 Favored 'General case' 0 CA--C 1.543 0.673 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 166.506 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 54.3 mt -148.16 136.54 21.41 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 124.89 1.276 . . . . 0.0 110.077 -171.682 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.3 t -147.34 150.8 35.45 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 113.035 0.754 . . . . 0.0 113.035 -178.376 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 53.55 -130.4 42.14 Favored Glycine 0 N--CA 1.469 0.853 0 C-N-CA 124.523 1.059 . . . . 0.0 113.181 173.167 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 39.0 m -59.11 -34.14 71.68 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 123.556 0.742 . . . . 0.0 112.931 -179.365 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 18.1 m-70 -70.41 -32.17 69.69 Favored 'General case' 0 CA--C 1.538 0.483 0 O-C-N 120.621 -1.299 . . . . 0.0 113.172 175.446 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 42.9 tp -69.6 -40.07 76.88 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 118.688 0.676 . . . . 0.0 111.24 171.16 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 78.5 t -60.83 -45.8 97.38 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.078 0 C-N-CA 123.947 0.899 . . . . 0.0 110.911 172.739 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -58.42 -48.17 81.55 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 123.558 0.743 . . . . 0.0 111.4 172.757 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.7 -41.81 99.32 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 123.631 0.772 . . . . 0.0 112.229 -178.655 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 31.0 mt -58.45 -43.97 89.02 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 118.558 0.617 . . . . 0.0 111.412 174.929 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 9.4 m-85 -70.88 -31.9 68.71 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 113.764 1.024 . . . . 0.0 113.764 174.898 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 64.4 mt -71.62 -41.41 68.89 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 119.382 0.992 . . . . 0.0 112.017 175.478 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 54.5 t -73.15 -47.8 45.9 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 C-N-CA 124.527 1.131 . . . . 0.0 111.501 179.97 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 66.8 m -94.73 -10.58 31.19 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 114.815 1.413 . . . . 0.0 114.815 -172.996 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 82.03 -164.53 44.48 Favored Glycine 0 CA--C 1.53 1.001 0 C-N-CA 124.867 1.222 . . . . 0.0 112.836 -177.372 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -61.68 -11.32 11.31 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 114.801 1.408 . . . . 0.0 114.801 -178.601 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 53.6 mtm180 -56.34 -33.49 65.69 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 125.056 1.342 . . . . 0.0 112.878 171.811 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 66.04 -154.51 51.3 Favored Glycine 0 CA--C 1.535 1.299 0 C-N-CA 123.692 0.663 . . . . 0.0 112.07 -172.422 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 54.5 p90 -141.69 155.41 45.67 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.802 1.241 . . . . 0.0 113.276 -172.159 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 75.1 t80 -87.47 -28.53 22.01 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.831 1.252 . . . . 0.0 113.185 -172.939 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 50.7 t80 -62.36 149.45 42.31 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.808 1.243 . . . . 0.0 113.14 179.841 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 13.5 t -111.61 126.12 29.14 Favored Pre-proline 0 N--CA 1.474 0.727 0 C-N-CA 124.216 1.007 . . . . 0.0 109.363 171.359 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -75.47 138.52 22.03 Favored 'Trans proline' 0 N--CA 1.455 -0.753 0 C-N-CA 122.674 2.249 . . . . 0.0 111.31 -171.118 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 18.9 ptmt . . . . . 0 CA--C 1.547 0.856 0 N-CA-C 113.362 0.875 . . . . 0.0 113.362 176.009 . . . . . . . . 0 0 . 1 . 049 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 20.7 tt . . . . . 0 N--CA 1.482 1.13 0 N-CA-C 114.783 1.401 . . . . 0.0 114.783 . . . . . . . . . 0 0 . 1 . 049 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 74.1 t -59.94 -40.86 84.15 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.028 0 C-N-CA 123.253 0.621 . . . . 0.0 111.166 -175.638 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -81.86 -2.75 52.16 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 113.149 0.796 . . . . 0.0 113.149 -179.509 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 20.8 tt0 -94.55 -58.72 2.11 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 123.56 0.744 . . . . 0.0 109.706 169.351 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 85.8 m -72.19 -30.37 64.9 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 113.962 1.097 . . . . 0.0 113.962 -170.054 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 71.2 m -69.93 -46.45 65.31 Favored 'General case' 0 N--CA 1.473 0.701 0 O-C-N 120.752 -1.218 . . . . 0.0 110.706 173.371 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 21.0 m -76.86 -37.95 54.62 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 126.756 2.023 . . . . 0.0 112.871 -170.084 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.7 t -144.19 -169.19 3.06 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.963 1.305 . . . . 0.0 111.77 -174.897 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 61.2 mt -79.91 127.27 39.37 Favored 'Isoleucine or valine' 0 C--O 1.238 0.448 0 O-C-N 120.818 -1.176 . . . . 0.0 111.707 -172.719 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 4.2 m -112.5 171.33 7.58 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 127.013 2.125 . . . . 0.0 110.832 168.166 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 35.4 t -163.34 163.26 25.22 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 126.422 1.889 . . . . 0.0 108.21 -170.715 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 9.8 mp -56.98 -33.71 67.35 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 119.231 0.923 . . . . 0.0 111.976 -176.092 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 73.2 t80 -61.11 -33.09 72.82 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 124.294 1.038 . . . . 0.0 113.572 173.4 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 36.9 mt-30 -86.8 -32.25 20.44 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 125.196 1.398 . . . . 0.0 111.333 177.682 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 96.1 mt -65.46 -50.56 64.88 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.624 1.17 . . . . 0.0 110.679 173.567 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -66.48 -23.23 66.23 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 113.35 0.87 . . . . 0.0 113.35 179.416 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 19.4 t30 -59.93 -29.74 68.59 Favored 'General case' 0 CA--C 1.545 0.788 0 O-C-N 121.118 -0.989 . . . . 0.0 113.031 177.427 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 51.9 m-85 -94.47 5.5 51.62 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.565 1.546 . . . . 0.0 113.717 176.946 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 75.0 m -101.09 129.1 46.92 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.016 0.927 . . . . 0.0 112.7 -179.646 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.252 1.211 0 C-N-CA 128.086 2.554 . . . . 0.0 112.393 -169.495 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 . . . . . 0 N--CA 1.486 1.338 0 CA-C-O 119.75 -0.167 . . . . 0.0 111.109 . . . . . . . . . 0 0 . 1 . 049 nuclear nobuild core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 88.1 t -78.01 141.12 15.94 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.207 0 C-N-CA 124.721 1.208 . . . . 0.0 109.583 172.437 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 5.8 p-10 -134.0 158.36 43.71 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 124.919 1.288 . . . . 0.0 113.614 -174.427 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 2.6 mm-40 -176.2 -172.7 0.5 Allowed 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 127.417 2.287 . . . . 0.0 108.779 -173.052 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 5.9 m-70 -83.44 -105.37 0.04 OUTLIER 'General case' 0 CA--C 1.549 0.923 0 O-C-N 120.457 -1.402 . . . . 0.0 107.912 166.497 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 57.2 mt 113.17 124.48 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.946 1 C-N-CA 131.879 4.072 . . . . 0.0 109.425 171.478 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 5.8 t -146.31 154.12 41.32 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.194 0.598 . . . . 0.0 112.431 -175.285 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 59.58 -136.29 50.58 Favored Glycine 0 N--CA 1.471 0.99 0 C-N-CA 123.801 0.715 . . . . 0.0 113.278 172.557 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 14.4 p -54.08 -36.99 63.75 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 124.541 1.136 . . . . 0.0 112.988 173.49 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 -69.67 -33.28 72.34 Favored 'General case' 0 CA--C 1.544 0.731 0 O-C-N 121.139 -0.975 . . . . 0.0 112.384 -179.751 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 53.7 tp -68.88 -42.48 76.92 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 118.562 0.619 . . . . 0.0 110.945 171.197 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 60.3 t -59.15 -46.77 91.79 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 C-N-CA 124.053 0.941 . . . . 0.0 111.064 174.488 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -65.69 -41.54 92.29 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 123.703 0.801 . . . . 0.0 112.137 176.679 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.75 -43.74 97.59 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 119.279 0.945 . . . . 0.0 111.529 174.823 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 62.5 mt -64.25 -40.22 95.55 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 118.299 0.499 . . . . 0.0 112.155 177.035 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 7.2 m-85 -58.14 -47.88 81.98 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.107 0.867 . . . . 0.0 111.86 170.744 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 78.5 mt -69.8 -41.63 74.78 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 124.146 0.979 . . . . 0.0 112.661 -177.156 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 60.6 t -76.82 -44.1 32.92 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 C-N-CA 123.754 0.822 . . . . 0.0 111.892 -177.268 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 73.7 m -95.9 -27.56 15.11 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 114.73 1.381 . . . . 0.0 114.73 -172.654 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 66.16 -134.76 34.14 Favored Glycine 0 N--CA 1.469 0.866 0 C-N-CA 124.216 0.913 . . . . 0.0 112.676 176.318 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -63.96 -17.92 63.76 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.248 1.419 . . . . 0.0 113.636 -177.847 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 84.9 mtm180 -61.66 -29.25 69.95 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 179.286 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.59 157.98 9.66 Favored Glycine 0 CA--C 1.534 1.234 0 C-N-CA 124.662 1.125 . . . . 0.0 113.144 -177.862 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 51.6 p90 -137.37 152.55 49.8 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.246 1.418 . . . . 0.0 113.334 -172.078 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 24.7 t80 -105.69 68.94 0.81 Allowed 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.748 1.619 . . . . 0.0 111.282 -179.749 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 50.5 t80 -67.34 117.71 9.7 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.469 1.108 . . . . 0.0 110.975 173.331 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 6.9 t -173.96 151.07 1.72 Allowed Pre-proline 0 N--CA 1.48 1.049 0 C-N-CA 125.637 1.575 . . . . 0.0 112.75 -175.656 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -89.5 -174.39 0.9 Allowed 'Trans proline' 0 CA--C 1.547 1.173 0 C-N-CA 124.493 3.462 . . . . 0.0 109.565 166.661 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 32.1 mtmm . . . . . 0 N--CA 1.481 1.075 0 O-C-N 120.282 -1.511 . . . . 0.0 112.43 170.007 . . . . . . . . 0 0 . 1 . 050 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 8.1 tp . . . . . 0 N--CA 1.477 0.917 0 N-CA-C 114.243 1.201 . . . . 0.0 114.243 . . . . . . . . . 0 0 . 1 . 050 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 40.1 t -65.22 -47.35 87.77 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 CA-C-N 118.452 0.569 . . . . 0.0 110.845 -179.14 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -64.34 -41.0 97.0 Favored 'General case' 0 CA--C 1.539 0.542 0 O-C-N 121.449 -0.782 . . . . 0.0 111.591 174.098 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 34.6 mt-30 -66.09 -35.74 81.31 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 118.374 -0.822 . . . . 0.0 112.955 -177.472 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 99.7 m -93.4 -31.18 14.73 Favored 'General case' 0 N--CA 1.47 0.525 0 N-CA-C 114.63 1.344 . . . . 0.0 114.63 179.281 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 78.2 m -86.76 -52.75 5.32 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 119.457 1.026 . . . . 0.0 111.602 -177.004 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 27.3 m -83.07 -40.8 19.4 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.731 1.212 . . . . 0.0 110.578 -174.067 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 7.9 t -112.5 -171.85 1.94 Allowed 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.398 1.079 . . . . 0.0 112.039 170.827 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 90.4 mt -96.24 128.68 47.22 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 C-N-CA 126.029 1.732 . . . . 0.0 108.522 175.596 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 21.1 p -107.9 -157.96 0.63 Allowed 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.987 0.915 . . . . 0.0 112.1 178.025 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 92.8 p -155.1 164.53 38.73 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 125.776 1.63 . . . . 0.0 111.387 -179.153 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 44.9 mt -62.01 -33.32 74.13 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 122.957 0.503 . . . . 0.0 111.601 174.381 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 93.2 t80 -63.29 -36.93 85.3 Favored 'General case' 0 CA--C 1.539 0.551 0 O-C-N 121.532 -0.73 . . . . 0.0 112.727 171.409 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -71.86 -34.58 69.34 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 118.757 -0.64 . . . . 0.0 111.739 174.687 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 95.5 mt -59.29 -49.57 77.32 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 119.503 1.047 . . . . 0.0 110.703 169.829 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -61.88 -34.37 75.91 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 113.562 0.949 . . . . 0.0 113.562 176.316 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 15.3 t30 -61.78 -27.78 68.99 Favored 'General case' 0 CA--C 1.546 0.821 0 O-C-N 121.129 -0.982 . . . . 0.0 112.79 177.92 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 66.3 m-85 -104.7 29.34 6.27 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.78 1.632 . . . . 0.0 112.814 176.008 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 93.7 m -125.59 172.97 9.3 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 126.681 1.992 . . . . 0.0 112.635 168.869 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 . . . . . 0 C--O 1.251 1.137 0 C-N-CA 124.551 1.141 . . . . 0.0 112.407 175.97 . . . . . . . . 0 0 . 1 . 050 nuclear nobuild core ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 66.3 m-85 . . . . . 0 N--CA 1.488 1.46 0 CA-C-O 118.896 -0.573 . . . . 0.0 109.999 . . . . . . . . . 0 0 . 1 . 050 nuclear nobuild core ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 9.1 p -62.28 -28.89 45.45 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.345 0 CA-C-N 120.145 1.338 . . . . 0.0 112.435 174.439 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 28.9 m120 -92.46 144.67 25.13 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.068 1.347 . . . . 0.0 111.94 171.54 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -175.22 167.77 3.4 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 125.699 1.599 . . . . 0.0 111.723 178.326 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 83.8 m-70 -87.51 143.15 27.36 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 124.628 1.171 . . . . 0.0 108.967 166.049 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 73.9 mt -146.63 138.07 24.4 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 125.636 1.574 . . . . 0.0 109.346 174.825 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 1.8 t -150.09 157.6 43.3 Favored 'General case' 0 N--CA 1.469 0.491 0 O-C-N 121.291 -0.881 . . . . 0.0 113.214 176.337 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.99 -136.44 48.07 Favored Glycine 0 CA--C 1.531 1.037 0 C-N-CA 124.741 1.163 . . . . 0.0 113.388 175.038 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 21.0 m -53.58 -37.4 62.92 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.99 0.916 . . . . 0.0 112.69 177.049 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -69.7 -36.13 75.68 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 120.793 -1.192 . . . . 0.0 112.104 179.401 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 65.6 tp -64.59 -47.16 79.71 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 118.684 0.675 . . . . 0.0 110.721 170.579 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 59.0 t -61.78 -44.3 98.57 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 C-N-CA 123.91 0.884 . . . . 0.0 110.942 -179.221 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -64.12 -45.67 87.54 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 118.589 0.631 . . . . 0.0 112.18 174.408 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.94 -44.87 94.89 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 119.39 0.995 . . . . 0.0 111.747 178.388 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 28.0 tp -58.07 -47.01 84.46 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.009 1.324 . . . . 0.0 110.885 177.089 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 8.2 m-30 -63.54 -43.43 97.1 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 123.6 0.76 . . . . 0.0 112.312 176.721 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 73.9 mt -67.95 -39.37 83.41 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 123.719 0.807 . . . . 0.0 112.446 179.029 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 40.8 t -70.15 -45.94 74.13 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 123.972 0.909 . . . . 0.0 111.868 177.897 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 68.8 m -88.93 -21.64 23.48 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 114.831 1.419 . . . . 0.0 114.831 -172.343 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.24 -141.2 45.89 Favored Glycine 0 CA--C 1.53 0.97 0 C-N-CA 124.504 1.05 . . . . 0.0 113.646 170.981 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -66.11 -19.93 66.0 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.083 1.353 . . . . 0.0 113.588 -175.462 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 78.0 mtp85 -62.24 -33.71 75.11 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.827 0.851 . . . . 0.0 112.897 178.068 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.46 161.54 37.31 Favored Glycine 0 CA--C 1.534 1.259 0 C-N-CA 124.685 1.136 . . . . 0.0 113.734 -178.227 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 55.0 p90 -97.52 165.79 11.82 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.881 1.673 . . . . 0.0 112.899 -176.558 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 46.3 t80 -115.94 -36.94 3.99 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 124.82 1.248 . . . . 0.0 111.314 168.74 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 81.0 t80 52.74 98.27 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 127.45 2.3 . . . . 0.0 115.163 169.587 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 92.3 m -111.65 111.17 54.63 Favored Pre-proline 0 N--CA 1.477 0.88 0 C-N-CA 123.953 0.901 . . . . 0.0 110.836 -176.871 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -82.14 -153.21 0.04 OUTLIER 'Trans proline' 0 CA--C 1.539 0.743 0 C-N-CA 124.729 3.619 . . . . 0.0 110.391 169.89 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt . . . . . 0 CA--C 1.549 0.941 0 C-N-CA 124.537 1.135 . . . . 0.0 113.583 170.904 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.592 0 N-CA-C 112.154 -0.378 . . . . 0.0 112.154 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 13.8 tt -59.87 -20.3 19.15 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.188 0 N-CA-C 115.476 1.658 . . . . 0.0 115.476 -169.693 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 18.2 t -52.14 -41.76 33.88 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 C-N-CA 124.224 1.009 . . . . 0.0 110.647 169.036 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 -70.74 -5.24 28.45 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 179.617 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 52.6 tt0 -104.3 -63.08 1.24 Allowed 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.007 0.923 . . . . 0.0 108.938 168.014 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 68.7 m -59.1 -33.51 70.92 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 113.674 0.99 . . . . 0.0 113.674 -170.15 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 13.6 t -77.75 -26.92 50.23 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 113.371 0.878 . . . . 0.0 113.371 -172.358 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 28.5 p -116.2 -35.05 4.47 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 125.718 1.607 . . . . 0.0 112.962 -175.611 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 9.0 t -113.95 -169.04 1.44 Allowed 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 126.449 1.9 . . . . 0.0 110.601 174.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 33.8 mm -92.39 145.55 7.45 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 C-N-CA 125.021 1.328 . . . . 0.0 110.456 179.543 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 15.6 p -141.64 176.84 8.58 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.776 1.23 . . . . 0.0 111.234 169.241 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 91.2 p -153.1 164.0 38.82 Favored 'General case' 0 N--CA 1.47 0.549 0 O-C-N 121.075 -1.016 . . . . 0.0 112.918 -169.661 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 21.5 mt -57.18 -37.13 71.68 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 123.945 0.898 . . . . 0.0 112.599 -173.661 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 87.2 t80 -62.05 -28.37 69.55 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.144 0.978 . . . . 0.0 113.475 175.381 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 46.8 mt-30 -87.5 -29.8 21.09 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.398 1.079 . . . . 0.0 111.04 176.141 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 72.5 mt -67.1 -38.17 85.2 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.969 0.908 . . . . 0.0 112.325 170.536 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -52.82 -31.59 39.71 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.743 1.217 . . . . 0.0 113.392 174.297 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -62.97 -19.32 64.19 Favored 'General case' 0 CA--C 1.548 0.886 0 N-CA-C 113.653 0.983 . . . . 0.0 113.653 178.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 95.4 m-85 -107.57 2.94 24.39 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.747 1.619 . . . . 0.0 113.937 -178.184 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 98.7 m -72.0 141.66 49.35 Favored 'General case' 0 CA--C 1.537 0.461 0 O-C-N 121.148 -0.97 . . . . 0.0 113.005 177.029 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 34.5 t30 . . . . . 0 C--O 1.252 1.208 0 C-N-CA 125.458 1.503 . . . . 0.0 111.327 171.566 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 37.9 t80 . . . . . 0 N--CA 1.49 1.573 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 24.3 t 79.27 -51.33 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 C-N-CA 128.404 2.682 . . . . 0.0 112.645 175.0 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -141.3 111.21 6.61 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 126.738 2.015 . . . . 0.0 107.896 175.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -170.86 174.73 4.73 Favored 'General case' 0 CA--C 1.543 0.695 0 O-C-N 121.496 -0.753 . . . . 0.0 111.949 -166.043 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 94.4 m-70 -81.41 142.2 33.2 Favored 'General case' 0 CA--C 1.55 0.968 0 N-CA-C 107.283 -1.377 . . . . 0.0 107.283 163.767 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 87.4 mt -145.09 135.98 24.66 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 125.819 1.648 . . . . 0.0 110.495 178.327 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.5 t -149.66 145.48 26.75 Favored 'General case' 0 N--CA 1.471 0.608 0 O-C-N 120.865 -1.147 . . . . 0.0 113.235 178.422 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 59.95 -126.68 42.38 Favored Glycine 0 CA--C 1.528 0.862 0 C-N-CA 124.49 1.043 . . . . 0.0 112.77 176.492 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 20.3 p -52.34 -40.79 62.38 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 124.884 1.274 . . . . 0.0 113.021 176.193 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 27.6 m80 -62.93 -42.27 99.75 Favored 'General case' 0 CA--C 1.543 0.687 0 O-C-N 121.206 -0.934 . . . . 0.0 111.66 178.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 48.6 tp -69.03 -41.36 77.81 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 124.085 0.954 . . . . 0.0 111.376 176.654 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 37.8 t -62.15 -44.71 99.38 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 C-N-CA 124.513 1.125 . . . . 0.0 111.267 175.407 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -66.59 -40.07 88.73 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 118.426 0.557 . . . . 0.0 111.977 175.262 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.48 -41.82 99.06 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 119.55 1.068 . . . . 0.0 111.938 174.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 43.2 mt -59.05 -47.17 86.22 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-O 118.818 -0.611 . . . . 0.0 111.046 171.754 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 24.2 m-85 -62.93 -33.89 76.29 Favored 'General case' 0 CA--C 1.545 0.762 0 CA-C-N 120.01 1.277 . . . . 0.0 113.711 175.359 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 70.2 mt -67.24 -42.44 83.96 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 119.395 0.998 . . . . 0.0 112.054 173.051 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 55.5 t -73.52 -46.67 47.95 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 C-N-CA 123.793 0.837 . . . . 0.0 112.097 -179.462 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 33.6 m -85.37 -18.56 33.39 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 113.758 1.022 . . . . 0.0 113.758 -174.064 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 70.55 -155.22 52.88 Favored Glycine 0 CA--C 1.531 1.067 0 C-N-CA 124.709 1.147 . . . . 0.0 112.434 -174.521 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -61.72 -21.12 64.23 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.072 1.349 . . . . 0.0 113.275 -178.733 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 76.9 mtp85 -62.7 -28.18 69.77 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.22 1.008 . . . . 0.0 113.297 175.051 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.86 -166.48 53.27 Favored Glycine 0 CA--C 1.533 1.193 0 C-N-CA 124.942 1.258 . . . . 0.0 113.801 -178.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 44.1 p90 -121.63 148.42 44.58 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 126.025 1.73 . . . . 0.0 111.411 -179.058 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 27.4 p90 -85.83 -13.75 47.11 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 113.299 0.851 . . . . 0.0 113.299 175.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 71.8 t80 -63.98 154.41 34.2 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 126.081 1.752 . . . . 0.0 114.39 -177.622 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 26.3 p -132.63 134.69 25.02 Favored Pre-proline 0 N--CA 1.477 0.914 0 C-N-CA 126.382 1.873 . . . . 0.0 108.31 170.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -63.12 101.42 0.28 Allowed 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 124.371 3.381 . . . . 0.0 112.891 -168.598 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . 0.311 61.5 pttt 40.83 29.84 0.08 Allowed 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 127.849 2.46 . . . . 0.0 116.83 -174.145 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 96.9 m -100.13 95.92 7.15 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 126.208 1.803 . . . . 0.0 107.747 173.185 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 15.5 tppt? 70.6 -43.79 0.56 Allowed 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 128.491 2.716 . . . . 0.0 113.565 -179.593 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.251 1.163 0 C-N-CA 126.731 2.012 . . . . 0.0 110.96 169.59 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.688 0 N-CA-C 110.918 -0.873 . . . . 0.0 110.918 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 20.3 tt -54.2 -33.29 24.91 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.453 0 N-CA-C 115.656 1.725 . . . . 0.0 115.656 -169.313 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . 0.465 HG12 ' H ' ' B' ' 29' ' ' LYS . 6.4 p -62.32 -23.46 32.15 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.141 0 C-N-CA 124.124 0.969 . . . . 0.0 112.754 177.226 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -76.04 0.72 17.67 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.224 1.409 . . . . 0.0 112.508 175.336 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 63.4 tp60 -117.93 -54.71 2.31 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 125.042 1.337 . . . . 0.0 109.025 166.868 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 22.8 m -67.72 -26.1 65.99 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 115.419 1.637 . . . . 0.0 115.419 -170.713 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 37.7 t -103.0 -41.95 5.96 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 119.112 0.869 . . . . 0.0 113.085 -176.547 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 24.1 p -71.42 -33.2 69.22 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 125.986 1.715 . . . . 0.0 112.169 176.359 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.8 t -134.42 -157.81 0.83 Allowed 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.957 1.703 . . . . 0.0 109.606 173.509 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 86.4 mt -100.14 150.11 5.62 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 C-N-CA 125.887 1.675 . . . . 0.0 110.847 -176.003 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.1 p -143.42 -164.02 1.77 Allowed 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 124.148 0.979 . . . . 0.0 112.233 169.387 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 26.5 t -154.84 151.76 28.99 Favored 'General case' 0 N--CA 1.469 0.494 0 O-C-N 120.727 -1.233 . . . . 0.0 111.59 -171.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 62.6 mt -60.77 -28.52 68.8 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.888 0.875 . . . . 0.0 112.22 178.641 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 68.6 t80 -62.15 -31.05 71.49 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.529 1.132 . . . . 0.0 113.049 172.363 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 65.6 mt-30 -81.54 -35.26 30.52 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 123.736 0.814 . . . . 0.0 110.842 175.328 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 17.8 mt -58.71 -41.18 85.71 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 118.924 0.784 . . . . 0.0 111.464 172.787 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -56.3 -28.46 58.85 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.865 1.666 . . . . 0.0 114.167 176.776 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 15.2 t-20 -66.11 -22.26 66.39 Favored 'General case' 0 CA--C 1.547 0.829 0 O-C-N 121.264 -0.898 . . . . 0.0 112.917 176.658 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 56.7 m-85 -100.88 4.91 43.12 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.404 1.482 . . . . 0.0 113.655 -178.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 77.9 m -73.76 168.35 19.56 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.172 0.989 . . . . 0.0 112.897 171.818 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.248 0.989 0 C-N-CA 125.86 1.664 . . . . 0.0 111.966 -178.863 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 . . . . . 0 N--CA 1.483 1.194 0 CA-C-O 118.313 -0.851 . . . . 0.0 111.078 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 92.5 t -78.72 -39.39 22.61 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.252 0 CA-C-N 120.525 1.511 . . . . 0.0 111.488 -177.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 2.3 t30 59.23 75.05 0.42 Allowed 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 125.564 1.546 . . . . 0.0 112.525 169.145 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -149.51 160.79 43.18 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 124.428 1.091 . . . . 0.0 111.93 -178.146 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 98.0 m-70 -85.02 140.9 30.68 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.494 1.117 . . . . 0.0 111.214 170.833 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 62.0 mt -141.57 137.1 31.71 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 125.941 1.696 . . . . 0.0 110.112 174.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 1.8 t -140.16 143.67 36.27 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 113.132 0.79 . . . . 0.0 113.132 -175.056 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 49.91 -123.03 12.67 Favored Glycine 0 N--CA 1.469 0.896 0 C-N-CA 125.232 1.396 . . . . 0.0 114.175 169.432 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.1 p -56.28 -36.46 68.63 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 124.908 1.283 . . . . 0.0 113.048 177.242 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -73.14 -32.51 64.95 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 120.736 -1.227 . . . . 0.0 112.035 178.235 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 41.9 tp -70.74 -43.3 69.13 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.918 0.887 . . . . 0.0 111.475 172.733 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 39.1 t -59.89 -43.78 92.85 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 C-N-CA 124.497 1.119 . . . . 0.0 110.911 172.524 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -64.08 -43.66 94.76 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.598 0.759 . . . . 0.0 111.088 175.477 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.93 -41.68 99.56 Favored 'General case' 0 CA--C 1.54 0.589 0 O-C-N 121.329 -0.857 . . . . 0.0 112.249 177.009 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 21.6 mt -60.06 -46.38 89.74 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 118.547 0.612 . . . . 0.0 110.662 173.126 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 19.3 m-85 -62.05 -35.72 79.45 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 120.936 -1.102 . . . . 0.0 113.69 173.525 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 62.5 mt -70.24 -41.57 73.37 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 119.49 1.041 . . . . 0.0 111.999 176.091 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 63.0 t -71.7 -42.36 70.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 C-N-CA 123.578 0.751 . . . . 0.0 111.702 179.407 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 36.7 m -86.41 -15.21 41.01 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 114.328 1.233 . . . . 0.0 114.328 -178.144 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 72.9 -162.01 54.61 Favored Glycine 0 CA--C 1.534 1.262 0 C-N-CA 124.963 1.268 . . . . 0.0 112.781 -174.076 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -58.61 -20.72 49.83 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 125.033 1.333 . . . . 0.0 113.354 179.04 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 73.6 mtp85 -61.66 -24.16 66.55 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 125.483 1.513 . . . . 0.0 113.302 175.335 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.42 -178.45 44.76 Favored Glycine 0 CA--C 1.529 0.951 0 C-N-CA 124.74 1.162 . . . . 0.0 113.81 -179.164 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 55.3 p90 -119.01 156.54 29.44 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 125.399 1.48 . . . . 0.0 111.932 -178.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 84.6 t80 -91.38 -40.12 11.63 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.328 1.051 . . . . 0.0 113.042 -177.739 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 8.2 t80 -87.85 112.74 22.81 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 114.162 1.171 . . . . 0.0 114.162 -169.028 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 6.6 t -72.4 144.05 86.21 Favored Pre-proline 0 N--CA 1.476 0.84 0 C-N-CA 124.891 1.276 . . . . 0.0 111.275 179.183 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -73.99 167.03 28.21 Favored 'Trans proline' 0 CA--C 1.537 0.667 0 C-N-CA 123.086 2.524 . . . . 0.0 111.101 169.84 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . 0.465 ' H ' HG12 ' A' ' 3' ' ' VAL . 16.1 tptm -67.06 -23.74 65.9 Favored 'General case' 0 CA--C 1.547 0.865 0 O-C-N 121.217 -0.927 . . . . 0.0 113.093 178.225 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 25.2 p -72.4 -20.56 61.41 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 126.85 2.06 . . . . 0.0 112.947 170.163 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 11.3 tmtt? 80.87 119.46 0.05 Allowed 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 129.275 3.03 . . . . 0.0 112.476 170.617 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 44.4 tpt85 . . . . . 0 N--CA 1.48 1.055 0 C-N-CA 125.732 1.613 . . . . 0.0 113.216 178.371 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.572 0 N-CA-C 111.79 -0.524 . . . . 0.0 111.79 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -60.39 -39.06 79.86 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.228 0 C-N-CA 123.8 0.84 . . . . 0.0 112.159 -173.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 9.5 p -66.0 -36.69 78.08 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 N-CA-C 112.976 0.732 . . . . 0.0 112.976 -179.253 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 46.8 mp0 -68.6 -45.78 71.07 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 119.158 0.89 . . . . 0.0 110.759 169.836 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 22.5 tt0 -61.18 -49.99 74.96 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.397 1.079 . . . . 0.0 112.165 -172.87 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 1.5 m -68.99 -17.98 64.0 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 113.726 1.01 . . . . 0.0 113.726 176.503 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 48.7 t -98.83 -42.27 7.25 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 119.245 0.929 . . . . 0.0 113.214 -174.667 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 1.9 t -73.6 -26.56 60.86 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 125.352 1.461 . . . . 0.0 112.712 -179.5 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.5 t -137.34 -173.05 3.36 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 125.475 1.51 . . . . 0.0 110.821 174.525 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 63.0 mt -82.44 139.49 17.77 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 C-N-CA 124.748 1.219 . . . . 0.0 110.462 176.831 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 16.5 p -129.99 158.07 40.58 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.332 1.053 . . . . 0.0 111.558 168.831 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 22.6 t -108.63 154.96 21.24 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 124.424 1.09 . . . . 0.0 113.904 -169.714 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.529 HD22 ' H ' ' A' ' 13' ' ' LEU . 2.1 mm? -58.52 -31.15 67.64 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.32 1.048 . . . . 0.0 111.462 174.052 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 90.1 t80 -62.1 -33.07 73.74 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.081 0.952 . . . . 0.0 112.98 173.384 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 57.4 mt-30 -76.23 -42.14 46.93 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 123.433 0.693 . . . . 0.0 109.886 174.613 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 81.3 mt -59.14 -41.96 89.52 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 118.455 0.571 . . . . 0.0 111.876 174.668 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 23.5 mt-10 -63.51 -32.53 74.01 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 171.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.4 t-20 -69.95 -23.51 63.2 Favored 'General case' 0 CA--C 1.546 0.819 0 CA-C-N 119.038 0.836 . . . . 0.0 112.772 173.067 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 13.2 m-85 -86.94 -11.04 51.79 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 124.897 1.279 . . . . 0.0 113.614 174.869 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 61.3 m -63.1 151.35 40.3 Favored 'General case' 0 N--CA 1.47 0.549 0 O-C-N 120.988 -1.07 . . . . 0.0 111.68 169.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 . . . . . 0 C--O 1.252 1.215 0 C-N-CA 125.072 1.349 . . . . 0.0 112.618 179.383 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 77.7 m-85 . . . . . 0 N--CA 1.486 1.349 0 CA-C-O 118.94 -0.553 . . . . 0.0 112.43 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 27.4 m -129.39 -167.48 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.126 0 C-N-CA 125.816 1.646 . . . . 0.0 110.092 -179.024 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 17.8 p-10 -60.82 117.58 5.59 Favored 'General case' 0 CA--C 1.545 0.773 0 O-C-N 121.183 -0.948 . . . . 0.0 110.484 169.755 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 36.9 mt-30 -146.6 174.95 10.96 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.422 1.489 . . . . 0.0 111.333 -167.875 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 38.4 m-70 -79.51 135.01 36.52 Favored 'General case' 0 CA--C 1.545 0.776 0 O-C-N 121.366 -0.834 . . . . 0.0 109.249 167.373 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 82.7 mt -136.9 121.16 17.98 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 125.931 1.692 . . . . 0.0 109.688 178.215 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 80.9 m -121.19 132.87 55.09 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.772 1.229 . . . . 0.0 111.957 -174.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 50.28 -117.99 5.55 Favored Glycine 0 N--CA 1.476 1.307 0 C-N-CA 125.349 1.452 . . . . 0.0 114.838 168.827 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.1 p -53.85 -39.58 65.75 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 125.221 1.408 . . . . 0.0 112.91 176.678 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -69.67 -34.29 73.76 Favored 'General case' 0 CA--C 1.54 0.586 0 O-C-N 121.098 -1.001 . . . . 0.0 111.826 178.599 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 59.9 tp -68.89 -44.17 73.76 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 123.574 0.75 . . . . 0.0 111.69 172.19 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 47.6 t -60.87 -43.53 95.84 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 C-N-CA 123.948 0.899 . . . . 0.0 110.741 175.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 29.1 mm-40 -64.79 -41.54 95.75 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.434 0.694 . . . . 0.0 112.062 174.083 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.45 -40.75 97.63 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 119.293 0.952 . . . . 0.0 112.047 175.298 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 43.0 mt -61.22 -43.31 99.08 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.568 0.747 . . . . 0.0 111.608 173.84 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 20.1 m-85 -61.49 -42.65 99.11 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 119.635 1.107 . . . . 0.0 112.327 172.44 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 70.4 mt -67.51 -41.57 84.21 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.933 0.893 . . . . 0.0 112.466 179.489 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 51.5 t -73.1 -47.3 48.18 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 C-N-CA 123.962 0.905 . . . . 0.0 111.478 179.441 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 65.7 m -81.67 -30.11 32.83 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 113.621 0.971 . . . . 0.0 113.621 -174.383 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 66.66 -134.43 32.69 Favored Glycine 0 CA--C 1.527 0.814 0 C-N-CA 124.056 0.836 . . . . 0.0 111.127 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 2.5 pm0 -68.24 -13.94 62.62 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 114.229 1.196 . . . . 0.0 114.229 178.08 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 84.3 mtm180 -65.25 -36.2 83.4 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.943 0.897 . . . . 0.0 112.77 179.045 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.83 177.92 40.06 Favored Glycine 0 CA--C 1.535 1.282 0 C-N-CA 124.154 0.883 . . . . 0.0 112.609 -170.573 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 51.6 p90 -153.37 161.93 41.81 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 114.419 1.266 . . . . 0.0 114.419 -171.462 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -96.39 144.04 26.89 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.634 1.574 . . . . 0.0 110.11 168.815 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 69.6 t80 -161.28 142.67 11.58 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.882 1.273 . . . . 0.0 111.365 -174.526 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 40.4 p -126.59 108.57 23.13 Favored Pre-proline 0 C--O 1.239 0.512 0 C-N-CA 125.118 1.367 . . . . 0.0 110.903 179.79 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -67.89 106.2 1.27 Allowed 'Trans proline' 0 N--CA 1.457 -0.665 0 C-N-CA 121.82 1.68 . . . . 0.0 108.117 168.161 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 21.6 ttmm 71.11 -50.72 0.69 Allowed 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 129.076 2.95 . . . . 0.0 114.281 -176.531 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 9.8 t -175.37 -39.42 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 126.481 1.912 . . . . 0.0 112.175 -175.088 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 65.9 pttt -70.17 171.2 10.11 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 124.308 1.043 . . . . 0.0 112.517 173.291 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.153 0 C-N-CA 127.905 2.482 . . . . 0.0 111.132 175.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.659 0 N-CA-C 111.463 -0.655 . . . . 0.0 111.463 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.457 HG22 ' H ' ' B' ' 27' ' ' THR . 10.4 tp -63.75 -32.98 59.07 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.044 0 CA-C-N 118.523 1.162 . . . . 0.0 112.485 179.146 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 96.0 t -63.11 -51.88 66.02 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 CA-C-N 118.519 0.6 . . . . 0.0 110.541 174.865 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -53.21 -48.15 68.37 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 123.571 0.748 . . . . 0.0 111.067 173.036 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 42.1 tp60 -65.64 -55.18 18.91 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.886 0.875 . . . . 0.0 111.354 -172.358 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 72.0 m -69.47 -26.45 64.58 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 -178.014 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 84.9 m -71.88 -50.44 29.3 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 119.453 1.024 . . . . 0.0 111.17 171.802 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -79.93 -19.34 48.29 Favored 'General case' 0 N--CA 1.478 0.965 0 N-CA-C 114.065 1.135 . . . . 0.0 114.065 -172.291 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 95.8 p -149.82 168.93 22.31 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.254 1.022 . . . . 0.0 113.09 -173.406 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 53.2 mt -69.63 125.27 27.34 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 O-C-N 121.244 -0.91 . . . . 0.0 109.504 170.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 15.3 p -117.13 -159.9 0.75 Allowed 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.693 1.197 . . . . 0.0 110.411 170.427 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 6.7 t -157.19 168.76 26.46 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 120.209 -1.557 . . . . 0.0 111.481 175.161 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 52.0 mt -63.28 -27.46 69.35 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.685 1.194 . . . . 0.0 112.839 -174.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.2 t80 -63.73 -32.43 73.93 Favored 'General case' 0 CA--C 1.546 0.79 0 O-C-N 121.282 -0.886 . . . . 0.0 113.081 169.874 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 44.6 mm-40 -75.07 -23.57 58.07 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 123.569 0.748 . . . . 0.0 111.245 175.701 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 30.5 mt -77.06 -48.29 18.26 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 123.892 0.877 . . . . 0.0 110.817 172.679 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 -63.11 -22.72 67.05 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 113.639 0.977 . . . . 0.0 113.639 178.026 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 16.8 t30 -54.48 -29.4 49.84 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 123.929 0.892 . . . . 0.0 112.856 169.964 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 97.3 m-85 -100.8 7.45 43.75 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.316 1.446 . . . . 0.0 113.429 176.807 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 22.8 t -89.76 167.78 12.61 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.885 1.274 . . . . 0.0 111.782 170.029 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 21.7 m-80 . . . . . 0 C--O 1.252 1.192 0 C-N-CA 125.136 1.374 . . . . 0.0 112.561 173.253 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 65.6 m-85 . . . . . 0 N--CA 1.487 1.413 0 N-CA-C 110.779 -0.082 . . . . 0.0 110.779 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 76.2 t -68.62 142.31 16.41 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.239 0 C-N-CA 124.438 1.095 . . . . 0.0 110.606 -179.627 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 6.4 t-20 65.08 64.55 0.62 Allowed 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 126.114 1.766 . . . . 0.0 112.679 173.425 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 47.4 mt-30 -143.33 -170.68 3.33 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 126.037 1.735 . . . . 0.0 110.308 -179.139 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 23.6 m-70 -73.7 146.24 44.59 Favored 'General case' 0 CA--C 1.545 0.761 0 O-C-N 120.897 -1.127 . . . . 0.0 109.815 167.025 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 62.9 mt -143.82 125.56 15.1 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 126.001 1.72 . . . . 0.0 109.072 174.713 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 5.6 t -137.99 149.91 46.53 Favored 'General case' 0 CA--C 1.537 0.475 0 O-C-N 121.275 -0.89 . . . . 0.0 112.993 -176.719 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 54.29 -130.46 44.7 Favored Glycine 0 N--CA 1.468 0.827 0 C-N-CA 125.028 1.299 . . . . 0.0 113.572 174.132 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.9 m -56.54 -32.02 64.71 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.306 1.043 . . . . 0.0 113.128 179.141 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -73.07 -35.91 66.76 Favored 'General case' 0 CA--C 1.543 0.696 0 O-C-N 120.862 -1.149 . . . . 0.0 112.024 177.576 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 58.9 tp -67.25 -44.89 78.29 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 123.66 0.784 . . . . 0.0 110.943 172.106 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 58.3 t -61.45 -42.46 93.94 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 123.907 0.883 . . . . 0.0 110.902 176.006 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -62.67 -44.55 95.96 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 123.329 0.652 . . . . 0.0 112.052 173.687 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.33 -40.47 96.47 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 118.784 0.72 . . . . 0.0 112.22 175.757 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 16.0 mt -59.71 -44.5 93.69 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.025 0.93 . . . . 0.0 111.774 172.68 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 20.7 m-85 -62.93 -40.66 98.32 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 119.499 1.045 . . . . 0.0 112.993 173.322 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 78.7 mt -66.92 -41.97 86.18 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.676 0.79 . . . . 0.0 112.556 177.128 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 38.9 t -71.73 -48.44 51.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 C-N-CA 124.482 1.113 . . . . 0.0 111.949 178.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 28.0 t -86.84 -37.24 17.93 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 113.31 0.856 . . . . 0.0 113.31 -170.124 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 69.63 -146.0 42.96 Favored Glycine 0 CA--C 1.533 1.187 0 C-N-CA 124.201 0.905 . . . . 0.0 112.097 -177.264 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -65.44 -15.63 62.82 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 125.136 1.375 . . . . 0.0 113.44 -178.805 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 80.1 mtm180 -60.83 -29.95 69.8 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.886 1.274 . . . . 0.0 113.734 -178.591 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 80.52 138.91 2.19 Favored Glycine 0 N--CA 1.472 1.077 0 C-N-CA 125.249 1.405 . . . . 0.0 113.336 178.875 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 44.2 p90 -118.75 153.24 34.74 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 125.284 1.434 . . . . 0.0 113.232 -178.057 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 26.3 p90 -120.31 37.96 4.11 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 127.844 2.458 . . . . 0.0 111.227 -177.016 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -49.34 142.16 7.88 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 125.87 1.668 . . . . 0.0 114.231 -178.892 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . 0.457 ' H ' HG22 ' A' ' 2' ' ' ILE . 11.2 p -93.13 111.09 50.15 Favored Pre-proline 0 N--CA 1.474 0.766 0 C-N-CA 125.233 1.413 . . . . 0.0 112.806 -175.442 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_endo -79.62 161.08 25.01 Favored 'Trans proline' 0 C--N 1.353 0.807 0 C-N-CA 123.758 2.972 . . . . 0.0 110.597 169.35 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 43.5 tptt -70.37 -14.43 62.56 Favored 'General case' 0 CA--C 1.549 0.908 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 -178.539 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 31.1 p -66.48 -24.74 66.46 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 125.094 1.358 . . . . 0.0 112.233 169.614 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 63.3 mttp -101.75 -49.38 4.0 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.627 1.171 . . . . 0.0 113.191 176.038 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 13.9 mmm180 . . . . . 0 N--CA 1.481 1.117 0 C-N-CA 125.081 1.352 . . . . 0.0 112.654 -173.956 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.212 0 N-CA-C 110.672 -0.971 . . . . 0.0 110.672 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 15.1 tt 156.36 -41.43 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.366 1 C-N-CA 133.089 4.555 . . . . 0.0 109.616 175.443 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 7.1 p -65.56 -23.43 32.69 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.76 0 C-N-CA 124.511 1.124 . . . . 0.0 112.95 -177.661 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 26.0 pm0 -68.96 -11.53 60.8 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.338 1.455 . . . . 0.0 113.951 169.807 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 71.6 tp60 -105.92 -45.96 4.23 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 124.056 0.943 . . . . 0.0 110.542 169.454 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 54.4 m -79.33 -29.25 42.2 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 115.907 1.817 . . . . 0.0 115.907 -171.586 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 42.0 t -98.46 -56.92 2.32 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 119.86 1.209 . . . . 0.0 113.113 -173.436 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 17.0 p -66.47 -46.81 75.12 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.103 1.361 . . . . 0.0 111.074 178.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.9 t -102.15 -161.24 0.84 Allowed 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 124.771 1.228 . . . . 0.0 110.59 168.548 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 49.4 mt -110.01 150.16 12.71 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 C-N-CA 126.59 1.956 . . . . 0.0 110.28 -179.541 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 12.2 p -141.34 158.77 43.43 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 114.571 1.322 . . . . 0.0 114.571 174.153 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 78.6 p -98.3 167.59 10.76 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 126.195 1.798 . . . . 0.0 113.478 175.696 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 31.4 mt -65.0 -27.63 68.96 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 121.356 -0.84 . . . . 0.0 112.053 173.644 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.5 t80 -67.02 -34.74 78.38 Favored 'General case' 0 CA--C 1.542 0.643 0 O-C-N 121.449 -0.782 . . . . 0.0 112.253 171.456 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 81.7 mt-30 -73.39 -26.5 61.01 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 118.746 -0.645 . . . . 0.0 112.073 172.873 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 68.7 mt -68.61 -49.45 59.18 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 119.47 1.032 . . . . 0.0 110.523 168.404 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 18.1 mm-40 -56.35 -30.56 62.78 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.71 1.204 . . . . 0.0 113.256 175.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -59.45 -24.19 63.34 Favored 'General case' 0 CA--C 1.55 0.945 0 N-CA-C 113.68 0.993 . . . . 0.0 113.68 178.549 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 78.8 m-85 -100.48 -2.46 33.09 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.224 1.41 . . . . 0.0 114.037 175.462 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 75.1 m -86.99 153.62 21.42 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 121.03 -1.044 . . . . 0.0 113.506 179.395 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 31.6 m120 . . . . . 0 C--O 1.253 1.244 0 C-N-CA 125.277 1.431 . . . . 0.0 113.241 179.46 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 22.8 p90 . . . . . 0 N--CA 1.486 1.339 0 CA-C-O 119.471 -0.3 . . . . 0.0 110.78 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 34.8 m -66.29 -21.36 28.61 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.325 0 N-CA-C 114.757 1.391 . . . . 0.0 114.757 -171.103 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 22.0 t-20 -73.96 111.63 9.31 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 169.358 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -162.97 -179.07 6.48 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 113.158 0.799 . . . . 0.0 113.158 -167.915 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 89.0 m-70 -81.95 136.76 35.26 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 123.502 0.721 . . . . 0.0 110.719 168.588 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 65.7 mt -142.04 135.02 28.79 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 126.411 1.884 . . . . 0.0 108.872 173.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 1.3 t -139.32 145.27 38.87 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 112.878 0.696 . . . . 0.0 112.878 -174.767 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 48.57 -123.34 10.1 Favored Glycine 0 N--CA 1.47 0.948 0 C-N-CA 125.197 1.38 . . . . 0.0 114.146 170.071 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 18.3 m -54.9 -36.74 65.49 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 124.606 1.162 . . . . 0.0 113.393 178.409 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 73.4 m-70 -76.62 -29.41 56.47 Favored 'General case' 0 CA--C 1.538 0.486 0 O-C-N 120.777 -1.202 . . . . 0.0 112.693 177.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 39.4 tp -69.81 -44.59 69.7 Favored 'General case' 0 N--CA 1.468 0.431 0 O-C-N 121.658 -0.651 . . . . 0.0 111.304 170.483 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 42.7 t -60.15 -44.26 94.85 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 125.15 1.38 . . . . 0.0 111.141 173.036 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -59.98 -46.78 88.32 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.993 1.317 . . . . 0.0 111.866 173.305 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.47 -43.03 99.8 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 118.942 0.792 . . . . 0.0 112.093 177.082 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 29.0 mt -58.35 -45.01 89.01 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 123.617 0.767 . . . . 0.0 111.366 174.73 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 11.5 m-85 -61.8 -44.67 96.4 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 123.243 0.617 . . . . 0.0 112.436 173.686 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 73.3 mt -68.14 -41.56 81.46 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 123.852 0.861 . . . . 0.0 112.52 -178.515 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 65.6 t -72.14 -48.79 47.59 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 C-N-CA 123.658 0.783 . . . . 0.0 111.527 -179.461 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 71.3 m -96.97 -17.24 20.2 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 115.013 1.486 . . . . 0.0 115.013 -169.487 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 67.76 -145.48 45.29 Favored Glycine 0 CA--C 1.53 1.017 0 C-N-CA 124.533 1.064 . . . . 0.0 113.834 172.585 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -61.06 -20.4 62.52 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.363 1.465 . . . . 0.0 113.906 -176.114 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 40.4 mtp180 -56.23 -38.53 71.2 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.032 1.333 . . . . 0.0 112.973 177.262 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.38 175.48 45.42 Favored Glycine 0 CA--C 1.535 1.337 0 C-N-CA 124.729 1.156 . . . . 0.0 113.618 -176.002 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 51.9 p90 -153.1 160.87 42.97 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.315 1.446 . . . . 0.0 113.865 -172.794 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 70.7 t80 -89.06 146.24 24.96 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.607 1.563 . . . . 0.0 110.937 170.038 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 56.4 t80 -155.26 129.36 8.81 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.846 0.858 . . . . 0.0 112.412 -178.482 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 21.3 p -146.49 159.16 45.54 Favored Pre-proline 0 N--CA 1.477 0.899 0 C-N-CA 126.739 2.015 . . . . 0.0 110.343 176.374 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -74.56 -179.83 5.22 Favored 'Trans proline' 0 C--N 1.351 0.699 0 C-N-CA 123.767 2.978 . . . . 0.0 112.202 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 48.5 mtmt -56.1 -32.68 64.39 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 124.811 1.244 . . . . 0.0 113.544 -179.367 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 24.9 p -88.44 -9.25 53.18 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 127.604 2.361 . . . . 0.0 113.934 179.71 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 58.9 tttm 72.47 -31.05 0.22 Allowed 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 128.444 2.698 . . . . 0.0 114.081 -177.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 17.3 ptm180 . . . . . 0 C--O 1.251 1.138 0 C-N-CA 126.859 2.063 . . . . 0.0 112.999 -176.087 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.446 ' HA3' HG23 ' B' ' 27' ' ' THR . . . . . . . . 0 N--CA 1.476 1.32 0 CA-C-O 119.455 -0.636 . . . . 0.0 112.398 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 14.1 tt -94.39 -32.04 4.55 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.114 0 CA-C-N 118.563 1.181 . . . . 0.0 114.072 -172.497 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 50.5 t -62.93 -38.19 81.27 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.32 0 CA-C-N 119.488 1.04 . . . . 0.0 111.184 -175.181 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.1 pm0 -67.22 -7.61 25.28 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 114.105 1.15 . . . . 0.0 114.105 176.641 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 13.2 tp60 -105.6 -56.76 2.13 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.295 1.038 . . . . 0.0 110.224 168.921 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 19.2 m -77.29 -25.37 51.29 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 115.025 1.491 . . . . 0.0 115.025 -170.559 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 34.2 t -96.31 -42.37 8.18 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 119.569 1.077 . . . . 0.0 111.807 178.043 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 33.7 m -62.74 -37.89 88.36 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 125.263 1.425 . . . . 0.0 112.153 176.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.9 t -138.22 -170.49 2.82 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.587 1.155 . . . . 0.0 110.952 178.54 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 55.2 mt -79.0 139.87 17.73 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 C-N-CA 124.713 1.205 . . . . 0.0 110.089 175.801 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 8.7 p -136.05 157.4 46.93 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 121.907 0.86 . . . . 0.0 113.056 169.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.4 m -104.55 164.3 11.85 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 125.168 1.387 . . . . 0.0 111.749 -173.062 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 45.3 mt -56.27 -32.03 64.16 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 121.458 -0.776 . . . . 0.0 112.235 172.177 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.7 t80 -61.58 -29.78 70.24 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 124.113 0.965 . . . . 0.0 113.4 174.221 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 61.6 mm-40 -78.87 -36.43 42.23 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.317 0.647 . . . . 0.0 110.484 175.652 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 87.2 mt -64.13 -43.52 95.03 Favored 'General case' 0 CA--C 1.539 0.546 0 O-C-N 121.813 -0.554 . . . . 0.0 111.467 171.716 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -59.39 -24.19 63.24 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.601 1.56 . . . . 0.0 114.172 173.765 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.4 t30 -77.3 -29.49 53.7 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 123.951 0.901 . . . . 0.0 112.702 176.247 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 27.0 m-85 -86.23 -1.3 57.34 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 124.625 1.17 . . . . 0.0 113.884 175.16 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 57.2 m -73.5 132.2 42.62 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 123.405 0.682 . . . . 0.0 110.36 168.593 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.251 1.161 0 C-N-CA 127.168 2.187 . . . . 0.0 112.765 -172.31 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 12.5 t80 . . . . . 0 N--CA 1.489 1.478 0 CA-C-O 118.757 -0.639 . . . . 0.0 110.301 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 92.1 t -61.67 122.48 12.39 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 CA-C-N 120.224 1.375 . . . . 0.0 111.457 -174.212 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 47.4 t30 -168.27 103.0 0.44 Allowed 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 126.351 1.861 . . . . 0.0 109.312 -174.063 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 3.0 mm-40 -164.21 179.51 6.82 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.802 1.241 . . . . 0.0 111.563 -168.817 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 40.9 m-70 -72.73 138.54 46.61 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 123.775 0.83 . . . . 0.0 110.37 168.173 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 72.6 mt -140.39 126.79 20.03 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 126.925 2.09 . . . . 0.0 109.045 175.613 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 87.4 m -128.0 141.92 51.38 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.61 1.164 . . . . 0.0 112.614 -172.382 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 47.94 -121.04 6.66 Favored Glycine 0 C--N 1.343 0.941 0 C-N-CA 125.273 1.416 . . . . 0.0 114.552 169.11 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 18.1 m -54.65 -37.69 65.99 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.835 1.254 . . . . 0.0 113.105 178.382 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 77.2 m-70 -75.07 -28.52 60.39 Favored 'General case' 0 CA--C 1.543 0.68 0 O-C-N 120.958 -1.089 . . . . 0.0 112.759 176.882 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 28.5 tp -70.08 -43.54 70.94 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 121.353 -0.842 . . . . 0.0 111.371 170.051 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 60.8 t -61.75 -41.8 91.94 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.094 0 C-N-CA 124.348 1.059 . . . . 0.0 110.891 173.009 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -58.35 -49.87 75.69 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.894 1.277 . . . . 0.0 111.49 173.666 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.41 -42.4 96.08 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.532 0.733 . . . . 0.0 111.645 179.454 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 47.0 mt -56.69 -51.11 70.04 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-O 118.661 -0.685 . . . . 0.0 111.349 173.685 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -66.47 -35.18 79.65 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 119.897 1.226 . . . . 0.0 112.271 -178.193 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 83.8 mt -68.95 -41.14 78.44 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 123.611 0.765 . . . . 0.0 112.525 176.422 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 41.9 t -71.5 -46.58 62.82 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.984 0 C-N-CA 123.66 0.784 . . . . 0.0 112.002 177.389 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 72.0 m -78.13 -38.34 44.1 Favored 'General case' 0 N--CA 1.466 0.334 0 N-CA-C 113.306 0.854 . . . . 0.0 113.306 -173.072 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 56.36 -123.71 32.34 Favored Glycine 0 CA--C 1.53 1.013 0 C-N-CA 123.659 0.647 . . . . 0.0 111.912 -179.602 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 3.2 pm0 -67.01 -15.45 63.74 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.671 1.588 . . . . 0.0 114.705 178.374 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 81.8 mtp180 -67.99 -26.22 65.81 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 119.106 0.866 . . . . 0.0 112.732 178.607 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.42 168.69 20.11 Favored Glycine 0 CA--C 1.534 1.229 0 C-N-CA 124.616 1.103 . . . . 0.0 112.245 -169.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 34.3 p90 -152.96 165.68 34.78 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 125.026 1.33 . . . . 0.0 112.821 -178.423 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -132.11 104.81 7.0 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 123.933 0.893 . . . . 0.0 110.49 171.141 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 83.7 t80 -73.4 148.98 42.83 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 123.97 0.908 . . . . 0.0 111.394 171.139 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . 0.446 HG23 ' HA3' ' A' ' 1' ' ' GLY . 0.1 OUTLIER -158.02 115.51 1.81 Allowed Pre-proline 0 N--CA 1.472 0.657 0 C-N-CA 124.997 1.319 . . . . 0.0 109.659 178.694 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_endo -79.71 177.38 8.49 Favored 'Trans proline' 0 CA--C 1.534 0.508 0 C-N-CA 123.982 3.121 . . . . 0.0 112.686 -172.607 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -63.05 -24.64 68.01 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 125.036 1.334 . . . . 0.0 112.605 176.034 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 22.4 p -82.05 -9.07 59.67 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 126.746 2.018 . . . . 0.0 113.793 172.178 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 18.1 ttmm 84.73 143.29 0.06 Allowed 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 129.008 2.923 . . . . 0.0 113.662 170.188 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 13.4 ttp180 . . . . . 0 C--O 1.251 1.16 0 C-N-CA 126.466 1.906 . . . . 0.0 110.869 170.105 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.372 0 N-CA-C 109.79 -1.324 . . . . 0.0 109.79 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 14.2 tt -179.74 -51.79 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.252 0 C-N-CA 128.197 2.599 . . . . 0.0 110.96 170.31 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 2.7 t -65.73 -33.11 61.41 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.127 0 C-N-CA 123.556 0.743 . . . . 0.0 111.184 -171.655 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.5 pm0 -68.67 -8.96 47.2 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.961 1.305 . . . . 0.0 113.879 175.318 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 72.0 tp60 -103.72 -58.42 1.88 Allowed 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.108 0.963 . . . . 0.0 108.951 168.208 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 41.8 m -65.86 -31.17 71.97 Favored 'General case' 0 N--CA 1.469 0.486 0 N-CA-C 115.159 1.54 . . . . 0.0 115.159 -170.729 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 48.5 t -96.97 -47.34 5.85 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 119.09 0.859 . . . . 0.0 112.167 -178.398 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 32.1 m -69.95 -31.52 69.29 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 125.496 1.518 . . . . 0.0 111.887 -179.504 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.4 t -133.36 -152.87 0.51 Allowed 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.34 1.456 . . . . 0.0 109.974 172.503 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 78.5 mt -101.34 147.55 8.17 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 C-N-CA 126.522 1.929 . . . . 0.0 109.76 179.283 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.0 p -138.5 160.97 38.21 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 113.103 0.779 . . . . 0.0 113.103 169.252 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 76.6 p -105.74 163.01 13.04 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 125.46 1.504 . . . . 0.0 113.626 -174.811 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 81.6 mt -60.51 -33.24 72.34 Favored 'General case' 0 N--CA 1.471 0.581 0 O-C-N 121.47 -0.769 . . . . 0.0 111.984 170.18 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 91.6 t80 -65.25 -36.17 83.29 Favored 'General case' 0 N--CA 1.47 0.544 0 O-C-N 121.604 -0.685 . . . . 0.0 112.327 174.271 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 87.8 mt-30 -70.18 -40.15 74.81 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 118.563 -0.732 . . . . 0.0 111.054 172.177 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 73.0 mt -58.77 -41.52 86.78 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 119.549 1.068 . . . . 0.0 111.979 172.07 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.4 ' HA ' ' SG ' ' A' ' 20' ' ' CYS . 18.3 mt-10 -63.21 -35.68 81.13 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 113.527 0.936 . . . . 0.0 113.527 171.81 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 26.9 t30 -65.37 -24.07 67.14 Favored 'General case' 0 CA--C 1.547 0.837 0 O-C-N 120.94 -1.1 . . . . 0.0 112.429 174.355 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 47.6 m-85 -90.99 0.71 57.47 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 125.163 1.385 . . . . 0.0 114.056 173.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.4 ' SG ' ' HA ' ' A' ' 17' ' ' GLU . 67.2 m -71.74 149.59 45.25 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 120.93 -1.106 . . . . 0.0 111.307 169.172 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 . . . . . 0 C--O 1.251 1.184 0 C-N-CA 125.342 1.457 . . . . 0.0 112.999 -179.569 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 82.0 m-85 . . . . . 0 N--CA 1.486 1.326 0 CA-C-O 119.34 -0.362 . . . . 0.0 111.359 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 22.8 t 73.83 -50.28 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 C-N-CA 128.252 2.621 . . . . 0.0 113.21 172.633 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 3.6 m120 -99.79 134.03 43.28 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.236 1.415 . . . . 0.0 111.362 -178.671 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 2.4 mm-40 -159.75 169.94 22.57 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.977 1.311 . . . . 0.0 112.508 -178.065 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 97.0 m-70 -88.98 135.29 33.63 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.784 1.233 . . . . 0.0 109.372 167.191 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 77.5 mt -143.81 119.46 10.44 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 125.592 1.557 . . . . 0.0 109.521 -177.555 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 86.4 m -123.78 130.79 53.17 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.818 1.247 . . . . 0.0 112.543 -176.468 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 58.83 -121.12 25.54 Favored Glycine 0 N--CA 1.472 1.063 0 C-N-CA 124.815 1.198 . . . . 0.0 113.998 169.243 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 24.1 p -53.47 -43.15 67.92 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 124.437 1.095 . . . . 0.0 112.501 177.182 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 27.4 m80 -61.08 -40.74 94.84 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.313 1.045 . . . . 0.0 112.031 177.428 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 47.3 tp -66.72 -45.91 77.18 Favored 'General case' 0 C--O 1.223 -0.323 0 C-N-CA 124.117 0.967 . . . . 0.0 111.363 174.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 68.6 t -62.89 -42.16 95.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 C-N-CA 123.903 0.881 . . . . 0.0 111.241 178.339 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.7 mm-40 -59.01 -52.04 67.48 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.677 0.791 . . . . 0.0 111.216 173.436 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.79 -44.74 89.01 Favored 'General case' 0 CA--C 1.538 0.518 0 O-C-N 121.681 -0.637 . . . . 0.0 111.905 -177.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 62.5 tp -58.66 -50.03 75.38 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 125.023 1.329 . . . . 0.0 111.217 178.513 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -68.01 -35.83 78.96 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 119.437 1.017 . . . . 0.0 112.291 179.258 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 78.4 mt -67.47 -36.33 80.93 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 118.864 0.757 . . . . 0.0 112.195 176.129 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 33.4 t -67.04 -45.66 86.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 CA-C-N 118.906 0.776 . . . . 0.0 111.482 171.895 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 72.2 m -73.6 -34.54 65.11 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 113.655 0.983 . . . . 0.0 113.655 -176.763 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 64.49 -130.93 37.84 Favored Glycine 0 CA--C 1.529 0.931 0 C-N-CA 124.142 0.877 . . . . 0.0 111.041 -177.698 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -65.91 -15.25 62.78 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 114.47 1.285 . . . . 0.0 114.47 178.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 83.4 mtm180 -66.89 -32.75 74.21 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.21 1.004 . . . . 0.0 113.564 -176.641 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.09 176.63 44.36 Favored Glycine 0 CA--C 1.533 1.204 0 C-N-CA 123.867 0.746 . . . . 0.0 112.212 -169.587 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 45.3 p90 -149.14 159.62 44.08 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 114.881 1.437 . . . . 0.0 114.881 -168.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 76.8 t80 -100.35 136.44 40.24 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 126.601 1.961 . . . . 0.0 109.691 169.255 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 64.1 t80 -153.94 122.34 6.18 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.775 0.83 . . . . 0.0 112.283 -179.7 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 9.3 t 170.87 136.17 0.07 OUTLIER Pre-proline 0 N--CA 1.479 1.007 0 C-N-CA 129.316 3.046 . . . . 0.0 109.544 170.811 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -85.24 166.71 10.85 Favored 'Trans proline' 0 CA--C 1.536 0.624 0 C-N-CA 123.628 2.885 . . . . 0.0 112.07 174.857 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 94.0 mttt -94.78 -49.44 5.6 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 112.807 0.669 . . . . 0.0 112.807 169.408 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 30.5 p -88.54 -36.23 16.5 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 125.489 1.516 . . . . 0.0 113.499 -173.772 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 30.1 mtpp -81.78 -3.33 53.61 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 124.413 1.085 . . . . 0.0 113.846 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 74.8 ttt-85 . . . . . 0 C--O 1.253 1.247 0 C-N-CA 126.786 2.034 . . . . 0.0 112.672 -177.679 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.541 0 N-CA-C 111.84 -0.504 . . . . 0.0 111.84 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 17.8 tt -60.03 -33.65 53.8 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.256 0 N-CA-C 114.026 1.121 . . . . 0.0 114.026 -170.322 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 41.9 t -66.77 -32.55 58.53 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.99 0 C-N-CA 123.556 0.742 . . . . 0.0 111.745 -178.342 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -69.25 -48.07 62.89 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.398 0.679 . . . . 0.0 110.498 169.799 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 31.7 tt0 -69.1 -45.63 69.76 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 124.005 0.922 . . . . 0.0 111.979 -169.946 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 61.0 m -64.05 -24.49 67.72 Favored 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 113.617 0.969 . . . . 0.0 113.617 175.475 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 37.3 t -92.95 -42.6 9.38 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 118.746 0.703 . . . . 0.0 112.158 -177.714 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 69.6 p -79.67 -21.95 44.09 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 124.981 1.313 . . . . 0.0 113.64 179.361 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 9.0 t -142.14 -166.89 2.34 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.327 1.451 . . . . 0.0 111.099 175.326 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 71.0 mt -97.76 112.23 29.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 O-C-N 120.57 -1.331 . . . . 0.0 108.172 170.889 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 31.6 p -83.58 156.62 22.66 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 123.694 0.798 . . . . 0.0 111.298 171.036 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 48.7 m -83.59 149.64 26.43 Favored 'General case' 0 N--CA 1.471 0.613 0 O-C-N 120.747 -1.221 . . . . 0.0 111.72 -178.118 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 74.2 mt -60.81 -26.71 67.5 Favored 'General case' 0 CA--C 1.546 0.801 0 O-C-N 121.048 -1.032 . . . . 0.0 111.556 171.008 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 82.7 t80 -65.12 -28.53 69.49 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 124.885 1.274 . . . . 0.0 113.808 169.807 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 94.5 mt-30 -79.56 -36.15 38.72 Favored 'General case' 0 N--CA 1.472 0.628 0 O-C-N 121.048 -1.033 . . . . 0.0 110.279 174.59 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 82.1 mt -61.26 -42.99 99.57 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 118.598 0.635 . . . . 0.0 111.419 169.082 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 45.8 mm-40 -60.75 -34.3 74.23 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.561 1.144 . . . . 0.0 113.312 170.84 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 17.0 t30 -64.63 -28.65 69.76 Favored 'General case' 0 CA--C 1.546 0.817 0 O-C-N 121.021 -1.049 . . . . 0.0 112.703 179.2 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 23.8 m-85 -87.79 -12.22 45.7 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 124.547 1.139 . . . . 0.0 113.394 173.727 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 35.1 t -80.53 174.01 12.03 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.416 1.486 . . . . 0.0 111.525 168.784 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 12.6 m-80 . . . . . 0 C--O 1.251 1.146 0 C-N-CA 125.126 1.37 . . . . 0.0 112.672 171.336 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 71.1 m-85 . . . . . 0 N--CA 1.489 1.489 0 N-CA-C 111.466 0.173 . . . . 0.0 111.466 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 8.5 p -63.36 150.0 9.94 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.125 0 C-N-CA 124.734 1.214 . . . . 0.0 112.435 178.337 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 43.4 t30 81.24 178.96 0.08 Allowed 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 127.628 2.371 . . . . 0.0 113.421 172.262 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 38.0 mt-30 -134.99 -179.97 5.95 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 127.091 2.156 . . . . 0.0 110.218 -176.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 27.0 m-70 -69.68 135.67 50.13 Favored 'General case' 0 CA--C 1.546 0.821 0 O-C-N 121.202 -0.936 . . . . 0.0 110.246 168.691 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 87.7 mt -137.34 118.59 14.57 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 126.803 2.041 . . . . 0.0 109.601 -176.888 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 85.9 m -123.7 139.6 53.83 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.213 1.405 . . . . 0.0 111.307 -178.268 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 50.84 -123.88 18.31 Favored Glycine 0 N--CA 1.473 1.14 0 C-N-CA 124.693 1.14 . . . . 0.0 114.582 169.518 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 18.5 m -56.02 -32.74 64.28 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.542 1.137 . . . . 0.0 113.389 178.63 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 1.4 t-80 -72.72 -35.04 67.49 Favored 'General case' 0 CA--C 1.54 0.585 0 O-C-N 120.825 -1.172 . . . . 0.0 111.537 176.711 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 49.8 tp -68.43 -42.1 79.38 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 123.66 0.784 . . . . 0.0 111.474 171.446 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 65.3 t -59.94 -44.07 93.67 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 C-N-CA 123.577 0.751 . . . . 0.0 110.566 173.707 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -63.12 -44.24 96.16 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.52 0.728 . . . . 0.0 112.215 174.842 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.47 -39.87 94.82 Favored 'General case' 0 CA--C 1.537 0.479 0 O-C-N 121.221 -0.924 . . . . 0.0 112.179 175.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 37.0 mt -62.71 -41.7 99.28 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 123.612 0.765 . . . . 0.0 111.455 173.748 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 19.7 m-85 -61.42 -40.99 96.42 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-N 119.915 1.234 . . . . 0.0 112.376 171.601 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 77.8 mt -68.22 -42.59 79.59 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.772 0.829 . . . . 0.0 112.816 178.188 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 46.8 t -72.71 -47.43 50.23 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 124.005 0.922 . . . . 0.0 111.608 178.512 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 33.9 t -83.35 -41.37 18.29 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 113.432 0.901 . . . . 0.0 113.432 -170.393 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 70.62 -143.07 36.27 Favored Glycine 0 CA--C 1.53 1.025 0 C-N-CA 124.217 0.913 . . . . 0.0 112.514 -176.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -64.67 -18.58 65.09 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 125.234 1.414 . . . . 0.0 113.518 -178.161 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 71.0 mtm180 -60.84 -30.67 70.25 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.664 1.185 . . . . 0.0 114.084 -177.236 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 80.46 142.23 2.98 Favored Glycine 0 CA--C 1.534 1.237 0 C-N-CA 125.57 1.557 . . . . 0.0 113.352 179.628 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 52.7 p90 -129.41 155.85 45.01 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 125.199 1.4 . . . . 0.0 112.579 -177.764 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -85.83 143.67 28.14 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.485 1.114 . . . . 0.0 110.571 171.248 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 65.0 t80 -158.84 130.61 6.52 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.242 1.017 . . . . 0.0 112.732 -179.775 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 98.6 m -144.25 121.95 6.69 Favored Pre-proline 0 N--CA 1.475 0.803 0 C-N-CA 126.302 1.841 . . . . 0.0 108.065 170.09 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_endo -80.83 153.01 19.52 Favored 'Trans proline' 0 N--CA 1.458 -0.617 0 C-N-CA 123.053 2.502 . . . . 0.0 110.548 177.215 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 5.2 tmtt? -67.52 -14.17 62.7 Favored 'General case' 0 CA--C 1.547 0.865 0 N-CA-C 114.081 1.141 . . . . 0.0 114.081 -178.079 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 27.1 p -69.53 -29.18 66.72 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 125.643 1.577 . . . . 0.0 112.44 170.286 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -86.31 -41.33 14.65 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.436 1.094 . . . . 0.0 112.704 177.833 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 60.0 ttt85 . . . . . 0 C--O 1.252 1.187 0 C-N-CA 125.667 1.587 . . . . 0.0 112.23 -176.929 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.737 0 N-CA-C 111.093 -0.803 . . . . 0.0 111.093 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 9.2 tp -53.39 -35.52 24.94 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.335 0 C-N-CA 125.016 1.326 . . . . 0.0 114.544 -169.853 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 16.4 t -62.78 -33.25 59.09 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.888 0 C-N-CA 124.467 1.107 . . . . 0.0 111.72 -178.139 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -70.05 -21.53 63.16 Favored 'General case' 0 CA--C 1.544 0.72 0 O-C-N 121.508 -0.745 . . . . 0.0 112.485 176.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 72.0 tp60 -87.56 -59.34 2.28 Favored 'General case' 0 CA--C 1.535 0.375 0 O-C-N 121.516 -0.74 . . . . 0.0 110.025 170.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 63.0 m -70.52 -32.37 69.81 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 114.75 1.389 . . . . 0.0 114.75 -169.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 16.5 t -82.91 -53.62 5.71 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 119.523 1.056 . . . . 0.0 110.936 -176.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 17.7 m -77.95 -24.39 48.2 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 126.278 1.831 . . . . 0.0 112.655 -174.008 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.4 t -137.77 -167.28 2.11 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.085 1.354 . . . . 0.0 111.364 176.308 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 69.9 mt -86.04 145.26 8.01 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 C-N-CA 124.699 1.199 . . . . 0.0 109.946 175.694 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.0 p -137.83 159.27 42.46 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 114.146 1.165 . . . . 0.0 114.146 171.583 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 87.9 p -117.57 168.31 10.52 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.63 1.572 . . . . 0.0 113.394 -176.452 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 79.0 mt -57.11 -34.03 67.95 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 124.214 1.006 . . . . 0.0 112.78 177.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 89.3 t80 -61.43 -32.76 72.73 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.235 1.014 . . . . 0.0 112.583 175.189 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 90.9 mt-30 -82.75 -31.28 28.44 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.815 0.846 . . . . 0.0 111.107 177.699 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 76.1 mt -65.92 -41.35 91.52 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 118.725 0.693 . . . . 0.0 111.55 169.722 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 45.7 mm-40 -60.27 -37.51 80.65 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.911 1.285 . . . . 0.0 112.705 169.724 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.8 t-20 -61.97 -26.22 68.08 Favored 'General case' 0 CA--C 1.55 0.97 0 O-C-N 121.085 -1.009 . . . . 0.0 113.542 -175.829 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 51.5 m-85 -97.26 -2.0 43.6 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 125.267 1.427 . . . . 0.0 113.874 175.561 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 18.7 t -79.72 172.03 14.34 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.861 1.265 . . . . 0.0 111.394 168.826 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 9.1 m-80 . . . . . 0 C--O 1.256 1.407 0 C-N-CA 124.497 1.119 . . . . 0.0 112.494 171.723 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.48 0 CA-C-O 119.17 -0.443 . . . . 0.0 111.367 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 92.3 t -87.43 110.06 20.15 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 CA-C-N 119.513 1.051 . . . . 0.0 109.273 177.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 37.3 t30 -162.53 98.66 1.01 Allowed 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 127.312 2.245 . . . . 0.0 107.615 -179.279 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 6.1 tt0 -161.04 170.28 20.83 Favored 'General case' 0 N--CA 1.476 0.826 0 O-C-N 121.542 -0.724 . . . . 0.0 112.119 -166.264 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 31.6 m-70 -73.77 141.93 46.25 Favored 'General case' 0 CA--C 1.549 0.906 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 164.268 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 76.5 mt -145.21 133.55 21.78 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 126.884 2.073 . . . . 0.0 108.733 175.569 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.7 t -146.69 154.52 41.53 Favored 'General case' 0 N--CA 1.471 0.62 0 O-C-N 121.363 -0.836 . . . . 0.0 113.209 -178.814 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 54.99 -133.98 48.18 Favored Glycine 0 N--CA 1.471 0.989 0 C-N-CA 124.436 1.017 . . . . 0.0 113.021 176.612 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 18.4 m -54.36 -36.55 63.97 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.207 1.003 . . . . 0.0 113.028 177.889 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 17.5 t-160 -67.76 -39.05 84.18 Favored 'General case' 0 CA--C 1.544 0.733 0 O-C-N 120.942 -1.099 . . . . 0.0 111.721 179.598 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 39.8 tp -67.62 -42.75 81.87 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 123.569 0.747 . . . . 0.0 111.882 172.017 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 54.2 t -59.99 -43.41 92.41 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 C-N-CA 123.361 0.665 . . . . 0.0 110.867 175.244 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -64.86 -42.42 94.87 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 123.624 0.77 . . . . 0.0 112.4 174.339 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.28 -42.33 98.46 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 119.443 1.02 . . . . 0.0 112.106 174.459 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 51.0 mt -61.91 -43.08 99.57 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.688 0.795 . . . . 0.0 111.489 174.408 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 13.6 m-85 -59.79 -44.09 94.1 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 119.885 1.221 . . . . 0.0 112.329 172.224 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 74.5 mt -66.67 -42.03 87.21 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.829 0.852 . . . . 0.0 112.437 179.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 60.1 t -76.24 -49.38 25.27 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 123.359 0.664 . . . . 0.0 111.977 179.818 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 48.5 t -79.13 -39.62 33.11 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 113.014 0.746 . . . . 0.0 113.014 -172.209 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 69.39 -142.03 36.51 Favored Glycine 0 CA--C 1.53 1.016 0 C-N-CA 124.326 0.965 . . . . 0.0 112.296 -179.348 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -64.26 -19.08 65.15 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 125.221 1.408 . . . . 0.0 113.637 -176.658 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 80.3 mtm180 -60.73 -32.87 72.12 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.899 1.28 . . . . 0.0 113.797 -178.368 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 80.52 142.79 3.16 Favored Glycine 0 CA--C 1.534 1.263 0 C-N-CA 125.212 1.387 . . . . 0.0 113.419 -178.491 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 50.8 p90 -129.11 158.43 38.98 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.653 1.581 . . . . 0.0 112.766 -175.518 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 81.7 t80 -83.41 140.75 32.19 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.862 0.865 . . . . 0.0 110.893 169.625 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 65.1 t80 -149.46 142.47 24.86 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.714 1.206 . . . . 0.0 111.723 173.52 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 3.5 m -162.42 131.4 3.05 Favored Pre-proline 0 N--CA 1.478 0.938 0 C-N-CA 127.65 2.38 . . . . 0.0 107.325 173.077 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -72.07 113.09 3.58 Favored 'Trans proline' 0 C--N 1.35 0.656 0 C-N-CA 122.712 2.275 . . . . 0.0 110.239 178.376 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 28.4 tptp -93.2 -55.61 3.26 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.765 0.826 . . . . 0.0 111.574 -179.539 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 25.4 p -100.17 -19.16 16.56 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 126.022 1.729 . . . . 0.0 113.153 176.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 26.8 tptp -75.63 -20.2 58.67 Favored 'General case' 0 CA--C 1.553 1.058 0 C-N-CA 124.814 1.246 . . . . 0.0 113.483 174.806 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 51.7 tpt85 . . . . . 0 C--O 1.253 1.275 0 C-N-CA 125.734 1.614 . . . . 0.0 113.292 -178.37 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.408 0 CA-C-O 119.19 -0.784 . . . . 0.0 111.42 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 9.5 tt -177.16 -48.75 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.255 0 C-N-CA 127.812 2.445 . . . . 0.0 111.623 -177.535 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 8.4 p -67.56 -21.92 28.03 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 124.256 1.022 . . . . 0.0 112.445 -174.515 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -64.1 -10.19 20.99 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 125.882 1.673 . . . . 0.0 113.173 171.625 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 11.6 tt0 -113.06 -50.98 2.85 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 126.137 1.775 . . . . 0.0 109.452 168.368 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 61.0 m -67.49 -22.46 65.46 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 115.404 1.631 . . . . 0.0 115.404 -171.249 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 37.2 t -102.58 -33.76 9.35 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 119.398 0.999 . . . . 0.0 113.0 177.436 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 44.5 p -72.35 -34.53 68.08 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 125.211 1.404 . . . . 0.0 111.969 178.694 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 9.1 t -134.05 -161.32 1.13 Allowed 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 126.453 1.901 . . . . 0.0 110.031 172.844 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 66.9 mt -101.86 116.61 45.8 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 C-N-CA 124.628 1.171 . . . . 0.0 108.148 171.223 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 21.7 p -89.58 152.69 21.27 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.294 0.637 . . . . 0.0 111.111 169.777 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 36.9 t -80.61 151.32 29.1 Favored 'General case' 0 N--CA 1.47 0.561 0 O-C-N 120.902 -1.124 . . . . 0.0 112.089 -176.449 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 80.0 mt -57.96 -32.78 68.16 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 121.402 -0.811 . . . . 0.0 111.217 170.268 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 83.4 t80 -64.35 -27.43 69.01 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.053 0.941 . . . . 0.0 113.071 173.654 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 80.2 mt-30 -80.79 -39.0 27.5 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 123.399 0.68 . . . . 0.0 110.551 173.445 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 58.6 mt -57.24 -42.31 81.23 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 119.275 0.943 . . . . 0.0 111.783 172.045 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -60.54 -17.51 46.33 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 114.74 1.385 . . . . 0.0 114.74 174.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 14.6 t-20 -70.04 -24.06 63.2 Favored 'General case' 0 CA--C 1.547 0.843 0 CA-C-N 119.878 1.217 . . . . 0.0 112.963 176.014 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 88.4 m-85 -94.01 -2.06 53.59 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.118 1.367 . . . . 0.0 113.805 -177.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 82.9 m -70.03 132.2 45.52 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.61 1.164 . . . . 0.0 112.112 177.445 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.253 1.261 0 C-N-CA 128.229 2.611 . . . . 0.0 112.313 -172.447 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 72.1 m-85 . . . . . 0 N--CA 1.486 1.366 0 CA-C-O 119.439 -0.315 . . . . 0.0 110.541 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 7.6 p -161.5 144.99 4.23 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 C-N-CA 124.576 1.15 . . . . 0.0 111.245 -178.726 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 53.1 t30 -85.82 -157.8 0.35 Allowed 'General case' 0 CA--C 1.557 1.224 0 C-N-CA 125.423 1.489 . . . . 0.0 111.029 174.483 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 45.8 mm-40 -135.31 173.08 12.11 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 126.083 1.753 . . . . 0.0 110.792 175.247 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 32.4 m-70 -69.0 133.43 48.13 Favored 'General case' 0 CA--C 1.544 0.72 0 O-C-N 121.647 -0.658 . . . . 0.0 109.988 169.469 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 87.2 mt -133.84 120.47 20.49 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 125.871 1.669 . . . . 0.0 109.843 -176.244 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -121.5 140.04 52.71 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 125.05 1.34 . . . . 0.0 111.988 -179.321 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 52.94 -126.46 33.03 Favored Glycine 0 CA--C 1.53 1.006 0 C-N-CA 124.79 1.186 . . . . 0.0 114.484 169.867 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 20.6 m -56.41 -29.59 61.75 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 124.533 1.133 . . . . 0.0 113.325 178.499 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 29.6 m80 -69.47 -40.68 76.95 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 120.877 -1.139 . . . . 0.0 111.335 176.541 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 49.5 tp -65.9 -43.14 89.1 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.307 1.043 . . . . 0.0 111.153 173.657 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 41.5 t -59.87 -46.24 94.06 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 124.469 1.108 . . . . 0.0 111.188 174.364 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -64.24 -44.0 93.18 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 123.502 0.721 . . . . 0.0 111.404 177.151 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.41 -44.12 92.91 Favored 'General case' 0 CA--C 1.539 0.521 0 O-C-N 121.557 -0.715 . . . . 0.0 111.253 175.896 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 18.1 mt -60.31 -45.34 93.72 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.899 0.879 . . . . 0.0 111.878 175.538 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -57.51 -44.75 85.27 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 119.439 1.018 . . . . 0.0 112.759 174.236 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 10.0 mp -69.69 -41.18 75.78 Favored 'General case' 0 N--CA 1.471 0.575 0 C-N-CA 123.432 0.693 . . . . 0.0 112.454 178.888 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 29.9 t -66.46 -43.53 90.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 124.388 1.075 . . . . 0.0 111.485 178.629 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 71.2 m -72.94 -45.37 58.45 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 118.795 0.725 . . . . 0.0 112.763 -178.586 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.4 -129.68 40.21 Favored Glycine 0 CA--C 1.533 1.198 0 C-N-CA 124.269 0.938 . . . . 0.0 112.0 179.308 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -59.84 -21.16 60.55 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 125.081 1.352 . . . . 0.0 113.557 -179.514 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 83.5 mtm180 -67.94 -16.37 64.03 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.548 1.139 . . . . 0.0 113.841 177.226 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.87 159.93 25.4 Favored Glycine 0 CA--C 1.53 1.006 0 C-N-CA 125.35 1.452 . . . . 0.0 113.35 -179.919 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 68.8 t80 -159.15 148.27 18.48 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.482 1.113 . . . . 0.0 112.346 178.114 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 90.2 t80 -174.82 114.8 0.16 Allowed 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 127.778 2.431 . . . . 0.0 109.624 168.318 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 35.5 t80 -167.84 143.28 3.84 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 126.004 1.722 . . . . 0.0 110.439 178.558 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 10.3 p -103.4 129.21 25.89 Favored Pre-proline 0 N--CA 1.475 0.817 0 C-N-CA 124.825 1.25 . . . . 0.0 112.15 -169.71 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -85.82 150.11 9.81 Favored 'Trans proline' 0 C--N 1.352 0.734 0 C-N-CA 123.762 2.974 . . . . 0.0 111.403 176.178 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 81.7 tttt -60.79 -17.69 50.81 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 124.833 1.253 . . . . 0.0 113.867 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 7.0 m -57.83 -39.92 78.8 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 126.868 2.067 . . . . 0.0 112.52 176.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 20.5 pttp -136.46 -0.38 2.42 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 115.813 1.783 . . . . 0.0 115.813 -172.83 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 7.0 tpm_? . . . . . 0 C--O 1.251 1.158 0 C-N-CA 125.027 1.331 . . . . 0.0 111.361 169.49 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.644 0 N-CA-C 111.116 -0.793 . . . . 0.0 111.116 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 15.1 tt -59.16 -31.13 45.31 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 N-CA-C 115.537 1.68 . . . . 0.0 115.537 -169.204 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 4.7 p -59.64 -34.01 53.79 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.248 0 CA-C-N 119.87 1.214 . . . . 0.0 112.562 176.585 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -69.61 -14.71 62.97 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 123.982 0.913 . . . . 0.0 112.648 178.625 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 27.6 tt0 -99.89 -55.69 2.57 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.816 0.846 . . . . 0.0 111.098 171.683 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 59.6 m -59.08 -27.77 65.85 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 114.578 1.325 . . . . 0.0 114.578 -171.78 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 68.2 m -70.44 -29.86 66.56 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 113.641 0.978 . . . . 0.0 113.641 -179.086 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 33.5 p -122.66 -37.57 2.75 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 125.003 1.321 . . . . 0.0 112.781 -170.124 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 50.8 m -100.46 163.99 12.12 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.319 1.447 . . . . 0.0 110.992 171.072 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 16.0 tt -81.46 132.07 32.39 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 O-C-N 121.542 -0.724 . . . . 0.0 109.534 174.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 13.9 p -128.2 165.92 19.52 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.6 1.16 . . . . 0.0 111.975 -176.764 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 38.1 t -116.03 151.39 35.6 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 -169.456 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 9.6 mp -58.26 -28.89 65.34 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 123.707 0.803 . . . . 0.0 111.742 169.817 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 87.7 t80 -60.36 -32.37 71.22 Favored 'General case' 0 CA--C 1.541 0.622 0 O-C-N 121.623 -0.673 . . . . 0.0 112.567 171.583 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 56.9 mt-30 -80.49 -35.24 35.01 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 123.953 0.901 . . . . 0.0 111.017 176.676 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 82.4 mt -59.27 -43.12 92.52 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-N 118.459 0.572 . . . . 0.0 111.189 171.294 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -68.5 -33.68 74.57 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 123.675 0.79 . . . . 0.0 112.972 172.779 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 22.7 t-20 -66.22 -33.19 75.2 Favored 'General case' 0 CA--C 1.546 0.801 0 O-C-N 120.606 -1.309 . . . . 0.0 112.356 176.287 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 19.2 m-85 -82.59 -1.46 50.9 Favored 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 125.513 1.525 . . . . 0.0 113.658 171.161 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 10.6 t -86.78 179.5 6.74 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 124.844 1.257 . . . . 0.0 112.17 170.02 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 . . . . . 0 C--O 1.253 1.244 0 C-N-CA 125.578 1.551 . . . . 0.0 113.235 179.776 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 34.0 t80 . . . . . 0 N--CA 1.49 1.557 0 CA-C-O 119.435 -0.317 . . . . 0.0 110.829 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 7.0 p -60.76 -23.96 30.75 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 C-N-CA 124.731 1.212 . . . . 0.0 114.054 -173.742 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 2.9 p30 -137.99 136.65 37.13 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.949 1.3 . . . . 0.0 109.646 167.718 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 5.0 tt0 -169.23 169.31 9.32 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.163 0.985 . . . . 0.0 111.246 -167.336 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 99.6 m-70 -85.12 142.77 29.28 Favored 'General case' 0 CA--C 1.543 0.703 0 O-C-N 121.381 -0.825 . . . . 0.0 108.782 165.5 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 86.0 mt -148.66 132.15 16.7 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 125.827 1.651 . . . . 0.0 109.65 -179.039 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.7 t -145.16 136.09 24.68 Favored 'General case' 0 N--CA 1.469 0.522 0 O-C-N 121.346 -0.846 . . . . 0.0 113.068 -178.348 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 58.56 -122.8 31.2 Favored Glycine 0 N--CA 1.469 0.862 0 C-N-CA 124.564 1.078 . . . . 0.0 112.962 174.795 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 25.8 p -54.36 -34.77 61.83 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.767 1.227 . . . . 0.0 113.281 176.8 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 35.1 m80 -68.49 -40.77 80.78 Favored 'General case' 0 CA--C 1.543 0.708 0 O-C-N 120.909 -1.12 . . . . 0.0 111.599 177.311 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 63.4 tp -67.92 -43.43 79.21 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 123.807 0.843 . . . . 0.0 110.999 175.06 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 44.9 t -59.49 -46.02 93.26 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 124.131 0.973 . . . . 0.0 110.647 174.625 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -63.37 -43.31 97.99 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.524 0.729 . . . . 0.0 111.65 176.179 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.65 -42.89 97.91 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 118.911 0.778 . . . . 0.0 112.192 174.679 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 49.0 mt -62.16 -39.54 92.98 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 118.718 0.69 . . . . 0.0 111.879 175.474 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 30.4 m-85 -67.58 -38.32 83.87 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 119.407 1.003 . . . . 0.0 113.104 172.665 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 75.4 mt -69.33 -44.28 71.99 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 119.295 0.952 . . . . 0.0 112.079 176.943 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 73.9 t -77.54 -41.05 29.02 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 C-N-CA 124.49 1.116 . . . . 0.0 112.171 -177.297 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -139.43 8.77 2.44 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 115.925 1.824 . . . . 0.0 115.925 -168.75 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -61.95 -31.04 77.1 Favored Glycine 0 N--CA 1.476 1.359 0 CA-C-N 120.135 1.334 . . . . 0.0 114.725 -171.654 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -78.48 -33.96 47.88 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 118.198 0.999 . . . . 0.0 112.623 176.97 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 81.2 mtm180 -72.71 -29.01 63.02 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 124.079 0.952 . . . . 0.0 111.806 170.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 83.19 109.03 0.5 Allowed Glycine 0 CA--C 1.529 0.911 0 C-N-CA 126.549 2.023 . . . . 0.0 111.196 -179.262 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 50.6 p90 -86.83 145.27 26.67 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.44 0.696 . . . . 0.0 112.209 175.526 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -82.74 -28.57 30.33 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.205 1.002 . . . . 0.0 112.643 -177.176 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 49.6 t80 -66.04 151.63 46.42 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 114.822 1.416 . . . . 0.0 114.822 -171.49 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 49.0 m -138.45 122.48 11.5 Favored Pre-proline 0 CA--C 1.539 0.531 0 C-N-CA 125.957 1.703 . . . . 0.0 107.687 169.029 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 78.3 Cg_exo -56.58 156.92 20.49 Favored 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 123.729 2.953 . . . . 0.0 113.778 177.958 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 58.3 tptt -59.68 -29.89 68.39 Favored 'General case' 0 CA--C 1.549 0.92 0 N-CA-C 113.032 0.753 . . . . 0.0 113.032 173.211 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 21.7 p -81.36 -19.88 41.77 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 126.91 2.084 . . . . 0.0 113.583 173.187 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 54.2 mtmt 71.15 164.35 0.28 Allowed 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 128.814 2.846 . . . . 0.0 114.234 175.546 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 86.8 mtm-85 . . . . . 0 C--O 1.255 1.383 0 C-N-CA 125.464 1.506 . . . . 0.0 111.781 173.618 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.52 0 N-CA-C 111.818 -0.513 . . . . 0.0 111.818 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 12.3 tt -87.72 -28.7 5.53 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 N-CA-C 114.056 1.132 . . . . 0.0 114.056 -175.897 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 9.3 p -63.83 -35.62 73.82 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.265 0 CA-C-N 120.458 1.481 . . . . 0.0 112.566 -177.847 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -72.04 -8.9 57.2 Favored 'General case' 0 CA--C 1.547 0.835 0 N-CA-C 113.471 0.915 . . . . 0.0 113.471 176.262 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 21.7 tt0 -93.73 -58.51 2.24 Favored 'General case' 0 N--CA 1.464 0.246 0 C-N-CA 124.788 1.235 . . . . 0.0 109.083 168.607 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 71.4 m -72.33 -22.3 61.2 Favored 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 114.555 1.317 . . . . 0.0 114.555 -169.945 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 4.7 t -77.51 -18.25 57.21 Favored 'General case' 0 N--CA 1.473 0.72 0 O-C-N 121.453 -0.779 . . . . 0.0 112.471 171.853 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 31.7 m -103.78 -42.56 5.58 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 126.663 1.985 . . . . 0.0 111.463 -173.216 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 67.3 m -124.54 168.7 12.75 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 126.795 2.038 . . . . 0.0 111.856 -179.478 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 31.8 mm -66.54 133.73 30.87 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 O-C-N 120.749 -1.219 . . . . 0.0 109.638 171.224 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.7 m -116.32 158.78 22.88 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 122.645 1.212 . . . . 0.0 113.534 175.614 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 20.9 t -122.43 162.29 21.94 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 126.443 1.897 . . . . 0.0 112.443 -176.244 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.485 ' H ' HD12 ' A' ' 13' ' ' LEU . 5.4 mp -64.12 -32.96 74.71 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 124.707 1.203 . . . . 0.0 111.923 -176.414 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 82.3 t80 -61.67 -30.79 70.96 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 123.701 0.8 . . . . 0.0 112.773 175.828 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 -78.21 -33.92 49.69 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.817 0.847 . . . . 0.0 110.667 176.766 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 90.2 mt -66.49 -46.49 76.11 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 118.644 0.656 . . . . 0.0 111.678 171.47 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 -64.11 -20.87 66.27 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 113.803 1.038 . . . . 0.0 113.803 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.7 t30 -57.01 -28.26 62.31 Favored 'General case' 0 CA--C 1.548 0.878 0 CA-C-N 119.356 0.98 . . . . 0.0 112.978 172.676 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 98.0 m-85 -98.61 -2.78 37.69 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.395 1.478 . . . . 0.0 113.487 178.547 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 12.3 t -84.65 -149.56 0.11 Allowed 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 125.989 1.716 . . . . 0.0 111.025 173.71 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 41.1 m-80 . . . . . 0 C--O 1.255 1.364 0 C-N-CA 127.045 2.138 . . . . 0.0 112.177 176.758 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 50.9 t80 . . . . . 0 N--CA 1.484 1.262 0 CA-C-O 119.627 -0.225 . . . . 0.0 111.019 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 7.1 p -70.18 -38.21 74.02 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.3 0 C-N-CA 124.023 0.929 . . . . 0.0 113.37 -173.541 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -74.23 111.68 9.64 Favored 'General case' 0 CA--C 1.544 0.718 0 N-CA-C 108.218 -1.03 . . . . 0.0 108.218 169.186 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 -170.64 172.34 5.89 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 123.932 0.893 . . . . 0.0 110.965 -165.219 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 95.1 m-70 -68.29 138.83 55.81 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 107.261 -1.385 . . . . 0.0 107.261 163.277 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 92.7 mt -138.2 126.39 22.95 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 125.177 1.391 . . . . 0.0 109.204 -178.334 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 6.3 t -146.42 145.11 30.13 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 123.312 0.645 . . . . 0.0 111.665 -174.651 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 51.92 -128.13 32.97 Favored Glycine 0 N--CA 1.472 1.091 0 C-N-CA 124.457 1.027 . . . . 0.0 112.75 175.822 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 36.2 m -58.73 -31.42 68.27 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 113.275 0.843 . . . . 0.0 113.275 179.277 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -72.05 -36.82 69.71 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 119.16 0.891 . . . . 0.0 111.641 176.571 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 57.5 tp -65.95 -47.29 75.14 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 118.591 0.632 . . . . 0.0 110.74 171.336 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 54.1 t -60.99 -43.76 96.76 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 C-N-CA 123.525 0.73 . . . . 0.0 110.618 -179.724 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -64.4 -46.25 84.11 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.602 0.761 . . . . 0.0 112.056 175.153 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.4 -42.3 99.32 Favored 'General case' 0 CA--C 1.539 0.548 0 O-C-N 121.408 -0.808 . . . . 0.0 111.857 177.5 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 46.0 tp -63.5 -41.22 98.55 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.652 1.181 . . . . 0.0 111.252 177.238 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 7.2 m-85 -60.41 -45.9 91.95 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 119.253 0.933 . . . . 0.0 112.435 169.831 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 72.2 mt -65.94 -43.5 87.86 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 123.305 0.642 . . . . 0.0 112.377 -179.378 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 53.2 t -76.97 -37.77 27.29 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 123.877 0.871 . . . . 0.0 112.327 -177.723 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 44.1 t -77.2 -41.82 39.92 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 118.779 0.718 . . . . 0.0 112.569 177.72 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 73.07 -148.21 40.8 Favored Glycine 0 CA--C 1.529 0.951 0 C-N-CA 124.646 1.117 . . . . 0.0 112.744 179.587 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -62.49 -19.98 64.13 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.257 1.423 . . . . 0.0 113.733 -177.522 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 86.9 mtm180 -57.32 -35.1 69.44 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 125.237 1.415 . . . . 0.0 114.043 179.153 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.07 144.9 2.42 Favored Glycine 0 CA--C 1.532 1.123 0 C-N-CA 125.272 1.415 . . . . 0.0 113.4 -178.148 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 48.0 p90 -113.23 151.2 31.34 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.186 1.395 . . . . 0.0 112.007 177.886 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 37.9 p90 -93.43 -10.09 36.32 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 114.34 1.237 . . . . 0.0 114.34 -178.646 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 74.7 t80 -70.2 148.25 48.84 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.934 1.294 . . . . 0.0 114.283 -177.761 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 85.7 m -127.47 131.2 23.71 Favored Pre-proline 0 N--CA 1.478 0.938 0 C-N-CA 126.389 1.876 . . . . 0.0 107.862 170.231 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -67.2 133.04 29.4 Favored 'Trans proline' 0 C--N 1.351 0.677 0 C-N-CA 122.888 2.392 . . . . 0.0 112.337 -173.14 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 84.0 tttt -66.49 -22.5 66.19 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 124.163 0.985 . . . . 0.0 112.971 177.875 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 34.5 p -81.28 -6.79 59.27 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 127.297 2.239 . . . . 0.0 113.521 171.534 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 57.5 tttm 75.0 -28.49 0.19 Allowed 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 128.679 2.792 . . . . 0.0 114.31 176.784 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 1.4 ttp180 . . . . . 0 C--O 1.252 1.2 0 C-N-CA 128.47 2.708 . . . . 0.0 111.729 176.762 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.622 0 N-CA-C 111.138 -0.785 . . . . 0.0 111.138 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 8.7 tp -51.43 -34.97 15.89 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.202 0 C-N-CA 125.761 1.624 . . . . 0.0 114.114 -170.567 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 5.7 p -62.58 -29.67 47.44 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 C-N-CA 123.556 0.742 . . . . 0.0 112.89 -179.522 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -76.86 -8.24 56.97 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 119.566 1.075 . . . . 0.0 112.855 179.188 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 79.7 mm-40 -97.19 -59.95 1.68 Allowed 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.985 0.914 . . . . 0.0 108.869 169.039 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 94.5 m -69.09 -29.03 67.04 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 114.923 1.453 . . . . 0.0 114.923 -170.538 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 7.9 t -80.65 -43.26 20.73 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 119.392 0.996 . . . . 0.0 111.03 176.847 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 23.2 m -68.97 -38.14 79.19 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 127.011 2.124 . . . . 0.0 112.917 -175.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.4 t -146.79 -172.04 3.89 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.949 1.299 . . . . 0.0 111.146 179.459 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 50.1 mt -76.64 124.0 34.11 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 O-C-N 120.893 -1.129 . . . . 0.0 109.0 170.72 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 23.8 p -103.25 157.76 16.79 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.062 0.945 . . . . 0.0 111.453 170.635 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 34.4 t -92.8 156.21 17.14 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.57 0.748 . . . . 0.0 111.847 179.687 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 59.2 mt -58.4 -29.36 66.01 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 123.398 0.679 . . . . 0.0 111.719 172.684 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.3 t80 -62.84 -33.04 74.41 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 113.16 0.8 . . . . 0.0 113.16 172.289 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 60.6 mm-40 -77.02 -34.55 57.33 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 123.281 0.633 . . . . 0.0 110.721 175.919 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 95.6 mt -65.1 -44.37 89.05 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 118.552 0.614 . . . . 0.0 111.186 171.772 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.422 ' HA ' ' SG ' ' A' ' 20' ' ' CYS . 24.6 mt-10 -63.85 -25.5 68.19 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 113.907 1.077 . . . . 0.0 113.907 175.929 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 -63.05 -21.25 66.04 Favored 'General case' 0 CA--C 1.547 0.832 0 CA-C-N 119.14 0.882 . . . . 0.0 112.87 175.944 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 73.7 m-85 -102.01 -0.21 34.02 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.161 1.384 . . . . 0.0 114.389 177.024 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.422 ' SG ' ' HA ' ' A' ' 17' ' ' GLU . 67.4 m -65.31 144.75 56.93 Favored 'General case' 0 CA--C 1.544 0.746 0 CA-C-N 119.373 0.988 . . . . 0.0 110.473 169.132 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 21.4 t-20 . . . . . 0 C--O 1.255 1.347 0 C-N-CA 124.867 1.267 . . . . 0.0 113.105 -175.643 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 68.5 t80 . . . . . 0 N--CA 1.484 1.23 0 CA-C-O 119.931 -0.081 . . . . 0.0 110.898 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 16.9 m -67.66 148.82 11.78 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.025 0 C-N-CA 124.181 0.993 . . . . 0.0 112.566 -178.422 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 42.9 54.9 4.6 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 126.123 1.769 . . . . 0.0 114.483 174.696 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 3.1 mm-40 -145.54 -177.21 5.45 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.963 1.705 . . . . 0.0 110.832 -175.258 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 27.6 m-70 -64.48 131.21 46.47 Favored 'General case' 0 CA--C 1.546 0.809 0 O-C-N 121.312 -0.868 . . . . 0.0 109.836 168.238 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 78.4 mt -141.77 127.02 18.6 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 126.2 1.8 . . . . 0.0 109.07 -177.79 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.7 t -145.14 143.43 30.35 Favored 'General case' 0 N--CA 1.472 0.653 0 O-C-N 121.357 -0.839 . . . . 0.0 112.327 -175.322 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 56.68 -127.43 44.24 Favored Glycine 0 CA--C 1.531 1.081 0 C-N-CA 124.165 0.888 . . . . 0.0 113.252 175.293 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 31.6 p -56.82 -33.7 67.0 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.731 1.213 . . . . 0.0 113.706 177.277 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 19.1 t-160 -70.89 -37.32 73.01 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 121.119 -0.988 . . . . 0.0 111.576 176.377 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 43.1 tp -69.97 -41.68 74.14 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 123.78 0.832 . . . . 0.0 111.747 172.907 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 37.8 t -58.16 -46.14 88.52 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 C-N-CA 124.152 0.981 . . . . 0.0 110.472 172.812 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -64.48 -42.61 95.79 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.829 0.852 . . . . 0.0 112.219 176.517 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.35 -40.69 95.2 Favored 'General case' 0 CA--C 1.538 0.516 0 O-C-N 121.347 -0.846 . . . . 0.0 112.14 174.477 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 47.8 mt -65.16 -39.06 92.43 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.522 -0.736 . . . . 0.0 112.047 174.896 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 15.7 m-85 -59.56 -44.3 93.33 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 119.568 1.076 . . . . 0.0 112.037 170.052 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 80.8 mt -68.9 -43.2 75.73 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.95 0.9 . . . . 0.0 112.62 179.615 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 42.2 t -72.29 -48.23 49.38 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 124.204 1.002 . . . . 0.0 111.821 -179.048 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 84.6 m -77.54 -34.39 53.91 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 121.432 -0.793 . . . . 0.0 113.0 -177.344 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 65.02 -132.26 36.57 Favored Glycine 0 CA--C 1.527 0.821 0 C-N-CA 124.06 0.838 . . . . 0.0 111.748 179.079 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -63.12 -20.16 65.11 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 124.533 1.133 . . . . 0.0 113.257 178.874 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 85.3 mtm180 -63.83 -35.32 80.23 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.795 0.838 . . . . 0.0 113.022 179.127 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.53 179.14 34.37 Favored Glycine 0 CA--C 1.537 1.452 0 C-N-CA 124.488 1.042 . . . . 0.0 112.9 -169.868 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 46.6 p90 -158.29 169.47 24.41 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 125.416 1.486 . . . . 0.0 113.658 -172.572 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 69.6 t80 -121.85 112.95 18.97 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.302 1.441 . . . . 0.0 110.252 173.093 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 45.7 t80 -74.93 138.22 42.21 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 123.552 0.741 . . . . 0.0 111.739 177.814 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 23.2 p -128.09 108.03 19.87 Favored Pre-proline 0 N--CA 1.478 0.957 0 C-N-CA 124.375 1.07 . . . . 0.0 111.825 179.507 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 31.0 Cg_exo -66.85 171.06 11.6 Favored 'Trans proline' 0 CA--C 1.538 0.681 0 C-N-CA 124.237 3.291 . . . . 0.0 112.072 168.853 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 60.4 tttp -73.79 -27.4 61.12 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 112.847 0.684 . . . . 0.0 112.847 169.635 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 23.7 p -75.22 -34.77 61.5 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 125.682 1.593 . . . . 0.0 113.08 -176.512 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 51.3 mtpt -78.97 133.33 36.87 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 123.374 0.67 . . . . 0.0 111.622 177.451 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 7.1 tpm_? . . . . . 0 C--O 1.252 1.235 0 C-N-CA 127.072 2.149 . . . . 0.0 111.196 -173.753 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.777 0 N-CA-C 112.423 -0.271 . . . . 0.0 112.423 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 10.8 tp -59.86 -33.71 53.49 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 O-C-N 121.487 -1.007 . . . . 0.0 113.516 -172.287 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 58.2 t -68.64 -23.89 28.41 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 C-N-CA 123.71 0.804 . . . . 0.0 112.241 179.064 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -80.74 -46.47 15.42 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.639 -0.663 . . . . 0.0 110.063 168.909 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 13.2 tp60 -68.31 -46.69 69.57 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.191 0.996 . . . . 0.0 112.853 -169.509 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 61.5 m -72.15 -21.13 61.5 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 113.12 0.785 . . . . 0.0 113.12 176.874 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 10.8 t -88.11 -48.62 7.6 Favored 'General case' 0 N--CA 1.467 0.395 0 O-C-N 121.407 -0.808 . . . . 0.0 111.632 -176.821 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 68.2 p -75.75 -22.44 56.5 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 125.03 1.332 . . . . 0.0 113.558 -178.919 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.3 t -150.24 -175.28 5.01 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.652 1.181 . . . . 0.0 111.743 178.19 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 62.4 mt -76.79 134.53 28.6 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 C-N-CA 124.551 1.141 . . . . 0.0 110.019 176.248 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.9 p -126.31 160.63 29.82 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.964 1.306 . . . . 0.0 110.973 170.271 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 90.3 p -110.82 165.36 11.91 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.44 1.096 . . . . 0.0 112.714 -179.103 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 10.2 mp -58.29 -28.34 64.91 Favored 'General case' 0 N--CA 1.473 0.681 0 O-C-N 121.609 -0.682 . . . . 0.0 112.515 173.602 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 78.3 t80 -64.31 -33.92 76.95 Favored 'General case' 0 CA--C 1.542 0.666 0 O-C-N 121.59 -0.694 . . . . 0.0 112.857 172.521 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 65.7 mm-40 -75.66 -24.24 56.36 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.623 0.769 . . . . 0.0 111.984 173.209 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 81.2 mt -75.93 -47.24 26.02 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 119.238 0.926 . . . . 0.0 111.447 172.268 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -65.29 -20.42 66.4 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 113.192 0.812 . . . . 0.0 113.192 177.146 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.5 t30 -54.79 -30.29 56.52 Favored 'General case' 0 CA--C 1.549 0.92 0 CA-C-N 119.144 0.884 . . . . 0.0 113.235 171.732 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 98.2 m-85 -98.18 -2.06 40.72 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.583 1.553 . . . . 0.0 113.646 178.567 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 11.3 t -78.31 169.5 18.16 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.465 1.506 . . . . 0.0 111.533 171.192 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 9.9 m-80 . . . . . 0 C--O 1.252 1.233 0 C-N-CA 124.857 1.263 . . . . 0.0 112.409 173.943 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 67.6 t80 . . . . . 0 N--CA 1.486 1.347 0 CA-C-O 119.681 -0.2 . . . . 0.0 110.697 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 13.0 m -80.71 68.56 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 C-N-CA 125.042 1.337 . . . . 0.0 111.144 177.149 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 39.7 p-10 -156.2 147.9 22.86 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.47 1.508 . . . . 0.0 113.426 -174.49 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 1.6 mm-40 -176.44 177.26 1.49 Allowed 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 126.982 2.113 . . . . 0.0 110.569 -177.551 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 27.0 m-70 -77.44 141.45 39.72 Favored 'General case' 0 CA--C 1.548 0.885 0 O-C-N 120.948 -1.095 . . . . 0.0 109.603 166.458 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 69.8 mt -144.12 135.56 25.77 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 126.521 1.928 . . . . 0.0 109.119 174.141 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 5.5 t -149.33 142.7 25.23 Favored 'General case' 0 N--CA 1.473 0.676 0 O-C-N 121.138 -0.976 . . . . 0.0 112.944 -177.464 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 62.57 -131.1 43.87 Favored Glycine 0 CA--C 1.529 0.941 0 C-N-CA 124.613 1.102 . . . . 0.0 113.321 175.46 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 26.1 p -56.02 -35.26 66.66 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 124.734 1.214 . . . . 0.0 113.026 177.6 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 23.6 m80 -64.48 -42.15 96.06 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.193 0.997 . . . . 0.0 111.613 176.541 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 48.0 tp -70.41 -42.51 71.56 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 123.928 0.891 . . . . 0.0 111.68 176.583 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 55.9 t -60.37 -44.28 95.68 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 123.293 0.637 . . . . 0.0 110.694 174.829 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -64.45 -43.09 95.35 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.819 0.848 . . . . 0.0 111.999 175.343 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.37 -44.01 96.02 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 118.609 0.64 . . . . 0.0 111.684 174.449 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 31.8 mt -59.9 -43.67 94.68 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 118.87 0.759 . . . . 0.0 111.345 175.606 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 20.8 m-85 -60.59 -44.87 95.76 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 119.131 0.878 . . . . 0.0 112.624 173.546 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 81.3 mt -69.36 -43.92 72.62 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 123.694 0.797 . . . . 0.0 112.493 -179.502 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 69.6 t -78.03 -40.92 26.9 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 124.766 1.226 . . . . 0.0 111.796 -174.074 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 48.7 t -78.19 -41.43 34.58 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 118.781 0.718 . . . . 0.0 112.282 176.459 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 72.25 -146.83 39.96 Favored Glycine 0 CA--C 1.531 1.064 0 C-N-CA 124.325 0.964 . . . . 0.0 112.741 178.524 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -60.79 -21.1 62.75 Favored 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 125.465 1.506 . . . . 0.0 113.561 -176.663 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 89.1 mtm180 -56.8 -36.12 69.53 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.968 1.307 . . . . 0.0 113.029 175.889 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 80.07 140.71 2.41 Favored Glycine 0 CA--C 1.534 1.273 0 C-N-CA 125.352 1.453 . . . . 0.0 112.935 -178.482 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 38.7 p90 -119.04 162.91 17.78 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.819 1.248 . . . . 0.0 112.258 179.857 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 4.1 t80 -145.31 85.1 1.71 Allowed 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.891 1.276 . . . . 0.0 109.452 175.373 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -78.4 169.4 18.31 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 115.614 1.709 . . . . 0.0 115.614 -173.089 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 87.7 m -106.31 100.92 32.18 Favored Pre-proline 0 N--CA 1.476 0.857 0 C-N-CA 125.572 1.549 . . . . 0.0 109.53 173.824 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -92.55 143.55 2.44 Favored 'Trans proline' 0 C--N 1.35 0.647 0 C-N-CA 123.406 2.738 . . . . 0.0 113.162 -177.959 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt 70.78 -45.89 0.62 Allowed 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 128.801 2.84 . . . . 0.0 115.761 168.607 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 10.9 t -176.08 -143.88 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 128.895 2.878 . . . . 0.0 107.268 -170.037 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -63.49 148.42 48.7 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 124.949 1.3 . . . . 0.0 112.148 172.339 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 81.3 mtt180 . . . . . 0 C--O 1.252 1.201 0 C-N-CA 124.609 1.164 . . . . 0.0 112.624 178.623 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.765 0 N-CA-C 111.952 -0.459 . . . . 0.0 111.952 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 11.2 tp -58.73 -38.52 72.45 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.174 0 N-CA-C 114.25 1.204 . . . . 0.0 114.25 -169.958 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 47.9 t -62.24 -35.66 70.31 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.134 0 CA-C-N 118.624 0.647 . . . . 0.0 111.334 176.267 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -76.67 -7.66 55.73 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.463 1.105 . . . . 0.0 112.91 -179.454 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 35.9 tp60 -103.01 -57.52 2.03 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.935 1.294 . . . . 0.0 109.861 173.941 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 83.4 m -74.34 -25.55 59.61 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 115.16 1.541 . . . . 0.0 115.16 -169.522 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 72.3 m -77.24 -23.31 51.32 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 119.373 0.988 . . . . 0.0 113.019 -179.692 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 18.0 p -114.09 -48.13 2.91 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 125.966 1.707 . . . . 0.0 111.747 -171.315 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 73.2 m -96.67 169.91 9.56 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.505 1.522 . . . . 0.0 111.437 172.087 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 61.8 mt -77.69 130.1 36.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 O-C-N 120.939 -1.101 . . . . 0.0 109.034 172.964 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.3 m -97.56 155.81 16.79 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 122.343 1.068 . . . . 0.0 112.756 173.223 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 90.5 p -118.33 162.76 17.76 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 126.665 1.986 . . . . 0.0 110.996 177.504 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 58.3 mt -62.55 -28.13 69.65 Favored 'General case' 0 CA--C 1.536 0.437 0 O-C-N 121.884 -0.51 . . . . 0.0 111.797 175.484 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 89.4 t80 -65.01 -38.87 92.34 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 123.795 0.838 . . . . 0.0 112.766 172.204 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -72.74 -28.37 62.59 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 123.074 0.55 . . . . 0.0 112.011 175.631 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 86.3 mt -72.39 -44.63 62.22 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-N 118.531 0.605 . . . . 0.0 111.971 169.89 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.0 mm-40 -55.38 -38.4 68.82 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.041 1.336 . . . . 0.0 112.569 172.394 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 -60.09 -22.55 62.9 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 113.554 0.946 . . . . 0.0 113.554 177.351 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 18.7 m-85 -103.39 1.69 32.93 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.672 1.589 . . . . 0.0 114.288 175.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 86.4 m -71.97 154.22 41.32 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 120.566 -1.334 . . . . 0.0 111.765 169.07 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 21.4 t-20 . . . . . 0 C--O 1.254 1.313 0 C-N-CA 124.496 1.118 . . . . 0.0 112.933 176.98 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . 0.251 23.4 p90 . . . . . 0 N--CA 1.488 1.448 0 CA-C-O 118.249 -0.881 . . . . 0.0 111.209 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 18.6 m -69.7 161.62 4.33 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.281 0 CA-C-N 120.569 1.532 . . . . 0.0 111.98 170.66 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 8.5 p-10 -55.46 135.85 50.2 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.735 1.214 . . . . 0.0 112.401 171.837 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -166.73 163.23 16.57 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 124.991 1.316 . . . . 0.0 110.979 -169.344 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 98.4 m-70 -69.77 136.47 50.92 Favored 'General case' 0 CA--C 1.545 0.778 0 O-C-N 121.224 -0.922 . . . . 0.0 110.385 168.663 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 72.4 mt -140.67 131.45 25.8 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 124.808 1.243 . . . . 0.0 109.518 -177.472 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.6 t -145.6 147.18 31.78 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -176.71 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 56.1 -123.52 31.33 Favored Glycine 0 CA--C 1.528 0.873 0 C-N-CA 124.742 1.163 . . . . 0.0 113.174 172.441 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 23.8 p -55.85 -41.38 74.24 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.299 1.04 . . . . 0.0 112.986 176.263 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 14.7 m-70 -70.28 -32.21 69.91 Favored 'General case' 0 CA--C 1.541 0.63 0 O-C-N 120.682 -1.261 . . . . 0.0 112.575 178.619 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 46.5 tp -68.14 -41.18 82.04 Favored 'General case' 0 N--CA 1.471 0.59 0 O-C-N 121.581 -0.699 . . . . 0.0 111.003 171.221 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 25.5 t -61.57 -45.74 98.01 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 C-N-CA 124.23 1.012 . . . . 0.0 110.774 173.321 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -59.59 -46.29 89.37 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 123.97 0.908 . . . . 0.0 111.652 174.299 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.89 -41.32 99.38 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 121.505 -0.747 . . . . 0.0 112.215 178.372 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 73.6 mt -64.18 -41.25 97.18 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 118.768 -0.634 . . . . 0.0 111.521 174.542 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 -59.31 -44.55 92.55 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-N 119.798 1.181 . . . . 0.0 112.286 171.0 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 67.8 mt -67.16 -42.28 84.59 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.172 0.989 . . . . 0.0 112.965 -179.636 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 53.8 t -74.93 -49.39 29.03 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 123.419 0.688 . . . . 0.0 111.659 178.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 58.1 m -78.03 -33.46 51.06 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 113.267 0.84 . . . . 0.0 113.267 -172.352 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 64.8 -135.33 38.02 Favored Glycine 0 CA--C 1.53 1.006 0 C-N-CA 124.024 0.821 . . . . 0.0 112.125 179.095 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -62.05 -23.21 66.34 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 124.539 1.136 . . . . 0.0 113.554 -178.423 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 88.2 mtm180 -59.79 -38.29 81.48 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.087 0.955 . . . . 0.0 112.876 176.893 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 76.78 178.22 46.12 Favored Glycine 0 CA--C 1.533 1.215 0 C-N-CA 124.12 0.867 . . . . 0.0 112.117 -168.606 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 54.4 p90 -141.41 157.46 45.15 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 113.898 1.073 . . . . 0.0 113.898 -171.612 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -96.42 158.36 15.47 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 126.304 1.841 . . . . 0.0 108.943 167.93 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 26.2 t80 -148.1 143.77 27.38 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 121.403 -0.811 . . . . 0.0 111.906 -173.861 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 18.6 m -141.33 115.54 7.0 Favored Pre-proline 0 N--CA 1.475 0.82 0 C-N-CA 124.725 1.21 . . . . 0.0 109.676 179.592 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -83.55 166.06 13.88 Favored 'Trans proline' 0 CA--C 1.538 0.701 0 C-N-CA 124.316 3.344 . . . . 0.0 111.97 179.496 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 40.6 ttpt -68.82 -32.21 71.75 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 123.692 0.797 . . . . 0.0 112.667 170.628 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 16.7 p -127.9 -77.01 0.57 Allowed 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 126.904 2.082 . . . . 0.0 110.314 -177.885 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 15.0 ttpp -162.96 168.35 21.26 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 126.524 1.93 . . . . 0.0 111.275 -177.398 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 1.6 mmp_? . . . . . 0 C--O 1.254 1.304 0 C-N-CA 126.447 1.899 . . . . 0.0 110.61 168.801 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.652 0 N-CA-C 111.719 -0.553 . . . . 0.0 111.719 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.526 HG22 ' H ' ' B' ' 27' ' ' THR . 8.3 tt -56.88 -34.4 43.92 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.141 0 C-N-CA 124.447 1.099 . . . . 0.0 113.63 -172.364 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 55.6 t -62.52 -30.51 49.33 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 CA-C-N 119.069 0.85 . . . . 0.0 111.176 178.862 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -69.5 -36.89 76.9 Favored 'General case' 0 CA--C 1.541 0.608 0 O-C-N 120.813 -1.18 . . . . 0.0 111.009 174.94 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 19.8 tp60 -77.73 -36.47 50.85 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.757 0.823 . . . . 0.0 112.219 -179.754 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 56.2 m -97.47 -27.26 14.52 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 115.069 1.507 . . . . 0.0 115.069 -175.85 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 22.8 t -102.01 -58.0 1.96 Allowed 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 120.006 1.275 . . . . 0.0 111.964 -176.927 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 15.5 m -65.8 -55.62 16.21 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 124.413 1.085 . . . . 0.0 109.498 177.32 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 74.8 m -89.89 176.0 6.99 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 124.112 0.965 . . . . 0.0 111.035 167.329 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 11.3 tt -92.65 147.09 5.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 124.033 0.933 . . . . 0.0 110.466 171.453 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.6 p -130.3 154.73 47.32 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 114.034 1.124 . . . . 0.0 114.034 176.643 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 47.0 t -92.95 153.94 18.47 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.698 1.599 . . . . 0.0 112.824 178.59 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 10.8 mp -59.36 -28.49 66.91 Favored 'General case' 0 N--CA 1.47 0.548 0 O-C-N 121.321 -0.862 . . . . 0.0 111.824 172.214 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.8 t80 -60.85 -36.22 78.57 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 121.466 -0.772 . . . . 0.0 112.529 170.647 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -76.22 -37.5 57.66 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 123.809 0.844 . . . . 0.0 110.392 177.637 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 93.7 mt -59.48 -43.13 93.35 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 123.288 0.635 . . . . 0.0 111.539 172.708 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -67.64 -33.05 74.19 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 113.412 0.894 . . . . 0.0 113.412 172.578 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 -70.59 -27.48 64.14 Favored 'General case' 0 CA--C 1.544 0.749 0 CA-C-N 119.652 1.115 . . . . 0.0 113.504 177.04 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 17.2 m-85 -79.0 -5.38 53.77 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 124.069 0.948 . . . . 0.0 113.482 169.351 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 2.8 t -82.04 168.35 17.89 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.785 1.234 . . . . 0.0 112.367 171.065 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.251 1.177 0 C-N-CA 125.34 1.456 . . . . 0.0 113.0 -174.303 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 65.6 m-85 . . . . . 0 N--CA 1.487 1.416 0 CA-C-O 119.642 -0.218 . . . . 0.0 110.525 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 26.8 t -84.97 115.76 27.37 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 N-CA-C 106.742 -1.577 . . . . 0.0 106.742 168.689 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -154.89 146.25 22.98 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.352 1.061 . . . . 0.0 112.92 -169.554 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 29.3 tt0 -158.62 160.36 36.45 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.13 0.972 . . . . 0.0 111.144 -169.831 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 70.7 m-70 -86.56 128.74 35.0 Favored 'General case' 0 CA--C 1.545 0.762 0 O-C-N 121.509 -0.745 . . . . 0.0 110.578 168.89 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 66.3 mt -143.03 133.91 25.44 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 126.604 1.962 . . . . 0.0 109.582 -173.224 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -137.76 140.08 40.44 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 123.89 0.876 . . . . 0.0 112.24 -172.074 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 52.94 -123.35 24.07 Favored Glycine 0 N--CA 1.474 1.171 0 C-N-CA 124.387 0.994 . . . . 0.0 114.39 169.536 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 25.2 p -58.64 -36.38 74.01 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.174 0.989 . . . . 0.0 113.119 177.109 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 93.3 m-70 -66.87 -36.83 83.2 Favored 'General case' 0 CA--C 1.54 0.559 0 O-C-N 120.739 -1.225 . . . . 0.0 111.791 175.001 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 40.2 tp -67.97 -41.75 81.9 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 123.721 0.808 . . . . 0.0 111.753 173.506 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 50.9 t -59.44 -47.67 89.88 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.137 0 C-N-CA 124.329 1.051 . . . . 0.0 111.038 172.808 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -63.57 -40.45 97.0 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 123.116 0.567 . . . . 0.0 112.042 176.336 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.1 -42.65 99.64 Favored 'General case' 0 CA--C 1.534 0.342 0 O-C-N 121.273 -0.892 . . . . 0.0 112.292 174.807 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 49.2 mt -58.94 -43.1 91.15 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 118.887 0.767 . . . . 0.0 111.566 174.925 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 23.7 m-85 -61.19 -47.29 86.81 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 118.479 0.581 . . . . 0.0 112.319 172.641 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 72.3 mt -68.85 -42.29 77.3 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.587 0.755 . . . . 0.0 112.807 -177.713 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 74.0 t -79.17 -41.79 23.21 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 C-N-CA 124.403 1.081 . . . . 0.0 111.821 -173.905 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 21.7 t -85.8 -33.2 21.43 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 113.809 1.04 . . . . 0.0 113.809 178.607 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 83.84 -153.78 30.08 Favored Glycine 0 CA--C 1.53 1.023 0 C-N-CA 124.468 1.032 . . . . 0.0 112.464 -174.768 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -68.56 -7.34 31.76 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 115.296 1.591 . . . . 0.0 115.296 -172.815 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 85.0 mtm180 -58.96 -36.58 75.05 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 124.906 1.282 . . . . 0.0 113.29 -178.579 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 86.48 147.16 10.5 Favored Glycine 0 CA--C 1.534 1.273 0 C-N-CA 125.2 1.381 . . . . 0.0 113.748 175.085 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 54.0 p90 -138.72 175.2 9.76 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.96 1.704 . . . . 0.0 112.594 -170.714 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -136.65 109.71 7.72 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.12 1.368 . . . . 0.0 109.236 169.46 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -88.68 149.72 23.36 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 113.215 0.82 . . . . 0.0 113.215 -179.292 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . 0.526 ' H ' HG22 ' A' ' 2' ' ' ILE . 19.0 p -120.39 73.25 21.15 Favored Pre-proline 0 N--CA 1.475 0.79 0 C-N-CA 125.868 1.667 . . . . 0.0 112.543 -172.356 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_endo -72.12 144.84 43.03 Favored 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 123.338 2.692 . . . . 0.0 110.789 169.48 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 70.3 tttt -72.63 -10.24 59.56 Favored 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 124.046 0.938 . . . . 0.0 113.517 -175.883 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 30.1 p -82.9 -20.01 36.24 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 126.589 1.955 . . . . 0.0 114.199 -176.639 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 62.1 pttt -149.27 29.07 0.8 Allowed 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 114.7 1.37 . . . . 0.0 114.7 -170.344 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 2.9 mpt_? . . . . . 0 N--CA 1.482 1.161 0 C-N-CA 126.47 1.908 . . . . 0.0 110.386 169.087 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.433 0 N-CA-C 112.015 -0.434 . . . . 0.0 112.015 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 16.6 tt -81.34 -28.69 10.62 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 N-CA-C 113.954 1.094 . . . . 0.0 113.954 -175.522 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 23.5 t -61.08 -39.97 84.13 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.062 0 CA-C-N 118.924 0.784 . . . . 0.0 110.408 -177.962 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -64.7 -16.62 63.15 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 126.07 1.748 . . . . 0.0 113.138 176.551 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 40.2 tt0 -90.68 -59.58 2.14 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 123.535 0.734 . . . . 0.0 109.247 168.964 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 76.0 m -55.91 -35.39 66.52 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 114.612 1.338 . . . . 0.0 114.612 -171.379 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 74.1 m -81.29 -20.8 40.07 Favored 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 113.885 1.068 . . . . 0.0 113.885 -178.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 38.3 m -114.83 -36.9 4.34 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 124.886 1.275 . . . . 0.0 112.534 -168.406 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 7.6 t -125.61 -164.91 1.35 Allowed 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 126.207 1.803 . . . . 0.0 109.911 171.343 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 13.9 tt -86.36 145.9 7.12 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.676 0 C-N-CA 124.387 1.075 . . . . 0.0 110.79 174.528 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 13.7 p -137.08 156.1 48.82 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.144 0.978 . . . . 0.0 112.334 174.389 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 14.5 m -107.24 149.21 28.0 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 113.953 1.094 . . . . 0.0 113.953 -167.749 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 27.4 mt -61.45 -29.93 70.26 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 121.272 -0.892 . . . . 0.0 111.696 174.959 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 91.7 t80 -59.95 -30.87 69.37 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.304 1.441 . . . . 0.0 113.05 170.693 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 59.1 mt-30 -80.88 -36.26 31.54 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 123.617 0.767 . . . . 0.0 110.921 174.731 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 59.7 mt -62.69 -40.54 97.46 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 118.656 0.662 . . . . 0.0 112.354 173.478 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 26.8 mt-10 -60.29 -20.38 58.86 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 114.814 1.413 . . . . 0.0 114.814 175.204 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 26.6 t30 -59.69 -27.39 66.38 Favored 'General case' 0 CA--C 1.546 0.813 0 CA-C-N 119.579 1.081 . . . . 0.0 112.723 174.343 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 76.9 m-85 -100.8 -0.06 37.78 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.331 1.452 . . . . 0.0 114.293 -174.495 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 65.8 m -75.18 126.59 31.33 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.431 0.692 . . . . 0.0 111.822 176.503 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.252 1.228 0 C-N-CA 129.169 2.988 . . . . 0.0 112.154 -171.925 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 5.9 p90 . . . . . 0 N--CA 1.483 1.221 0 N-CA-C 111.587 0.217 . . . . 0.0 111.587 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 72.3 t -90.26 146.51 6.1 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.222 0 C-N-CA 124.874 1.27 . . . . 0.0 109.503 171.333 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 53.1 p-10 -149.89 151.32 33.24 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 124.761 1.224 . . . . 0.0 113.568 -178.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 2.9 mm-40 -163.71 172.23 14.49 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.359 1.464 . . . . 0.0 111.944 -170.075 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 99.8 m-70 -90.62 135.05 33.95 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.615 1.166 . . . . 0.0 109.905 168.523 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 78.6 mt -149.41 139.44 22.06 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 124.775 1.23 . . . . 0.0 110.359 -174.607 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 2.4 t -151.57 152.36 32.8 Favored 'General case' 0 C--O 1.237 0.402 0 O-C-N 121.072 -1.018 . . . . 0.0 113.405 177.029 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 56.31 -128.1 45.22 Favored Glycine 0 CA--C 1.53 0.988 0 C-N-CA 124.738 1.161 . . . . 0.0 113.743 171.602 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 29.6 p -57.29 -37.53 72.57 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 124.36 1.064 . . . . 0.0 112.91 177.38 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 66.9 m-70 -72.31 -29.03 63.47 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 119.589 1.086 . . . . 0.0 113.027 176.665 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 50.8 tp -72.08 -45.27 61.35 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 119.035 0.834 . . . . 0.0 110.926 170.51 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 45.1 t -58.59 -40.91 80.55 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.159 0 C-N-CA 124.205 1.002 . . . . 0.0 111.231 174.184 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . 0.409 ' HA ' ' CE2' ' B' ' 16' ' ' TYR . 39.9 tt0 -61.25 -46.38 90.6 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 125.234 1.414 . . . . 0.0 112.036 171.092 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.23 -41.36 96.73 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 121.55 -0.719 . . . . 0.0 111.799 176.637 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -55.96 -51.98 65.79 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 119.138 0.881 . . . . 0.0 110.728 172.011 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . 0.409 ' CE2' ' HA ' ' B' ' 13' ' ' GLU 0.265 1.0 OUTLIER -69.47 -29.41 67.06 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 113.819 1.044 . . . . 0.0 113.819 -177.718 . . . . . . . . 4 4 . 1 . 017 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 82.4 mt -74.33 -41.74 60.6 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.161 0.984 . . . . 0.0 112.551 173.931 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 38.8 t -67.84 -47.91 77.56 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 C-N-CA 123.698 0.799 . . . . 0.0 110.786 177.81 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 86.2 m -73.75 -39.12 64.45 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 112.682 0.623 . . . . 0.0 112.682 -177.619 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.25 -129.0 40.06 Favored Glycine 0 CA--C 1.528 0.876 0 C-N-CA 123.913 0.768 . . . . 0.0 111.687 -179.624 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -60.37 -23.97 64.73 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.905 1.282 . . . . 0.0 113.182 177.527 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 85.3 mtm180 -65.39 -30.15 70.94 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.042 0.937 . . . . 0.0 113.248 178.738 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.89 175.99 11.76 Favored Glycine 0 CA--C 1.536 1.372 0 C-N-CA 124.889 1.233 . . . . 0.0 113.164 -173.766 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 15.9 p90 -143.15 161.12 39.05 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.759 1.224 . . . . 0.0 111.669 174.448 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 9.0 t80 -127.78 -13.7 5.23 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 113.822 1.045 . . . . 0.0 113.822 -176.115 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 88.3 t80 -61.18 127.12 29.99 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 124.198 0.999 . . . . 0.0 113.622 -179.569 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 12.2 p -92.49 128.71 43.39 Favored Pre-proline 0 CA--C 1.54 0.569 0 C-N-CA 125.466 1.507 . . . . 0.0 110.212 174.539 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_endo -67.38 131.47 24.91 Favored 'Trans proline' 0 C--N 1.35 0.655 0 C-N-CA 123.273 2.649 . . . . 0.0 111.421 -169.94 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 96.8 mttt 63.46 -2.25 0.5 Allowed 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 126.787 2.035 . . . . 0.0 114.281 -179.028 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 85.0 m -111.77 -46.87 3.2 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 126.268 1.827 . . . . 0.0 111.376 -169.765 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 81.4 tttt 76.57 134.56 0.06 Allowed 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 128.264 2.626 . . . . 0.0 112.482 -178.133 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.254 1.339 0 C-N-CA 125.011 1.324 . . . . 0.0 114.497 -174.463 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.811 0 N-CA-C 111.349 -0.7 . . . . 0.0 111.349 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 44.6 pt -66.44 -19.36 25.56 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.061 0 N-CA-C 115.5 1.667 . . . . 0.0 115.5 -169.2 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . 0.648 HG21 ' HA ' ' B' ' 28' ' ' PRO . 75.2 t -56.07 -35.98 43.44 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.313 0 CA-C-N 120.462 1.483 . . . . 0.0 111.193 178.23 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 18.4 tt0 -70.81 -17.92 62.75 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 123.735 0.814 . . . . 0.0 112.769 179.102 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 37.5 tt0 -88.69 -51.76 5.5 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 124.816 1.246 . . . . 0.0 109.434 168.826 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 88.5 m -55.92 -38.77 70.72 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.444 1.098 . . . . 0.0 112.747 -176.231 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 96.0 m -76.14 -27.87 57.19 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 113.74 1.015 . . . . 0.0 113.74 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 82.0 p -102.95 -22.85 13.77 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 124.829 1.252 . . . . 0.0 113.161 -172.783 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 10.6 t -151.2 -166.2 2.46 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.289 1.836 . . . . 0.0 110.371 -174.868 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 56.7 mt -81.1 139.36 18.17 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 O-C-N 120.448 -1.407 . . . . 0.0 110.594 174.658 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 11.8 p -133.81 161.08 35.72 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 124.532 1.133 . . . . 0.0 111.207 168.628 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 24.2 p -103.1 159.28 15.67 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 113.669 0.989 . . . . 0.0 113.669 -171.552 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 56.4 mt -68.04 -27.46 66.55 Favored 'General case' 0 CA--C 1.537 0.451 0 O-C-N 121.193 -0.942 . . . . 0.0 111.86 174.805 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.9 t80 -66.05 -34.03 77.14 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 123.595 0.758 . . . . 0.0 112.766 171.471 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 70.1 mt-30 -67.12 -43.29 82.81 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 118.834 -0.603 . . . . 0.0 110.804 170.704 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 36.9 mt -58.65 -45.9 88.3 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 118.932 0.787 . . . . 0.0 111.852 175.502 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 11.3 tt0 -65.47 -23.01 66.81 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 113.78 1.03 . . . . 0.0 113.78 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 13.8 t-20 -62.55 -22.4 66.3 Favored 'General case' 0 CA--C 1.549 0.91 0 O-C-N 120.983 -1.073 . . . . 0.0 113.089 176.8 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -98.55 2.86 47.88 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 125.626 1.571 . . . . 0.0 113.794 175.57 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 11.5 t -76.64 169.93 17.36 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.627 1.171 . . . . 0.0 111.46 169.534 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 8.2 m-80 . . . . . 0 C--O 1.251 1.165 0 C-N-CA 124.036 0.934 . . . . 0.0 112.109 172.343 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 44.0 t80 . . . . . 0 N--CA 1.484 1.225 0 CA-C-O 119.784 -0.15 . . . . 0.0 110.876 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 13.8 p -66.54 150.55 10.95 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 C-N-CA 124.539 1.136 . . . . 0.0 111.708 175.337 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . 0.269 0.8 OUTLIER 47.98 59.03 4.5 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 126.244 1.818 . . . . 0.0 113.861 -179.998 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 -129.85 162.44 28.53 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.327 1.451 . . . . 0.0 111.028 -172.744 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 15.8 m-70 -76.44 135.41 39.41 Favored 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 164.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 82.3 mt -141.76 126.83 18.4 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 124.993 1.317 . . . . 0.0 109.856 -176.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 3.7 t -144.89 151.2 38.34 Favored 'General case' 0 N--CA 1.468 0.456 0 O-C-N 121.383 -0.823 . . . . 0.0 112.851 176.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.13 -124.93 34.36 Favored Glycine 0 CA--C 1.53 0.973 0 C-N-CA 125.018 1.294 . . . . 0.0 112.847 172.025 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 11.4 p -50.16 -48.64 53.74 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 125.361 1.464 . . . . 0.0 112.981 175.69 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -67.07 -34.56 77.93 Favored 'General case' 0 CA--C 1.541 0.63 0 O-C-N 121.171 -0.956 . . . . 0.0 112.216 -178.261 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . 0.592 HD21 HG22 ' A' ' 3' ' ' VAL . 52.2 tp -70.91 -42.57 69.77 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.623 0.769 . . . . 0.0 111.723 175.007 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 50.9 t -62.1 -43.09 97.3 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.858 0 C-N-CA 124.063 0.945 . . . . 0.0 110.547 174.531 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 27.1 mm-40 -63.82 -42.07 97.74 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 123.25 0.62 . . . . 0.0 112.175 173.573 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.03 -41.68 99.59 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 119.512 1.051 . . . . 0.0 111.811 175.571 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 28.0 mt -58.67 -44.54 90.21 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.822 0.849 . . . . 0.0 111.438 172.804 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 20.0 m-85 -63.01 -41.74 99.65 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 119.243 0.929 . . . . 0.0 112.952 173.268 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 64.7 mt -67.52 -41.09 84.97 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 123.919 0.887 . . . . 0.0 112.274 179.268 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 41.8 t -72.25 -48.56 48.09 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 C-N-CA 124.05 0.94 . . . . 0.0 111.934 177.583 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 48.6 t -81.62 -37.31 27.76 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 112.887 0.699 . . . . 0.0 112.887 -171.839 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 69.65 -144.27 40.02 Favored Glycine 0 CA--C 1.529 0.964 0 C-N-CA 124.111 0.862 . . . . 0.0 112.567 178.364 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -62.59 -21.52 65.68 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 125.091 1.356 . . . . 0.0 113.384 -177.211 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 90.4 mtm180 -58.76 -35.96 73.6 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.866 1.266 . . . . 0.0 113.262 178.82 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.12 142.42 1.92 Allowed Glycine 0 CA--C 1.535 1.313 0 C-N-CA 125.519 1.533 . . . . 0.0 113.517 -178.937 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 52.8 p90 -113.36 147.54 37.49 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.102 1.361 . . . . 0.0 111.077 176.397 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 45.4 p90 -94.97 -14.83 24.04 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.378 1.071 . . . . 0.0 113.709 -176.105 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 25.4 t80 -87.26 107.07 18.33 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.139 1.376 . . . . 0.0 113.506 -169.627 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 20.8 p -76.38 145.63 76.34 Favored Pre-proline 0 N--CA 1.475 0.802 0 C-N-CA 124.657 1.183 . . . . 0.0 110.064 168.831 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . 0.648 ' HA ' HG21 ' A' ' 3' ' ' VAL . 73.4 Cg_endo -72.6 151.84 53.05 Favored 'Trans proline' 0 CA--C 1.537 0.651 0 C-N-CA 122.612 2.208 . . . . 0.0 112.59 -172.406 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 22.2 tptm -61.78 -28.78 69.7 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 123.956 0.903 . . . . 0.0 112.26 171.584 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 22.7 p -92.3 40.05 1.04 Allowed 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 128.261 2.624 . . . . 0.0 111.954 177.917 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 81.0 tttt -57.72 143.42 41.86 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 125.431 1.493 . . . . 0.0 113.496 -176.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 78.3 ttt180 . . . . . 0 C--O 1.253 1.259 0 C-N-CA 125.912 1.685 . . . . 0.0 112.756 178.781 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.477 0 N-CA-C 110.921 -0.871 . . . . 0.0 110.921 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 10.8 tp -99.39 -26.54 3.71 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.988 0 N-CA-C 114.179 1.177 . . . . 0.0 114.179 175.711 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 5.4 p -66.32 -44.25 91.08 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.102 0 CA-C-N 120.394 1.452 . . . . 0.0 112.621 -172.7 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -75.06 -32.96 61.65 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 118.778 0.717 . . . . 0.0 111.468 174.826 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -65.96 -29.93 70.41 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 124.424 1.09 . . . . 0.0 112.35 -179.858 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 65.6 m -100.6 -26.53 13.79 Favored 'General case' 0 CA--C 1.543 0.703 0 N-CA-C 114.987 1.477 . . . . 0.0 114.987 174.141 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 15.1 t -96.14 -43.97 7.51 Favored 'General case' 0 N--CA 1.479 1.021 0 CA-C-N 120.021 1.282 . . . . 0.0 112.814 -174.974 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 25.5 m -86.18 -44.81 11.9 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 124.652 1.181 . . . . 0.0 110.167 176.898 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 75.4 m -101.36 175.4 5.59 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.976 1.31 . . . . 0.0 111.801 170.109 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 7.7 mt -96.98 141.88 14.94 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 C-N-CA 125.157 1.383 . . . . 0.0 109.468 -179.409 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 12.8 p -136.6 156.29 48.76 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 115.155 1.539 . . . . 0.0 115.155 -177.913 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 34.4 t -101.09 160.85 14.04 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 127.121 2.168 . . . . 0.0 111.334 173.916 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 54.9 mt -58.06 -27.5 63.68 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 123.844 0.858 . . . . 0.0 112.094 171.484 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 86.6 t80 -61.53 -32.11 72.16 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.292 1.037 . . . . 0.0 113.465 172.354 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 37.4 mt-30 -80.31 -33.29 37.7 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 123.901 0.88 . . . . 0.0 110.958 176.625 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 55.5 mt -61.3 -43.94 98.04 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.143 0.577 . . . . 0.0 111.679 169.469 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.3 tt0 -55.58 -28.75 56.81 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.721 1.608 . . . . 0.0 113.849 179.918 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 -63.04 -20.99 65.85 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 113.551 0.945 . . . . 0.0 113.551 178.213 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 73.3 m-85 -102.8 -1.23 30.18 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 125.527 1.531 . . . . 0.0 113.449 -179.165 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 72.0 m -69.47 148.9 48.9 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.162 0.985 . . . . 0.0 113.162 174.443 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 28.4 m120 . . . . . 0 C--O 1.251 1.176 0 C-N-CA 125.024 1.33 . . . . 0.0 112.35 169.325 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 54.8 p90 . . . . . 0 N--CA 1.482 1.168 0 CA-C-O 119.761 -0.161 . . . . 0.0 110.867 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 13.4 p -70.61 122.17 21.9 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.975 0 C-N-CA 123.585 0.754 . . . . 0.0 111.582 -178.909 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 55.7 t30 -169.49 118.21 0.63 Allowed 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.876 1.67 . . . . 0.0 109.901 -177.33 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 2.7 mm-40 -161.25 171.62 18.07 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.816 1.246 . . . . 0.0 111.301 -171.065 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 82.4 m-70 -83.19 141.32 32.0 Favored 'General case' 0 CA--C 1.545 0.782 0 O-C-N 121.51 -0.744 . . . . 0.0 110.829 169.054 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 72.6 mt -141.88 138.88 32.41 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 126.349 1.859 . . . . 0.0 109.049 174.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 2.7 t -151.77 148.0 27.34 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 123.176 0.59 . . . . 0.0 112.232 -175.786 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.19 -130.63 47.69 Favored Glycine 0 N--CA 1.472 1.043 0 C-N-CA 124.501 1.048 . . . . 0.0 113.128 174.43 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 18.6 m -53.93 -37.11 63.51 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 124.829 1.252 . . . . 0.0 113.121 177.838 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 88.9 m-70 -68.57 -39.29 81.06 Favored 'General case' 0 CA--C 1.543 0.687 0 O-C-N 121.116 -0.99 . . . . 0.0 111.685 178.612 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 58.3 tp -65.96 -44.5 84.78 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 123.645 0.778 . . . . 0.0 111.462 173.365 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 50.2 t -60.48 -44.89 97.36 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 C-N-CA 124.178 0.991 . . . . 0.0 111.141 176.962 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 27.3 mm-40 -65.28 -42.72 92.87 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.161 0.584 . . . . 0.0 111.943 175.003 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.58 -40.16 96.24 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 119.401 1.0 . . . . 0.0 112.295 177.19 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 32.1 mt -58.46 -50.53 73.4 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 123.217 0.607 . . . . 0.0 110.422 171.671 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 23.5 m-85 -61.86 -33.47 74.24 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 119.637 1.108 . . . . 0.0 113.453 176.52 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 69.4 mt -69.05 -41.9 77.02 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 119.174 0.897 . . . . 0.0 112.419 173.866 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 56.0 t -70.66 -44.36 76.67 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 CA-C-N 118.781 0.719 . . . . 0.0 111.872 177.951 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 34.9 m -81.32 -18.77 44.6 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 114.094 1.146 . . . . 0.0 114.094 -176.281 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 66.99 -146.78 48.64 Favored Glycine 0 CA--C 1.531 1.042 0 C-N-CA 124.229 0.919 . . . . 0.0 111.703 -174.247 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 2.5 pm0 -67.22 -15.51 63.74 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.926 1.291 . . . . 0.0 113.95 179.659 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 76.9 mtp85 -68.71 -31.43 70.51 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.848 0.859 . . . . 0.0 112.52 177.216 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.61 -177.03 49.96 Favored Glycine 0 CA--C 1.533 1.206 0 C-N-CA 125.191 1.377 . . . . 0.0 113.831 -179.156 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 42.4 p90 -123.22 161.95 23.53 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.058 1.343 . . . . 0.0 111.861 178.348 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 82.7 t80 -128.08 115.34 18.29 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.194 0.998 . . . . 0.0 110.056 172.925 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 49.0 t80 -169.28 153.52 5.4 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 125.478 1.511 . . . . 0.0 112.635 -175.089 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 17.4 p -128.29 106.94 19.46 Favored Pre-proline 0 N--CA 1.473 0.714 0 C-N-CA 126.424 1.889 . . . . 0.0 109.933 173.845 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -56.4 142.81 88.54 Favored 'Trans proline' 0 C--N 1.351 0.71 0 C-N-CA 124.255 3.303 . . . . 0.0 112.75 173.451 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 62.1 pttt -65.64 -15.19 62.53 Favored 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 114.852 1.427 . . . . 0.0 114.852 -175.82 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 14.2 t -73.58 -36.37 65.56 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 125.206 1.402 . . . . 0.0 112.17 177.043 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 19.4 ptpt -95.08 -13.75 24.87 Favored 'General case' 0 N--CA 1.477 0.883 0 N-CA-C 114.591 1.33 . . . . 0.0 114.591 178.969 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.252 1.22 0 C-N-CA 125.804 1.642 . . . . 0.0 111.369 -176.839 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.729 0 N-CA-C 111.089 -0.804 . . . . 0.0 111.089 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -53.0 -40.62 37.87 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.068 0 C-N-CA 124.925 1.29 . . . . 0.0 114.477 -169.329 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 84.2 t -65.76 -52.91 44.32 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 CA-C-N 118.75 0.705 . . . . 0.0 110.452 -175.328 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -64.25 -36.95 85.74 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 117.842 0.292 . . . . 0.0 111.131 178.156 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 52.5 tt0 -62.85 -53.97 45.99 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.812 1.245 . . . . 0.0 111.671 -179.199 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 51.9 m -70.24 -26.52 63.88 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 113.13 0.789 . . . . 0.0 113.13 178.008 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 89.8 m -71.14 -53.29 15.07 Favored 'General case' 0 N--CA 1.472 0.662 0 O-C-N 120.965 -1.085 . . . . 0.0 111.274 173.894 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 82.4 p -83.97 -16.92 42.3 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 124.599 1.16 . . . . 0.0 114.11 -171.308 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 77.6 p -143.48 168.33 20.1 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.904 0.882 . . . . 0.0 112.677 -179.011 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 20.4 mt -68.2 131.57 33.32 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 O-C-N 121.265 -0.897 . . . . 0.0 110.038 172.555 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 13.6 p -126.23 179.12 5.41 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.505 1.122 . . . . 0.0 111.914 171.789 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 88.2 p -139.78 165.14 28.08 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 125.258 1.423 . . . . 0.0 111.759 -171.547 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 11.2 mp -61.5 -29.42 69.97 Favored 'General case' 0 CA--C 1.54 0.562 0 O-C-N 121.29 -0.881 . . . . 0.0 112.306 -179.409 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 81.9 t80 -63.51 -37.48 87.47 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 112.872 0.693 . . . . 0.0 112.872 170.92 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 60.1 mt-30 -74.43 -33.74 63.04 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 124.063 0.945 . . . . 0.0 111.403 175.45 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 89.2 mt -63.28 -51.5 65.83 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 118.604 0.638 . . . . 0.0 110.988 171.601 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 25.0 mt-10 -66.28 -27.94 68.32 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 113.483 0.92 . . . . 0.0 113.483 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 16.1 t30 -58.84 -28.72 66.34 Favored 'General case' 0 CA--C 1.546 0.822 0 CA-C-N 119.317 0.962 . . . . 0.0 112.84 176.9 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 52.0 m-85 -98.09 5.69 48.38 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.615 1.566 . . . . 0.0 113.308 176.606 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 81.1 m -98.7 163.84 12.47 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.837 1.255 . . . . 0.0 112.62 170.911 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 73.4 m-80 . . . . . 0 C--O 1.251 1.17 0 CA-C-O 117.935 -1.031 . . . . 0.0 112.779 177.223 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 26.6 t80 . . . . . 0 N--CA 1.487 1.383 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 4.3 p -60.89 148.75 8.64 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 CA-C-N 120.409 1.459 . . . . 0.0 112.482 -178.803 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 1.9 t30 65.45 52.63 1.36 Allowed 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 125.319 1.447 . . . . 0.0 111.586 172.562 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 2.9 mm-40 -149.21 167.6 25.55 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.32 1.048 . . . . 0.0 111.7 -177.725 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 28.0 m-70 -78.55 143.84 36.15 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 123.35 0.66 . . . . 0.0 109.382 167.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 60.8 mt -140.86 126.25 18.74 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 125.596 1.558 . . . . 0.0 109.483 174.425 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 5.2 t -142.53 149.62 39.36 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 121.598 -0.689 . . . . 0.0 112.414 -175.687 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 59.5 -132.06 51.49 Favored Glycine 0 CA--C 1.529 0.955 0 C-N-CA 124.392 0.996 . . . . 0.0 113.488 172.362 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 24.4 p -57.15 -36.22 70.47 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.81 1.244 . . . . 0.0 113.11 177.927 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 67.5 m-70 -71.97 -29.65 64.47 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 119.665 1.12 . . . . 0.0 113.001 175.643 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 58.3 tp -70.75 -42.75 70.06 Favored 'General case' 0 N--CA 1.471 0.581 0 O-C-N 121.287 -0.883 . . . . 0.0 111.403 170.367 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 43.5 t -58.95 -48.39 86.65 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 124.415 1.086 . . . . 0.0 110.533 173.909 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -55.96 -49.7 72.83 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.354 1.462 . . . . 0.0 111.692 173.611 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.27 -47.91 83.86 Favored 'General case' 0 CA--C 1.534 0.359 0 O-C-N 121.618 -0.676 . . . . 0.0 111.937 178.487 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 50.4 mt -60.23 -40.9 91.83 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 118.884 0.765 . . . . 0.0 111.524 178.568 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 11.8 m-85 -63.63 -47.13 82.63 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-N 119.139 0.881 . . . . 0.0 112.716 173.575 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 9.2 mp -69.7 -38.23 76.9 Favored 'General case' 0 N--CA 1.472 0.632 0 O-C-N 121.614 -0.679 . . . . 0.0 112.463 -178.373 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 73.8 t -76.08 -43.76 37.94 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 C-N-CA 124.391 1.077 . . . . 0.0 111.633 -177.559 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 64.5 m -96.71 -20.62 18.12 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 114.763 1.394 . . . . 0.0 114.763 -173.81 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 71.68 -143.56 35.47 Favored Glycine 0 CA--C 1.533 1.2 0 C-N-CA 124.584 1.087 . . . . 0.0 112.466 179.243 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -63.67 -17.7 63.22 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 125.012 1.325 . . . . 0.0 113.65 -178.531 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 61.6 mtm180 -61.23 -31.2 70.99 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.354 1.062 . . . . 0.0 113.729 -179.516 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.18 171.81 29.66 Favored Glycine 0 CA--C 1.533 1.173 0 C-N-CA 124.192 0.901 . . . . 0.0 113.872 178.634 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 51.7 p90 -137.67 155.98 48.54 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 125.682 1.593 . . . . 0.0 113.333 -169.793 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 2.8 t80 -100.43 114.17 27.52 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.548 1.539 . . . . 0.0 108.944 169.108 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 15.6 t80 -85.36 57.2 4.32 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 124.953 1.301 . . . . 0.0 112.245 -173.285 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 2.7 m -65.89 122.69 82.18 Favored Pre-proline 0 N--CA 1.476 0.869 0 C-N-CA 125.255 1.422 . . . . 0.0 112.413 -169.598 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -80.01 -171.84 1.36 Allowed 'Trans proline' 0 CA--C 1.537 0.655 0 C-N-CA 124.165 3.244 . . . . 0.0 111.305 175.151 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 61.4 tttm -60.66 -35.64 76.71 Favored 'General case' 0 CA--C 1.547 0.842 0 O-C-N 121.273 -0.892 . . . . 0.0 113.284 174.025 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 30.5 p -130.75 -95.47 0.37 Allowed 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 126.315 1.846 . . . . 0.0 110.78 -169.896 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 23.1 pttp -155.77 24.48 0.39 Allowed 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 126.377 1.871 . . . . 0.0 113.093 -170.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 70.5 mtt180 . . . . . 0 C--O 1.252 1.224 0 C-N-CA 126.994 2.118 . . . . 0.0 113.44 -176.252 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.739 0 N-CA-C 111.872 -0.491 . . . . 0.0 111.872 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 18.1 tt -53.66 -31.23 19.56 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.144 0 N-CA-C 115.921 1.823 . . . . 0.0 115.921 -169.341 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 5.4 p -62.24 -27.21 42.14 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 O-C-N 121.294 -0.879 . . . . 0.0 112.492 176.105 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -73.71 -1.25 18.35 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 124.808 1.243 . . . . 0.0 112.862 174.821 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 12.2 tt0 -111.3 -57.46 2.24 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.046 1.338 . . . . 0.0 108.978 168.129 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 67.2 m -67.0 -27.61 67.58 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 114.802 1.408 . . . . 0.0 114.802 -170.604 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 11.9 t -92.64 -30.65 15.48 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.459 0.703 . . . . 0.0 112.819 -177.592 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 37.8 p -87.85 -31.65 19.42 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 126.344 1.857 . . . . 0.0 112.251 -178.965 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 9.1 t -142.59 -164.81 1.9 Allowed 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 126.268 1.827 . . . . 0.0 109.997 179.798 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 23.1 mm -86.52 144.66 8.94 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 C-N-CA 125.28 1.432 . . . . 0.0 110.469 177.057 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 15.0 p -137.29 172.81 12.43 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.119 1.368 . . . . 0.0 111.337 169.087 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 46.3 t -120.1 151.32 39.22 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 124.249 1.019 . . . . 0.0 112.354 -175.846 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 26.1 mt -60.77 -27.38 67.94 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.76 0.824 . . . . 0.0 112.116 175.431 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 87.1 t80 -60.87 -32.29 71.73 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 123.885 0.874 . . . . 0.0 113.178 170.262 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 68.6 mt-30 -77.73 -31.77 52.42 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.785 0.834 . . . . 0.0 110.934 176.989 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 41.2 mt -59.96 -50.37 74.0 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 122.95 0.5 . . . . 0.0 110.309 169.707 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -60.96 -28.92 69.34 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 113.294 0.85 . . . . 0.0 113.294 175.333 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 31.6 t30 -73.28 -33.88 65.46 Favored 'General case' 0 CA--C 1.545 0.778 0 CA-C-N 118.859 0.754 . . . . 0.0 112.415 176.674 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -70.81 -48.59 53.36 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.972 0.909 . . . . 0.0 112.09 171.937 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 85.0 m -54.13 134.61 44.23 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.067 1.347 . . . . 0.0 113.244 179.399 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 5.4 p30 . . . . . 0 C--O 1.252 1.189 0 C-N-CA 126.13 1.772 . . . . 0.0 113.518 -174.999 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 60.5 t80 . . . . . 0 N--CA 1.486 1.361 0 CA-C-O 119.618 -0.23 . . . . 0.0 110.527 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 10.3 t 78.37 -34.65 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 C-N-CA 128.346 2.658 . . . . 0.0 111.336 -175.99 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 11.4 p-10 -71.19 135.08 47.38 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 125.863 1.665 . . . . 0.0 112.459 169.594 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 3.3 tt0 -167.85 169.88 11.16 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.881 1.272 . . . . 0.0 111.701 179.705 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 98.5 m-70 -86.75 147.48 25.83 Favored 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 165.02 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 64.5 mt -149.22 141.26 23.86 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.784 1.634 . . . . 0.0 109.632 174.91 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.7 t -147.88 144.35 28.04 Favored 'General case' 0 N--CA 1.474 0.75 0 O-C-N 120.97 -1.081 . . . . 0.0 112.997 -178.076 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 50.04 -125.23 19.24 Favored Glycine 0 N--CA 1.471 1.003 0 C-N-CA 125.123 1.344 . . . . 0.0 113.841 171.496 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 20.0 m -56.83 -33.15 66.47 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.568 1.147 . . . . 0.0 113.248 178.492 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -73.25 -36.27 66.36 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.075 -1.016 . . . . 0.0 111.802 176.727 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 26.8 tp -68.49 -43.41 76.95 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 123.889 0.876 . . . . 0.0 111.041 173.253 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 50.4 t -60.45 -44.25 95.87 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.984 0 C-N-CA 124.731 1.212 . . . . 0.0 111.253 173.277 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -64.56 -43.88 92.52 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 123.446 0.698 . . . . 0.0 111.537 175.68 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.07 -45.18 94.65 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 123.33 0.652 . . . . 0.0 111.677 176.594 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 18.9 mt -53.66 -51.0 64.56 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.196 0.999 . . . . 0.0 111.118 172.869 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 21.1 m-85 -60.46 -46.52 89.77 Favored 'General case' 0 CA--C 1.542 0.662 0 O-C-N 121.479 -0.763 . . . . 0.0 113.025 177.207 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 84.4 mt -67.72 -40.72 84.22 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 123.672 0.789 . . . . 0.0 112.907 -178.998 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 49.5 t -75.21 -44.56 43.0 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 C-N-CA 123.826 0.85 . . . . 0.0 111.598 -178.599 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 78.3 m -87.53 -23.79 24.27 Favored 'General case' 0 N--CA 1.466 0.348 0 N-CA-C 114.413 1.264 . . . . 0.0 114.413 -171.619 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 52.35 -103.88 0.14 Allowed Glycine 0 CA--C 1.533 1.18 0 C-N-CA 124.428 1.013 . . . . 0.0 114.04 169.43 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -80.1 -16.11 55.7 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 126.181 1.792 . . . . 0.0 114.729 -177.468 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -70.76 -31.05 67.72 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 119.077 0.853 . . . . 0.0 112.385 175.753 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 82.64 142.16 4.26 Favored Glycine 0 CA--C 1.535 1.314 0 C-N-CA 125.027 1.299 . . . . 0.0 112.213 -173.913 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -80.62 173.39 12.65 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 114.197 1.184 . . . . 0.0 114.197 -175.387 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 19.3 t80 -156.37 39.82 0.35 Allowed 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.444 1.097 . . . . 0.0 112.033 -174.388 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 60.3 t80 -54.66 140.56 35.08 Favored 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 113.74 1.015 . . . . 0.0 113.74 -177.861 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 38.6 m -140.02 117.79 8.39 Favored Pre-proline 0 N--CA 1.474 0.765 0 C-N-CA 125.119 1.368 . . . . 0.0 109.651 177.688 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_exo -56.36 -178.71 0.08 OUTLIER 'Trans proline' 0 C--N 1.353 0.8 1 C-N-CA 125.668 4.245 . . . . 0.0 115.427 170.136 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 45.1 mttm -50.35 -51.65 43.88 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 125.373 1.469 . . . . 0.0 113.387 -179.038 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 19.3 p -125.91 109.0 11.97 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 126.812 2.045 . . . . 0.0 108.781 -179.078 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . 0.272 65.1 pttt 45.42 -144.0 0.21 Allowed 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 126.822 2.049 . . . . 0.0 113.993 -178.082 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 97.1 mtt180 . . . . . 0 C--O 1.253 1.272 0 C-N-CA 126.613 1.965 . . . . 0.0 111.012 -179.891 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.315 0 N-CA-C 111.239 -0.744 . . . . 0.0 111.239 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -86.26 -19.72 8.19 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 N-CA-C 114.875 1.435 . . . . 0.0 114.875 -177.576 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 23.2 t -59.45 -41.58 85.03 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.171 0 CA-C-N 119.879 1.218 . . . . 0.0 110.618 -174.248 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -70.3 -9.2 55.37 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.93 1.692 . . . . 0.0 113.472 -179.569 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 54.8 tt0 -103.54 -62.98 1.23 Allowed 'General case' 0 C--O 1.226 -0.178 0 C-N-CA 124.38 1.072 . . . . 0.0 109.24 169.815 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 86.8 m -55.48 -32.67 63.01 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 114.656 1.354 . . . . 0.0 114.656 -169.547 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 84.1 m -76.0 -20.59 57.72 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 113.889 1.07 . . . . 0.0 113.889 -176.456 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 39.5 p -126.09 -43.49 1.81 Allowed 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 125.564 1.545 . . . . 0.0 112.251 -171.053 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 67.5 m -102.84 176.51 5.13 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 127.136 2.174 . . . . 0.0 110.963 171.527 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 69.1 mt -82.24 145.57 8.44 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 O-C-N 120.619 -1.3 . . . . 0.0 110.077 173.781 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 15.0 p -136.57 -179.9 5.97 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.113 1.365 . . . . 0.0 111.432 170.492 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 93.4 p -138.49 159.86 41.02 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 121.149 -0.969 . . . . 0.0 112.02 -171.798 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 39.7 mt -62.42 -30.94 71.59 Favored 'General case' 0 CA--C 1.541 0.597 0 O-C-N 122.043 -0.411 . . . . 0.0 111.516 174.956 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.3 t80 -63.93 -34.15 77.32 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 123.784 0.833 . . . . 0.0 113.17 172.168 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 36.1 mt-30 -76.82 -26.59 54.54 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 123.639 0.776 . . . . 0.0 111.914 172.888 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 38.0 mt -71.05 -41.67 70.46 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 119.427 1.012 . . . . 0.0 111.901 169.673 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -53.55 -33.1 53.46 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.401 1.08 . . . . 0.0 113.182 175.055 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.0 t-20 -60.08 -22.44 62.73 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 178.075 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 70.1 m-85 -107.91 9.26 28.75 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.718 1.607 . . . . 0.0 114.184 177.357 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 75.9 m -83.39 147.31 27.96 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 121.113 -0.992 . . . . 0.0 111.795 169.545 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 83.4 m-20 . . . . . 0 C--O 1.254 1.3 0 CA-C-O 117.774 -1.107 . . . . 0.0 112.074 173.086 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . 0.277 8.8 p90 . . . . . 0 N--CA 1.496 1.83 0 CA-C-O 117.978 -1.011 . . . . 0.0 108.984 . . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 48.8 t -140.76 91.46 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 C-N-CA 126.33 1.852 . . . . 0.0 106.718 169.523 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 -162.36 152.1 16.15 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.617 1.167 . . . . 0.0 113.088 -167.836 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -174.98 177.68 1.92 Allowed 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 126.646 1.978 . . . . 0.0 110.688 -174.977 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -83.19 145.25 29.28 Favored 'General case' 0 CA--C 1.546 0.794 0 O-C-N 120.983 -1.073 . . . . 0.0 109.692 167.454 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 77.2 mt -147.99 138.43 22.93 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 125.892 1.677 . . . . 0.0 110.106 177.261 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 3.6 t -148.0 155.45 41.53 Favored 'General case' 0 CA--C 1.535 0.401 0 O-C-N 120.977 -1.077 . . . . 0.0 113.117 175.342 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 53.93 -130.6 43.69 Favored Glycine 0 N--CA 1.469 0.894 0 C-N-CA 124.874 1.226 . . . . 0.0 113.402 171.791 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.8 m -52.3 -39.35 60.42 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 124.529 1.132 . . . . 0.0 112.768 178.667 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 12.9 t60 -76.19 -30.67 58.12 Favored 'General case' 0 CA--C 1.541 0.626 0 O-C-N 121.097 -1.002 . . . . 0.0 112.578 -177.209 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 50.2 tp -67.94 -41.2 82.87 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 121.54 -0.725 . . . . 0.0 110.899 169.091 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 53.8 t -63.43 -43.1 98.31 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 C-N-CA 124.267 1.027 . . . . 0.0 111.389 174.64 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 57.0 mt-10 -56.88 -50.33 72.83 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.64 0.776 . . . . 0.0 111.341 170.58 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.63 -43.69 93.72 Favored 'General case' 0 CA--C 1.539 0.546 0 O-C-N 121.693 -0.629 . . . . 0.0 111.715 179.628 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 31.3 mt -59.02 -45.11 91.53 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.656 0.782 . . . . 0.0 111.842 173.682 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 18.4 m-85 -62.01 -42.33 99.04 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-N 119.585 1.084 . . . . 0.0 112.918 174.328 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 8.9 mp -68.41 -40.88 81.12 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 118.673 0.67 . . . . 0.0 112.029 178.472 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 54.7 t -70.7 -45.37 74.19 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 123.78 0.832 . . . . 0.0 111.852 179.46 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 57.2 m -80.38 -27.86 38.08 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 113.632 0.975 . . . . 0.0 113.632 -177.859 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 67.42 -138.94 34.7 Favored Glycine 0 CA--C 1.53 0.992 0 C-N-CA 123.891 0.758 . . . . 0.0 111.711 -176.426 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 2.4 pm0 -69.37 -15.49 63.32 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.786 1.234 . . . . 0.0 113.757 178.104 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 54.6 mtm180 -69.06 -34.36 75.04 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.296 1.039 . . . . 0.0 112.646 179.706 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.09 177.64 36.97 Favored Glycine 0 CA--C 1.533 1.175 0 C-N-CA 124.453 1.025 . . . . 0.0 113.711 -175.415 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 7.3 p90 -117.26 166.44 12.28 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 126.485 1.914 . . . . 0.0 112.922 -176.529 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 47.0 p90 -128.7 8.99 5.87 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.276 1.43 . . . . 0.0 113.731 175.145 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 5.2 p90 -55.13 147.43 16.15 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 115.167 1.543 . . . . 0.0 115.167 -171.951 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 23.6 p -89.25 134.75 32.37 Favored Pre-proline 0 N--CA 1.47 0.529 0 C-N-CA 124.596 1.158 . . . . 0.0 110.041 170.015 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -80.06 177.54 8.18 Favored 'Trans proline' 0 CA--C 1.538 0.712 0 C-N-CA 123.145 2.564 . . . . 0.0 111.397 176.859 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 40.6 ttpt -59.04 -34.71 72.23 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 123.751 0.82 . . . . 0.0 113.06 177.156 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 27.0 m -122.96 82.51 2.0 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.904 1.682 . . . . 0.0 108.481 178.958 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -63.33 131.51 48.54 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 124.092 0.957 . . . . 0.0 111.954 179.008 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 77.5 ttt180 . . . . . 0 C--O 1.252 1.223 0 C-N-CA 125.576 1.551 . . . . 0.0 111.985 177.109 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.486 0 N-CA-C 111.121 -0.792 . . . . 0.0 111.121 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 10.2 tt -96.56 -31.72 4.07 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 N-CA-C 112.902 0.705 . . . . 0.0 112.902 172.77 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 87.4 t -65.83 -46.19 89.43 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 CA-C-N 119.418 1.008 . . . . 0.0 112.151 -169.244 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -73.69 -29.59 62.38 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 119.235 0.925 . . . . 0.0 112.084 174.474 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 -67.95 -35.77 78.95 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.586 1.155 . . . . 0.0 112.219 179.398 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 14.8 m -97.48 -25.57 15.13 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 114.992 1.479 . . . . 0.0 114.992 176.842 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 27.8 t -95.06 -59.18 1.96 Allowed 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 120.014 1.279 . . . . 0.0 112.157 -176.305 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 20.9 m -71.26 -50.48 32.34 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.39 1.076 . . . . 0.0 109.847 179.265 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 75.2 m -91.22 171.16 9.43 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 124.203 1.001 . . . . 0.0 111.129 168.623 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 12.3 tt -91.87 147.38 5.34 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 124.124 0.97 . . . . 0.0 110.893 175.411 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 18.9 p -135.71 150.98 49.72 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 113.568 0.951 . . . . 0.0 113.568 177.325 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 13.2 t -106.53 164.14 12.31 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 125.262 1.425 . . . . 0.0 111.206 176.092 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 78.0 mt -59.39 -25.88 64.65 Favored 'General case' 0 CA--C 1.541 0.617 0 O-C-N 121.355 -0.841 . . . . 0.0 113.037 -177.755 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.8 t80 -60.01 -32.53 70.96 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 123.832 0.853 . . . . 0.0 113.224 170.397 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -81.08 -30.51 34.7 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.452 1.101 . . . . 0.0 110.927 176.181 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -64.89 -44.49 89.44 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 119.546 1.066 . . . . 0.0 110.626 169.238 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -59.84 -28.59 67.63 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 124.449 1.1 . . . . 0.0 113.822 176.421 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 22.4 t30 -59.36 -28.24 66.68 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 123.764 0.825 . . . . 0.0 113.095 177.446 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 97.6 m-85 -99.99 2.2 43.27 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.848 1.259 . . . . 0.0 113.899 -179.292 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 64.8 m -72.28 170.08 14.88 Favored 'General case' 0 CA--C 1.549 0.907 0 O-C-N 120.959 -1.088 . . . . 0.0 111.951 169.642 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.253 1.261 0 C-N-CA 125.374 1.469 . . . . 0.0 112.678 176.402 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 64.2 m-85 . . . . . 0 N--CA 1.488 1.469 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 8.0 t -85.92 57.48 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.369 0 CA-C-N 120.228 1.376 . . . . 0.0 109.223 174.456 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -97.32 130.36 44.5 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.535 1.534 . . . . 0.0 113.027 -170.749 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 41.1 mt-30 -148.01 163.77 35.85 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.872 1.669 . . . . 0.0 111.124 -174.903 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 57.5 m-70 -94.44 129.55 41.14 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 167.439 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 69.8 mt -137.06 135.1 37.21 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 126.184 1.794 . . . . 0.0 109.03 -176.36 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 1.4 t -143.02 142.95 31.72 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.256 0.622 . . . . 0.0 111.87 -171.918 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 51.17 -121.6 12.12 Favored Glycine 0 CA--C 1.53 0.973 0 C-N-CA 124.567 1.08 . . . . 0.0 113.957 170.439 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 16.3 t -55.51 -39.82 70.98 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.13 0.972 . . . . 0.0 112.701 178.199 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 72.6 m-70 -73.56 -27.93 61.59 Favored 'General case' 0 CA--C 1.542 0.661 0 O-C-N 120.455 -1.403 . . . . 0.0 113.348 178.013 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 41.8 tp -72.86 -41.79 64.39 Favored 'General case' 0 N--CA 1.467 0.415 0 O-C-N 121.437 -0.789 . . . . 0.0 111.654 170.836 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 24.9 t -60.67 -43.31 94.66 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.851 0 C-N-CA 124.495 1.118 . . . . 0.0 111.0 172.084 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -60.34 -46.8 88.65 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.312 1.445 . . . . 0.0 111.68 173.011 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.15 -40.99 95.91 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 121.461 -0.774 . . . . 0.0 112.23 175.907 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 59.6 mt -63.14 -42.18 99.42 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 118.915 0.779 . . . . 0.0 111.846 174.51 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 21.7 m-85 -61.58 -40.04 93.34 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 119.269 0.94 . . . . 0.0 112.521 172.309 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 79.0 mt -69.46 -44.51 71.07 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 123.824 0.849 . . . . 0.0 112.28 177.997 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 79.3 t -74.66 -44.46 46.56 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 C-N-CA 123.921 0.888 . . . . 0.0 112.095 -177.63 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 40.5 m -87.55 -26.61 23.05 Favored 'General case' 0 N--CA 1.474 0.772 0 N-CA-C 113.599 0.963 . . . . 0.0 113.599 -176.159 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 73.48 -153.09 47.29 Favored Glycine 0 CA--C 1.531 1.069 0 C-N-CA 125.188 1.375 . . . . 0.0 112.998 -179.698 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -59.14 -22.12 60.4 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.372 1.469 . . . . 0.0 113.867 -176.741 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.97 -26.98 68.82 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.759 1.223 . . . . 0.0 113.087 178.009 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 79.09 -172.62 55.27 Favored Glycine 0 CA--C 1.53 0.969 0 C-N-CA 124.543 1.068 . . . . 0.0 113.657 -176.098 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 40.4 p90 -148.92 161.02 42.7 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.011 1.324 . . . . 0.0 113.658 -169.321 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 57.3 m-85 -88.48 149.19 23.78 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 125.35 1.46 . . . . 0.0 109.364 167.89 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 48.4 t80 -138.5 130.36 28.08 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 121.455 -0.778 . . . . 0.0 112.864 -176.097 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 78.5 m -141.13 108.18 6.27 Favored Pre-proline 0 N--CA 1.472 0.666 0 C-N-CA 124.688 1.195 . . . . 0.0 110.267 -179.348 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_endo -80.88 168.65 17.25 Favored 'Trans proline' 0 N--CA 1.455 -0.756 0 C-N-CA 123.528 2.819 . . . . 0.0 110.908 169.487 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 39.7 ttpt -57.11 -29.94 63.95 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 123.351 0.66 . . . . 0.0 112.291 172.009 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 4.2 m -59.49 -26.52 65.35 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 127.869 2.468 . . . . 0.0 113.696 -179.808 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 36.7 ttmt -71.94 -20.94 61.68 Favored 'General case' 0 CA--C 1.551 1.008 0 N-CA-C 113.334 0.864 . . . . 0.0 113.334 178.796 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.23 0 C-N-CA 125.514 1.526 . . . . 0.0 112.968 -177.665 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.611 0 N-CA-C 111.718 -0.553 . . . . 0.0 111.718 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 9.8 tt -109.14 -10.33 11.28 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.251 0 C-N-CA 124.978 1.311 . . . . 0.0 114.332 -172.112 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 9.0 p -58.9 -35.67 57.63 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 O-C-N 121.106 -0.996 . . . . 0.0 113.636 -169.809 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 55.1 mt-10 -73.13 -10.46 59.8 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 119.178 0.899 . . . . 0.0 113.325 175.864 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 -93.26 -60.34 1.81 Allowed 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 108.565 -0.902 . . . . 0.0 108.565 169.053 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 56.1 m -62.83 -29.97 71.13 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 115.304 1.594 . . . . 0.0 115.304 -173.461 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 13.9 t -89.7 -29.0 19.05 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.581 0.752 . . . . 0.0 112.802 -175.847 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 28.1 m -97.07 -39.09 9.49 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 125.835 1.654 . . . . 0.0 111.502 -176.171 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 70.2 m -124.96 -173.21 2.75 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.247 1.819 . . . . 0.0 110.017 176.062 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 11.6 tt -88.41 143.47 11.15 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 O-C-N 120.336 -1.478 . . . . 0.0 110.577 176.281 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 18.9 p -130.92 166.08 21.69 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.438 1.095 . . . . 0.0 111.754 175.677 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 44.9 p -108.08 159.98 16.15 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 113.718 1.007 . . . . 0.0 113.718 -174.199 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 77.0 mt -64.53 -30.83 71.86 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 121.332 -0.855 . . . . 0.0 111.433 172.369 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 87.6 t80 -65.63 -34.67 78.76 Favored 'General case' 0 CA--C 1.542 0.645 0 O-C-N 121.481 -0.762 . . . . 0.0 112.816 174.153 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -71.46 -26.53 62.75 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 123.6 0.76 . . . . 0.0 112.07 172.837 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 98.5 mt -74.49 -41.82 60.05 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 119.143 0.883 . . . . 0.0 112.01 169.769 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -55.97 -29.07 59.66 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 124.21 1.004 . . . . 0.0 113.237 176.735 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 17.8 t30 -52.88 -32.04 42.92 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.729 1.211 . . . . 0.0 113.511 174.376 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 87.4 m-85 -97.69 2.03 49.26 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 125.398 1.479 . . . . 0.0 114.695 -175.766 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 73.0 m -78.43 150.83 32.99 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.005 0.922 . . . . 0.0 113.239 178.575 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 . . . . . 0 C--O 1.25 1.101 0 C-N-CA 124.31 1.044 . . . . 0.0 112.243 170.535 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 52.8 p90 . . . . . 0 N--CA 1.485 1.288 0 CA-C-O 118.832 -0.604 . . . . 0.0 110.721 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . 0.3 24.0 m 58.59 -37.3 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 C-N-CA 130.39 3.476 . . . . 0.0 116.44 -173.809 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 17.6 m120 -126.95 138.53 53.29 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 127.329 2.251 . . . . 0.0 109.209 169.011 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 33.0 tp60 -158.95 160.43 36.02 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 123.51 0.724 . . . . 0.0 111.483 -169.365 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 95.9 m-70 -98.13 133.03 43.14 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 123.881 0.872 . . . . 0.0 109.017 167.724 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 88.5 mt -146.57 141.88 27.42 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 124.986 1.314 . . . . 0.0 110.383 -171.799 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 2.0 t -153.25 146.26 24.55 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.157 0.583 . . . . 0.0 111.823 -177.247 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 52.3 -126.47 30.93 Favored Glycine 0 N--CA 1.475 1.263 0 C-N-CA 124.766 1.174 . . . . 0.0 114.086 171.952 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 31.4 p -58.97 -33.87 71.15 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.628 1.171 . . . . 0.0 113.142 178.301 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 22.4 t-160 -71.55 -37.22 71.13 Favored 'General case' 0 CA--C 1.544 0.731 0 O-C-N 121.036 -1.04 . . . . 0.0 111.57 176.497 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 64.0 tp -65.15 -44.99 86.8 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 123.587 0.755 . . . . 0.0 111.525 171.689 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 40.4 t -60.82 -43.85 96.32 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 C-N-CA 124.286 1.034 . . . . 0.0 111.177 175.414 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -64.42 -42.75 95.88 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 123.59 0.756 . . . . 0.0 111.725 175.628 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.37 -41.61 98.76 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 121.677 -0.639 . . . . 0.0 111.885 175.782 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 36.6 mt -58.78 -47.84 83.34 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 118.46 0.573 . . . . 0.0 110.852 172.906 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 26.2 m-85 -59.47 -41.54 89.98 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 119.679 1.127 . . . . 0.0 112.876 175.252 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 77.6 mt -67.0 -41.32 86.94 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.998 0.919 . . . . 0.0 112.424 177.511 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 44.3 t -69.86 -42.37 79.88 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 C-N-CA 124.239 1.016 . . . . 0.0 111.798 178.62 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 61.4 m -81.6 -32.0 32.23 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 113.837 1.051 . . . . 0.0 113.837 -176.003 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 82.04 -148.21 26.84 Favored Glycine 0 CA--C 1.53 1.01 0 C-N-CA 124.616 1.103 . . . . 0.0 112.686 -177.832 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 3.8 pm0 -62.88 -23.43 67.33 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 126.292 1.837 . . . . 0.0 115.494 -169.032 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 18.1 mtm-85 -83.7 -20.18 33.96 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 124.663 1.185 . . . . 0.0 113.221 -177.951 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.9 -161.63 54.3 Favored Glycine 0 CA--C 1.532 1.155 0 C-N-CA 124.611 1.101 . . . . 0.0 113.38 -174.96 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 9.9 p90 -125.73 164.83 19.8 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 126.252 1.821 . . . . 0.0 112.993 -172.947 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 43.0 p90 -101.58 3.71 40.26 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 124.793 1.237 . . . . 0.0 112.394 168.301 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 79.8 t80 -48.86 141.91 6.99 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 126.623 1.969 . . . . 0.0 115.438 -177.166 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 24.1 p -136.77 137.2 22.86 Favored Pre-proline 0 N--CA 1.472 0.659 0 C-N-CA 126.084 1.753 . . . . 0.0 109.247 168.322 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -77.06 162.47 31.77 Favored 'Trans proline' 0 N--CA 1.459 -0.531 0 C-N-CA 123.358 2.705 . . . . 0.0 110.915 173.989 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 52.3 mtpt -68.73 -12.0 60.93 Favored 'General case' 0 CA--C 1.547 0.858 0 N-CA-C 114.057 1.132 . . . . 0.0 114.057 -177.779 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 24.0 p -76.86 -24.1 52.64 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 126.069 1.748 . . . . 0.0 112.937 171.163 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -110.45 5.36 21.32 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 125.388 1.475 . . . . 0.0 114.049 -177.154 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.242 0 C-N-CA 125.832 1.653 . . . . 0.0 112.845 177.545 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.397 0 N-CA-C 111.957 -0.457 . . . . 0.0 111.957 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 10.0 tp -89.69 -34.33 6.64 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 N-CA-C 113.265 0.839 . . . . 0.0 113.265 -177.383 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 10.6 p -69.53 -38.76 77.46 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 C-N-CA 123.534 0.734 . . . . 0.0 112.503 -171.185 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 21.3 pm0 -72.51 -2.51 19.95 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 123.964 0.906 . . . . 0.0 113.333 174.855 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -105.17 -57.46 2.03 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.77 1.228 . . . . 0.0 110.417 172.23 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 21.4 m -68.22 -28.33 67.15 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 114.58 1.326 . . . . 0.0 114.58 -175.462 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 73.5 m -73.62 -47.15 42.43 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-N 119.644 1.111 . . . . 0.0 111.078 170.941 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 27.4 m -71.3 -37.17 71.84 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 126.538 1.935 . . . . 0.0 112.291 -170.737 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 48.2 m -137.2 167.7 21.05 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 125.326 1.45 . . . . 0.0 111.572 -176.313 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 39.2 mt -63.31 132.88 29.29 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 O-C-N 121.289 -0.882 . . . . 0.0 109.958 170.774 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 7.1 p -135.12 156.63 48.67 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.179 0.992 . . . . 0.0 112.635 176.254 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 34.2 t -108.79 160.83 15.66 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 126.138 1.775 . . . . 0.0 111.558 -175.229 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 23.7 mt -57.46 -28.01 62.98 Favored 'General case' 0 N--CA 1.469 0.504 0 O-C-N 121.62 -0.675 . . . . 0.0 111.838 173.17 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 85.9 t80 -61.85 -31.16 71.4 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 124.237 1.015 . . . . 0.0 113.665 173.06 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 34.5 mt-30 -79.16 -32.0 44.17 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.725 0.81 . . . . 0.0 111.015 174.381 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 55.0 mt -67.58 -41.14 84.62 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.36 0.664 . . . . 0.0 112.255 171.578 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -55.31 -33.15 63.06 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 124.866 1.266 . . . . 0.0 113.099 175.184 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 17.3 t30 -61.27 -26.5 67.81 Favored 'General case' 0 CA--C 1.547 0.839 0 N-CA-C 113.141 0.793 . . . . 0.0 113.141 176.811 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 49.2 m-85 -99.6 -1.77 37.31 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.409 1.484 . . . . 0.0 114.168 -179.293 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 73.5 m -67.26 151.03 48.23 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 120.867 -1.146 . . . . 0.0 112.957 173.202 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 90.0 m-20 . . . . . 0 C--O 1.252 1.208 0 C-N-CA 124.376 1.07 . . . . 0.0 111.95 169.754 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 43.8 p90 . . . . . 0 N--CA 1.487 1.378 0 CA-C-O 119.11 -0.471 . . . . 0.0 110.7 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 15.4 m -77.78 63.94 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.444 0 C-N-CA 125.513 1.525 . . . . 0.0 112.914 -173.17 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 38.8 t30 -157.87 109.7 2.31 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.917 1.687 . . . . 0.0 109.654 -175.35 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 2.6 mm-40 -168.09 175.65 6.51 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 125.291 1.436 . . . . 0.0 110.713 -169.626 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 49.0 m-70 -68.22 134.73 50.91 Favored 'General case' 0 CA--C 1.544 0.728 0 O-C-N 120.7 -1.25 . . . . 0.0 109.485 168.017 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 76.4 mt -135.31 126.89 28.87 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 125.631 1.572 . . . . 0.0 109.119 176.083 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.7 t -143.76 150.16 38.19 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 113.093 0.775 . . . . 0.0 113.093 -174.041 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 54.98 -128.27 43.14 Favored Glycine 0 N--CA 1.469 0.86 0 C-N-CA 124.68 1.133 . . . . 0.0 113.059 173.755 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 15.8 m -54.78 -36.17 64.61 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.518 1.127 . . . . 0.0 113.282 177.832 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 73.9 m-70 -76.76 -29.21 56.02 Favored 'General case' 0 CA--C 1.539 0.526 0 O-C-N 120.895 -1.128 . . . . 0.0 113.036 178.061 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 56.3 tp -69.54 -44.75 70.3 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 118.888 0.767 . . . . 0.0 110.689 169.908 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 25.3 t -60.22 -43.72 93.93 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.981 0 C-N-CA 124.904 1.282 . . . . 0.0 111.017 175.027 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -59.45 -50.44 73.92 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 125.142 1.377 . . . . 0.0 111.45 172.317 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.59 -40.75 97.91 Favored 'General case' 0 CA--C 1.537 0.466 0 O-C-N 121.397 -0.815 . . . . 0.0 111.978 179.683 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 40.0 mt -61.27 -42.66 99.02 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 123.661 0.784 . . . . 0.0 111.683 173.771 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 19.3 m-85 -61.97 -42.0 98.63 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-N 119.885 1.221 . . . . 0.0 112.678 172.702 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 9.0 mp -68.3 -42.39 79.5 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 118.613 0.642 . . . . 0.0 112.145 178.676 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 54.5 t -71.19 -45.31 71.7 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 C-N-CA 123.622 0.769 . . . . 0.0 111.809 -179.806 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 43.9 m -89.33 -20.01 24.57 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 114.027 1.121 . . . . 0.0 114.027 -173.023 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 66.91 -149.52 51.35 Favored Glycine 0 CA--C 1.532 1.132 0 C-N-CA 124.544 1.068 . . . . 0.0 113.078 177.956 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -61.26 -23.3 65.56 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 125.248 1.419 . . . . 0.0 113.531 -177.062 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 78.2 mtp85 -64.14 -29.44 70.56 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.34 1.056 . . . . 0.0 112.921 177.441 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.42 -169.69 54.64 Favored Glycine 0 CA--C 1.531 1.093 0 C-N-CA 124.464 1.031 . . . . 0.0 113.14 -175.238 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 54.9 p90 -147.07 157.71 43.7 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.503 1.121 . . . . 0.0 113.684 -171.164 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 60.1 t80 -88.77 147.36 24.49 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.89 1.676 . . . . 0.0 109.869 169.192 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 65.1 t80 -151.02 139.92 20.92 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.816 0.846 . . . . 0.0 111.997 -175.975 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 15.4 t -168.12 141.51 2.65 Favored Pre-proline 0 N--CA 1.472 0.65 0 C-N-CA 126.421 1.889 . . . . 0.0 109.681 -178.318 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -87.8 -163.69 0.17 Allowed 'Trans proline' 0 CA--C 1.54 0.819 0 C-N-CA 124.15 3.234 . . . . 0.0 111.821 178.099 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 39.8 ttmt -60.96 -36.23 78.83 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.861 1.264 . . . . 0.0 113.924 -175.407 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 9.0 t -156.87 -133.97 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 125.998 1.719 . . . . 0.0 109.152 -174.817 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 64.8 pttt -66.9 -4.9 10.54 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 125.627 1.571 . . . . 0.0 114.028 170.372 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 41.5 ptt180 . . . . . 0 C--O 1.255 1.374 0 C-N-CA 129.859 3.263 . . . . 0.0 110.581 -175.558 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.671 0 N-CA-C 111.922 -0.471 . . . . 0.0 111.922 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.406 HD12 ' CD1' ' A' ' 19' ' ' TYR . 12.4 tt -53.38 -34.57 23.04 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.174 0 C-N-CA 125.162 1.385 . . . . 0.0 113.687 -173.099 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 5.4 p -63.11 -27.92 44.08 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 O-C-N 121.518 -0.738 . . . . 0.0 112.92 178.901 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -72.14 -11.97 60.98 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 123.633 0.773 . . . . 0.0 112.833 176.27 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 22.6 tt0 -95.16 -66.49 0.91 Allowed 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 123.855 0.862 . . . . 0.0 109.144 169.165 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 57.0 m -68.94 -26.73 65.22 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 115.797 1.777 . . . . 0.0 115.797 -168.803 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 15.4 t -84.14 -43.26 15.18 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 119.631 1.105 . . . . 0.0 111.179 176.696 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 24.2 m -69.4 -32.33 71.27 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 126.116 1.766 . . . . 0.0 112.609 -179.245 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 91.8 p -147.26 169.12 20.07 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.946 1.298 . . . . 0.0 112.498 -174.967 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 38.7 mt -64.73 134.14 29.58 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.864 0 O-C-N 120.935 -1.103 . . . . 0.0 110.52 174.144 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 9.7 p -133.34 177.37 7.74 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 125.079 1.351 . . . . 0.0 111.195 169.907 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.4 t -139.69 167.33 22.35 Favored 'General case' 0 N--CA 1.466 0.366 0 O-C-N 120.927 -1.108 . . . . 0.0 112.786 179.433 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 46.8 mt -62.59 -30.11 71.09 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.445 1.098 . . . . 0.0 112.71 -169.658 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 83.3 t80 -63.61 -28.14 69.72 Favored 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 172.918 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 60.9 mt-30 -82.83 -23.18 33.86 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 123.84 0.856 . . . . 0.0 111.674 175.804 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 47.7 mt -67.83 -43.57 79.27 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 118.905 0.775 . . . . 0.0 110.742 171.661 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -56.13 -24.99 44.36 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 113.894 1.072 . . . . 0.0 113.894 175.707 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 29.4 t30 -60.47 -27.83 67.86 Favored 'General case' 0 CA--C 1.548 0.871 0 CA-C-N 119.628 1.104 . . . . 0.0 113.072 175.242 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.406 ' CD1' HD12 ' A' ' 2' ' ' ILE . 89.1 m-85 -96.71 2.33 51.92 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.505 1.522 . . . . 0.0 112.874 177.865 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 70.4 m -98.55 161.03 13.89 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.973 1.309 . . . . 0.0 112.535 177.357 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 75.7 m-20 . . . . . 0 C--O 1.25 1.126 0 C-N-CA 123.629 0.772 . . . . 0.0 112.355 175.911 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 55.0 t80 . . . . . 0 N--CA 1.491 1.609 0 N-CA-C 110.077 -0.342 . . . . 0.0 110.077 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 15.4 m -64.27 144.61 14.55 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 O-C-N 121.05 -1.031 . . . . 0.0 111.864 176.303 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 5.3 t30 54.49 60.29 3.64 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 125.517 1.527 . . . . 0.0 113.268 174.419 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 29.8 mm-40 -145.69 171.05 15.3 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 125.853 1.661 . . . . 0.0 111.601 -178.852 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 25.3 m-70 -81.02 143.19 32.68 Favored 'General case' 0 CA--C 1.545 0.776 0 O-C-N 120.956 -1.09 . . . . 0.0 109.607 167.356 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 67.0 mt -140.73 130.45 24.26 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 126.123 1.769 . . . . 0.0 109.148 175.26 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.6 t -135.68 144.31 45.9 Favored 'General case' 0 N--CA 1.472 0.645 0 O-C-N 121.53 -0.731 . . . . 0.0 112.784 -174.826 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 49.78 -123.33 13.11 Favored Glycine 0 N--CA 1.471 1.0 0 C-N-CA 125.287 1.423 . . . . 0.0 114.043 170.955 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 20.2 m -55.12 -38.25 67.94 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.322 1.049 . . . . 0.0 112.55 177.92 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 1.4 t-80 -70.04 -34.2 72.94 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 120.881 -1.137 . . . . 0.0 111.748 179.023 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 43.2 tp -69.99 -41.43 74.4 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 123.889 0.876 . . . . 0.0 111.507 173.653 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 55.0 t -62.15 -42.69 96.08 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 124.755 1.222 . . . . 0.0 110.91 173.313 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -64.39 -41.22 96.78 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.596 0.759 . . . . 0.0 112.233 173.071 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.1 -42.84 99.62 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 119.661 1.119 . . . . 0.0 111.792 174.977 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 26.2 mt -59.36 -44.75 92.67 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 123.362 0.665 . . . . 0.0 111.893 173.166 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 6.1 m-85 -57.76 -48.32 79.99 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.605 0.762 . . . . 0.0 112.208 172.999 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 7.9 mp -67.87 -41.27 83.11 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 123.704 0.801 . . . . 0.0 112.321 -178.077 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 61.5 t -74.33 -46.77 42.95 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.693 0 CA-C-N 118.188 0.449 . . . . 0.0 111.774 -177.061 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 86.3 m -99.96 -25.95 14.15 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 114.178 1.177 . . . . 0.0 114.178 -169.931 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 55.05 -121.64 22.79 Favored Glycine 0 CA--C 1.531 1.051 0 C-N-CA 124.386 0.993 . . . . 0.0 113.477 169.85 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -62.18 -22.9 66.28 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.721 1.608 . . . . 0.0 113.365 -177.073 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 24.6 mmm180 -62.31 -37.34 85.2 Favored 'General case' 0 N--CA 1.472 0.674 0 O-C-N 121.438 -0.788 . . . . 0.0 112.255 175.848 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.2 164.91 9.04 Favored Glycine 0 CA--C 1.535 1.296 0 C-N-CA 124.462 1.029 . . . . 0.0 112.911 -171.105 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 54.7 p90 -146.99 155.09 41.98 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.467 1.107 . . . . 0.0 113.689 -172.483 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 53.7 t80 -105.38 84.17 2.06 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.659 1.584 . . . . 0.0 109.672 175.197 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 66.5 t80 -68.12 140.18 56.19 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.675 -0.641 . . . . 0.0 111.11 172.632 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 15.7 p -133.29 119.22 15.31 Favored Pre-proline 0 CA--C 1.539 0.543 0 C-N-CA 125.132 1.373 . . . . 0.0 110.647 179.583 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -77.58 -179.13 5.14 Favored 'Trans proline' 0 CA--C 1.538 0.7 0 C-N-CA 123.287 2.658 . . . . 0.0 111.023 173.944 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 28.9 ttpp -60.23 -27.1 66.93 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 124.258 1.023 . . . . 0.0 112.804 170.725 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 1.4 m -75.13 -12.79 60.38 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 127.278 2.231 . . . . 0.0 112.6 174.453 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 37.9 ttpt 75.69 -42.82 0.47 Allowed 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 129.059 2.944 . . . . 0.0 113.525 177.899 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 51.0 tpt85 . . . . . 0 C--O 1.251 1.181 0 C-N-CA 126.276 1.83 . . . . 0.0 112.563 -177.907 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.512 0 N-CA-C 111.106 -0.798 . . . . 0.0 111.106 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 7.8 tp -164.62 -48.65 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.069 0 C-N-CA 125.999 1.72 . . . . 0.0 113.039 178.592 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 10.0 p -66.85 -34.9 72.99 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.19 0 CA-C-N 119.873 1.215 . . . . 0.0 111.297 179.962 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -69.38 -11.46 60.84 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.941 1.296 . . . . 0.0 113.535 172.103 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 27.2 tt0 -91.07 -61.18 1.72 Allowed 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 123.681 0.792 . . . . 0.0 108.973 168.751 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 59.9 m -66.31 -21.5 66.27 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 114.647 1.351 . . . . 0.0 114.647 -169.961 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 7.6 t -86.87 -19.1 29.41 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 124.592 1.157 . . . . 0.0 113.008 176.232 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 34.4 m -104.11 -45.96 4.58 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 125.996 1.719 . . . . 0.0 111.28 -174.816 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 66.9 m -120.89 178.1 4.85 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 127.26 2.224 . . . . 0.0 110.11 177.087 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 10.7 tt -84.28 137.13 21.41 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 O-C-N 120.679 -1.263 . . . . 0.0 110.708 178.178 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.8 m -106.75 172.5 6.78 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 125.249 1.419 . . . . 0.0 111.586 176.989 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 34.6 t -122.13 149.17 43.96 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 125.32 1.448 . . . . 0.0 112.08 176.98 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 82.6 mt -60.08 -29.12 68.36 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 121.422 -0.799 . . . . 0.0 111.747 171.076 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 79.1 t80 -63.98 -28.15 69.61 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 113.272 0.842 . . . . 0.0 113.272 173.776 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 90.3 mt-30 -76.26 -37.68 57.27 Favored 'General case' 0 CA--C 1.534 0.328 0 O-C-N 121.621 -0.675 . . . . 0.0 110.466 172.689 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 31.7 mt -64.09 -40.33 96.0 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 118.668 0.667 . . . . 0.0 112.13 175.181 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -54.92 -34.26 62.97 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.297 1.039 . . . . 0.0 113.309 171.631 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 -69.03 -21.43 64.12 Favored 'General case' 0 CA--C 1.549 0.912 0 O-C-N 121.309 -0.869 . . . . 0.0 113.158 179.005 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 75.0 m-85 -96.45 -0.96 48.38 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.186 1.394 . . . . 0.0 114.009 175.758 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 72.7 m -71.31 150.32 45.25 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 119.237 0.926 . . . . 0.0 112.88 173.565 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 . . . . . 0 C--O 1.255 1.383 0 C-N-CA 125.259 1.424 . . . . 0.0 112.762 176.243 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 46.2 t80 . . . . . 0 N--CA 1.486 1.365 0 CA-C-O 119.752 -0.166 . . . . 0.0 111.398 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 21.0 t 74.98 -57.29 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.325 0 C-N-CA 128.321 2.648 . . . . 0.0 111.114 -175.996 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 25.1 m120 -111.99 134.99 53.2 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.729 1.212 . . . . 0.0 112.326 177.864 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -151.63 155.52 38.56 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 125.28 1.432 . . . . 0.0 111.646 -175.569 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 95.4 m-70 -93.15 133.37 36.4 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 108.004 -1.109 . . . . 0.0 108.004 166.148 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 84.0 mt -143.52 134.71 25.78 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 124.687 1.195 . . . . 0.0 110.538 -170.972 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.6 t -149.49 132.41 16.13 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 123.399 0.68 . . . . 0.0 111.883 -175.107 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 58.65 -124.41 36.46 Favored Glycine 0 N--CA 1.472 1.047 0 C-N-CA 124.356 0.979 . . . . 0.0 112.861 177.295 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.8 m -52.02 -37.77 54.54 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.789 1.236 . . . . 0.0 112.827 177.454 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 40.8 m80 -66.21 -40.18 90.16 Favored 'General case' 0 CA--C 1.543 0.684 0 O-C-N 121.084 -1.01 . . . . 0.0 111.582 -179.143 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 53.3 tp -66.86 -41.62 87.01 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.056 0.942 . . . . 0.0 111.171 174.636 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 40.1 t -62.63 -43.06 98.21 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 C-N-CA 124.337 1.055 . . . . 0.0 111.457 175.313 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -61.05 -49.33 77.81 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.565 0.746 . . . . 0.0 111.259 173.797 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.99 -42.15 98.83 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 123.493 0.717 . . . . 0.0 111.501 -179.397 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 29.9 mt -57.37 -52.11 66.7 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 118.613 -0.708 . . . . 0.0 111.339 173.561 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -66.87 -31.83 72.7 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 120.118 1.326 . . . . 0.0 112.484 -178.627 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 79.5 mt -69.64 -39.09 77.33 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 123.903 0.881 . . . . 0.0 112.475 174.82 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 42.4 t -70.73 -44.6 76.24 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 C-N-CA 123.904 0.882 . . . . 0.0 111.954 175.285 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 59.2 m -80.52 -26.45 38.11 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 113.575 0.954 . . . . 0.0 113.575 -174.399 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 71.1 -147.81 43.42 Favored Glycine 0 CA--C 1.532 1.097 0 C-N-CA 124.437 1.018 . . . . 0.0 111.535 -173.256 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -63.24 -14.99 55.62 Favored 'General case' 0 CA--C 1.544 0.732 0 N-CA-C 114.451 1.278 . . . . 0.0 114.451 -178.559 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 59.1 mtm180 -65.36 -35.59 81.43 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.891 1.277 . . . . 0.0 112.742 177.092 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.04 -178.69 51.0 Favored Glycine 0 CA--C 1.533 1.202 0 C-N-CA 124.234 0.921 . . . . 0.0 113.611 -172.852 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 45.7 p90 -124.99 165.86 17.38 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.791 1.636 . . . . 0.0 112.709 -175.056 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 34.6 t80 -142.19 41.99 1.65 Allowed 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 126.669 1.987 . . . . 0.0 110.081 -179.281 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -64.59 156.08 31.12 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 124.685 1.194 . . . . 0.0 114.161 -177.79 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 22.9 p -122.68 67.22 29.39 Favored Pre-proline 0 N--CA 1.48 1.062 0 C-N-CA 125.041 1.336 . . . . 0.0 112.807 -170.618 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -72.76 157.23 52.29 Favored 'Trans proline' 0 C--N 1.348 0.509 0 C-N-CA 123.103 2.536 . . . . 0.0 111.672 176.237 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 94.1 mttt 87.66 119.44 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 129.114 2.965 . . . . 0.0 112.455 172.075 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 31.3 p -59.44 -22.19 61.12 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 126.36 1.864 . . . . 0.0 113.998 173.464 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 83.3 tttt -69.6 -17.68 63.55 Favored 'General case' 0 CA--C 1.553 1.07 0 C-N-CA 125.197 1.399 . . . . 0.0 113.815 177.105 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 59.7 ttm-85 . . . . . 0 C--O 1.252 1.232 0 C-N-CA 126.472 1.909 . . . . 0.0 113.12 -177.974 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.801 0 N-CA-C 111.582 -0.607 . . . . 0.0 111.582 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 17.2 tt -58.79 -27.73 35.68 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.221 0 N-CA-C 115.972 1.841 . . . . 0.0 115.972 -168.82 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 3.7 p -58.88 -29.54 40.86 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 CA-C-N 120.413 1.46 . . . . 0.0 112.17 173.399 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -73.04 -10.4 59.76 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.567 1.147 . . . . 0.0 112.693 177.033 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -99.74 -58.92 1.81 Allowed 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 124.387 1.075 . . . . 0.0 109.115 168.831 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 90.8 m -62.46 -29.85 70.82 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 115.085 1.513 . . . . 0.0 115.085 -172.74 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 8.1 t -87.93 -27.52 22.08 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 123.829 0.851 . . . . 0.0 112.562 179.188 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 23.1 m -90.47 -34.51 15.56 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 126.251 1.821 . . . . 0.0 111.992 -175.418 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.7 t -145.65 -163.68 1.78 Allowed 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 126.356 1.862 . . . . 0.0 110.18 178.654 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 17.8 mm -80.35 146.1 8.11 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 C-N-CA 124.927 1.291 . . . . 0.0 110.713 173.598 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 18.1 p -135.1 170.43 15.91 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.31 1.444 . . . . 0.0 111.886 169.433 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 74.7 m -124.89 153.43 42.64 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.184 1.394 . . . . 0.0 112.627 -170.05 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 43.1 mt -60.36 -31.65 70.53 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 113.619 0.97 . . . . 0.0 113.619 -173.87 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 91.9 t80 -62.43 -31.63 72.36 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 123.886 0.874 . . . . 0.0 113.243 172.909 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 68.5 mt-30 -75.44 -34.94 61.02 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.754 0.822 . . . . 0.0 110.53 176.014 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 57.9 mt -64.05 -48.17 77.32 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 123.334 0.654 . . . . 0.0 110.938 173.344 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -56.35 -28.87 60.42 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.802 1.241 . . . . 0.0 113.715 176.06 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 27.7 t30 -58.25 -26.97 63.55 Favored 'General case' 0 CA--C 1.546 0.823 0 O-C-N 120.931 -1.105 . . . . 0.0 113.523 178.3 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -97.86 -2.81 39.99 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.284 1.434 . . . . 0.0 113.606 179.614 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 80.3 m -82.83 161.3 22.0 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.456 1.103 . . . . 0.0 113.022 177.698 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 16.5 t-20 . . . . . 0 C--O 1.253 1.257 0 C-N-CA 124.911 1.284 . . . . 0.0 113.453 -175.727 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 36.9 p90 . . . . . 0 N--CA 1.487 1.402 0 N-CA-C 111.914 0.338 . . . . 0.0 111.914 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 49.0 t 71.69 -58.68 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.342 0 C-N-CA 128.463 2.705 . . . . 0.0 113.871 171.431 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 34.6 m120 -78.48 125.46 29.39 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.388 1.475 . . . . 0.0 111.911 -174.71 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -150.79 159.94 44.2 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.281 1.032 . . . . 0.0 112.165 -179.352 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 86.2 m-70 -97.71 136.31 38.25 Favored 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 107.066 -1.457 . . . . 0.0 107.066 165.365 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 87.0 mt -147.2 137.2 23.17 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.505 1.122 . . . . 0.0 110.814 -177.16 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.8 t -152.38 138.76 18.51 Favored 'General case' 0 N--CA 1.47 0.559 0 O-C-N 121.318 -0.864 . . . . 0.0 113.024 -177.901 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 58.32 -128.16 46.91 Favored Glycine 0 N--CA 1.47 0.965 0 C-N-CA 124.35 0.976 . . . . 0.0 113.334 174.303 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.7 m -55.25 -32.54 62.41 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.528 1.131 . . . . 0.0 113.046 176.993 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 25.0 m80 -69.85 -41.41 74.93 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 121.16 -0.962 . . . . 0.0 111.325 177.328 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 64.1 tp -64.89 -45.92 83.91 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.132 0.973 . . . . 0.0 110.782 173.763 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 38.6 t -57.55 -46.31 86.13 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.928 0 C-N-CA 124.717 1.207 . . . . 0.0 111.229 175.494 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -64.84 -42.99 94.48 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.429 0.691 . . . . 0.0 111.811 176.0 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.22 -41.62 98.56 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 121.574 -0.704 . . . . 0.0 112.21 176.766 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -56.66 -46.79 80.86 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.533 0.733 . . . . 0.0 110.963 173.51 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 31.6 m-85 -65.37 -36.51 84.22 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 113.453 0.909 . . . . 0.0 113.453 175.534 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 77.9 mt -71.31 -42.34 68.74 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 118.98 0.809 . . . . 0.0 112.684 177.4 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 54.8 t -72.07 -47.82 52.73 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.726 0 C-N-CA 124.334 1.054 . . . . 0.0 111.292 -177.885 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 81.4 m -93.75 -9.63 36.99 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 114.243 1.201 . . . . 0.0 114.243 -174.734 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 70.82 -154.33 52.12 Favored Glycine 0 CA--C 1.532 1.122 0 C-N-CA 124.998 1.285 . . . . 0.0 112.929 177.387 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -64.03 -9.07 13.92 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.972 1.309 . . . . 0.0 114.335 176.252 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 14.6 ttp180 -61.53 -30.99 70.99 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.668 1.587 . . . . 0.0 113.038 179.195 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 82.09 173.97 49.21 Favored Glycine 0 CA--C 1.53 1.024 0 C-N-CA 125.31 1.433 . . . . 0.0 114.17 174.639 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 23.4 p90 -151.16 155.22 38.43 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.26 1.424 . . . . 0.0 113.42 -176.159 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 74.9 t80 -90.99 -29.85 17.15 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.367 1.067 . . . . 0.0 113.71 -170.924 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 85.3 t80 -70.21 153.32 43.23 Favored 'General case' 0 CA--C 1.546 0.808 0 N-CA-C 114.915 1.45 . . . . 0.0 114.915 -170.266 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 24.3 p -136.02 142.75 41.4 Favored Pre-proline 0 N--CA 1.476 0.829 0 C-N-CA 126.903 2.081 . . . . 0.0 108.784 169.045 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -70.29 124.29 10.73 Favored 'Trans proline' 0 C--N 1.35 0.619 0 C-N-CA 122.78 2.32 . . . . 0.0 111.099 -170.658 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 25.3 mmmt -64.22 -14.56 56.27 Favored 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 -178.198 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 19.4 m -62.92 -33.0 74.41 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 126.503 1.921 . . . . 0.0 111.95 169.953 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 80.8 tttt -122.09 -19.25 6.65 Favored 'General case' 0 CA--C 1.547 0.839 0 N-CA-C 114.514 1.301 . . . . 0.0 114.514 -171.475 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 80.7 mmt-85 . . . . . 0 C--O 1.249 1.053 0 C-N-CA 125.713 1.605 . . . . 0.0 112.346 -178.477 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.67 0 CA-C-O 119.582 -0.565 . . . . 0.0 112.085 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.443 HG22 ' H ' ' B' ' 27' ' ' THR . 9.0 tp -57.24 -34.58 46.11 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.204 0 CA-C-N 119.1 1.45 . . . . 0.0 113.626 -171.301 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 5.0 p -63.74 -26.92 41.79 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 O-C-N 121.088 -1.008 . . . . 0.0 112.982 176.651 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 65.4 tt0 -72.05 -13.61 61.64 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.857 1.263 . . . . 0.0 112.351 175.154 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 31.9 tt0 -104.97 -45.32 4.58 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.223 1.409 . . . . 0.0 110.946 176.269 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 29.7 m -80.95 -25.91 37.03 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 115.502 1.667 . . . . 0.0 115.502 -175.672 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 49.4 t -87.99 -55.25 3.84 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 120.249 1.386 . . . . 0.0 112.6 -173.416 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 25.9 p -77.86 -20.23 53.41 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 125.471 1.508 . . . . 0.0 113.371 -176.574 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.4 t -132.83 -173.36 3.16 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.533 1.533 . . . . 0.0 111.257 171.723 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 71.0 mt -87.5 139.72 16.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 124.785 1.234 . . . . 0.0 110.209 178.241 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.3 p -131.26 153.8 49.14 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 122.081 0.943 . . . . 0.0 112.125 169.424 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 41.5 t -95.24 153.91 17.44 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 125.802 1.641 . . . . 0.0 112.77 -178.695 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 11.1 mp -58.99 -27.85 65.79 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 121.466 -0.771 . . . . 0.0 111.613 169.305 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 74.5 t80 -62.41 -31.72 72.45 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 123.884 0.873 . . . . 0.0 113.093 171.729 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 35.4 mt-30 -77.28 -42.39 37.15 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 123.961 0.905 . . . . 0.0 110.49 174.34 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 80.7 mt -56.71 -52.72 63.85 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 123.764 0.826 . . . . 0.0 111.612 174.565 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -60.54 -34.66 74.45 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 123.841 0.857 . . . . 0.0 112.854 178.428 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -71.38 -32.19 68.18 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 123.688 0.795 . . . . 0.0 112.627 175.483 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -72.8 -43.4 62.8 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.117 0.967 . . . . 0.0 111.811 175.284 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 87.9 m -55.49 136.35 49.94 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 125.695 1.598 . . . . 0.0 112.229 170.92 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 4.4 p30 . . . . . 0 C--O 1.252 1.237 0 C-N-CA 126.945 2.098 . . . . 0.0 112.882 -171.399 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 82.7 m-85 . . . . . 0 N--CA 1.485 1.307 0 N-CA-C 111.125 0.046 . . . . 0.0 111.125 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 57.4 t -66.77 137.59 24.55 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 C-N-CA 123.723 0.809 . . . . 0.0 109.334 171.884 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -158.48 150.48 21.48 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.451 1.101 . . . . 0.0 112.504 -170.64 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -175.85 176.9 1.75 Allowed 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 125.994 1.718 . . . . 0.0 110.703 -178.277 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 53.9 m-70 -77.94 135.72 37.88 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 124.5 1.12 . . . . 0.0 109.672 166.155 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 49.5 mt -141.81 135.82 30.02 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 126.607 1.963 . . . . 0.0 109.779 175.731 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 2.1 t -139.27 145.23 38.91 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 -174.315 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 50.21 -125.02 19.48 Favored Glycine 0 N--CA 1.471 0.976 0 C-N-CA 125.102 1.334 . . . . 0.0 114.277 169.957 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 18.9 m -55.65 -37.24 67.98 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.777 1.231 . . . . 0.0 113.09 178.223 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 70.3 m-70 -74.69 -30.29 61.51 Favored 'General case' 0 CA--C 1.541 0.599 0 O-C-N 120.79 -1.194 . . . . 0.0 112.79 176.99 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 39.2 tp -68.38 -44.68 74.62 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 118.805 0.73 . . . . 0.0 111.296 169.687 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 53.4 t -60.0 -46.21 94.43 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.014 0 C-N-CA 124.023 0.929 . . . . 0.0 110.919 173.993 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -58.61 -47.18 85.21 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 125.038 1.335 . . . . 0.0 111.869 174.33 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.53 -46.39 88.61 Favored 'General case' 0 CA--C 1.532 0.271 0 O-C-N 121.674 -0.641 . . . . 0.0 111.799 176.731 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 28.7 mt -54.84 -45.81 74.54 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 123.837 0.855 . . . . 0.0 111.138 175.788 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 11.0 m-85 -60.61 -51.51 69.11 Favored 'General case' 0 CA--C 1.544 0.722 0 O-C-N 121.041 -1.037 . . . . 0.0 112.819 173.972 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 91.9 mt -68.67 -40.23 80.26 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.133 0.973 . . . . 0.0 113.348 -175.395 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 54.3 t -73.58 -43.98 54.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 124.858 1.263 . . . . 0.0 111.365 -177.209 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 69.3 m -87.93 -27.91 21.84 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 114.705 1.372 . . . . 0.0 114.705 -170.147 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 56.17 -121.56 24.33 Favored Glycine 0 CA--C 1.531 1.045 0 C-N-CA 124.114 0.864 . . . . 0.0 112.799 174.575 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 3.7 pm0 -64.78 -14.62 59.69 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.809 1.643 . . . . 0.0 115.045 -177.064 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 61.1 mtp85 -62.77 -28.43 69.98 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 119.012 0.824 . . . . 0.0 112.655 172.621 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.84 133.05 1.57 Allowed Glycine 0 CA--C 1.53 1.014 0 C-N-CA 125.023 1.297 . . . . 0.0 110.661 -170.59 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -78.17 164.26 25.1 Favored 'General case' 0 CA--C 1.536 0.441 0 O-C-N 122.05 -0.676 . . . . 0.0 112.601 -177.697 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 53.4 t80 -155.75 134.63 11.99 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.398 1.079 . . . . 0.0 110.573 170.706 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 40.6 t80 -135.68 146.37 47.72 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 125.834 1.654 . . . . 0.0 111.849 -175.988 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . 0.443 ' H ' HG22 ' A' ' 2' ' ' ILE . 27.1 p -141.32 139.68 19.43 Favored Pre-proline 0 CA--C 1.544 0.727 0 C-N-CA 126.108 1.763 . . . . 0.0 110.43 175.721 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -84.7 -177.43 2.87 Favored 'Trans proline' 0 CA--C 1.539 0.759 0 C-N-CA 124.01 3.14 . . . . 0.0 112.55 -174.744 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 33.0 ttpt -78.68 37.54 0.29 Allowed 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 126.437 1.895 . . . . 0.0 112.921 174.855 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 6.2 m 66.06 51.81 1.27 Allowed 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 127.061 2.145 . . . . 0.0 110.137 -176.951 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt -65.64 -26.94 68.03 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 124.63 1.172 . . . . 0.0 113.372 -177.614 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 80.6 ttt180 . . . . . 0 C--O 1.25 1.086 0 C-N-CA 127.002 2.121 . . . . 0.0 110.971 -178.732 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.649 0 N-CA-C 111.545 -0.622 . . . . 0.0 111.545 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 9.0 tp -54.11 -36.54 32.39 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.283 0 N-CA-C 114.971 1.471 . . . . 0.0 114.971 -169.437 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 6.3 p -64.96 -24.72 36.1 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 O-C-N 121.342 -0.849 . . . . 0.0 112.985 178.855 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -75.93 0.28 18.92 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 124.067 0.947 . . . . 0.0 112.319 175.466 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 31.9 tt0 -124.46 -48.21 1.83 Allowed 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.221 1.408 . . . . 0.0 111.216 174.992 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 17.1 m -71.02 -27.39 63.64 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 114.736 1.384 . . . . 0.0 114.736 179.735 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 12.3 t -83.79 -42.07 16.88 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 119.492 1.042 . . . . 0.0 111.449 179.295 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 19.7 p -76.8 -33.94 57.97 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 126.955 2.102 . . . . 0.0 112.911 -177.159 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 73.8 m -134.27 170.8 15.16 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.468 1.507 . . . . 0.0 111.885 179.827 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 58.7 mt -68.47 136.12 27.08 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 O-C-N 120.8 -1.188 . . . . 0.0 110.13 170.833 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.0 p -133.07 162.98 30.28 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.462 1.105 . . . . 0.0 112.975 175.167 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 6.2 t -128.76 172.7 11.01 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 125.479 1.511 . . . . 0.0 112.566 -175.983 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.479 HD22 ' H ' ' A' ' 13' ' ' LEU . 1.9 mm? -59.03 -31.65 69.03 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.133 1.373 . . . . 0.0 113.1 -169.855 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 87.9 t80 -63.5 -33.5 75.71 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 123.608 0.763 . . . . 0.0 113.008 175.951 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 38.0 mt-30 -76.55 -33.7 58.54 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 124.295 1.038 . . . . 0.0 110.683 176.616 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 80.8 mt -68.31 -52.81 29.39 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.871 0.868 . . . . 0.0 111.387 174.038 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -63.95 -21.47 66.5 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 113.56 0.948 . . . . 0.0 113.56 -179.026 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.3 t30 -68.69 -33.32 73.76 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 123.877 0.871 . . . . 0.0 112.618 174.876 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 9.1 m-85 -88.52 -14.34 37.99 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 114.302 1.223 . . . . 0.0 114.302 -179.086 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 91.7 m -71.53 160.34 32.88 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.692 0.797 . . . . 0.0 112.936 170.988 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 7.1 p-10 . . . . . 0 C--O 1.254 1.299 0 C-N-CA 126.895 2.078 . . . . 0.0 113.356 179.675 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 67.5 m-85 . . . . . 0 N--CA 1.484 1.261 0 CA-C-O 117.898 -1.048 . . . . 0.0 108.743 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 80.2 t -68.62 -36.37 74.25 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.38 0 CA-C-N 120.861 1.664 . . . . 0.0 109.475 168.625 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 51.7 p-10 -65.48 149.02 50.74 Favored 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 125.458 1.503 . . . . 0.0 112.291 168.515 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -162.14 165.3 27.24 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.13 0.972 . . . . 0.0 111.253 -171.441 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 34.0 m-70 -74.86 143.29 43.93 Favored 'General case' 0 CA--C 1.55 0.979 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 164.412 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 40.6 mt -142.97 137.73 29.58 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 125.773 1.629 . . . . 0.0 109.208 174.722 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 3.4 t -145.62 148.76 33.45 Favored 'General case' 0 N--CA 1.47 0.574 0 O-C-N 121.367 -0.833 . . . . 0.0 112.581 -176.2 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 52.89 -128.91 38.03 Favored Glycine 0 N--CA 1.473 1.133 0 C-N-CA 125.08 1.324 . . . . 0.0 114.018 172.141 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 26.7 m -56.87 -38.17 72.36 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.182 0.993 . . . . 0.0 113.03 -178.717 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 69.7 m-70 -73.13 -30.19 63.43 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 119.308 0.958 . . . . 0.0 112.839 177.529 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 51.1 tp -68.5 -45.77 71.42 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 118.881 0.764 . . . . 0.0 111.119 170.85 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 73.8 t -63.94 -42.3 95.33 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 CA-C-N 118.489 0.586 . . . . 0.0 111.351 176.435 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -56.3 -49.54 74.0 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.991 1.317 . . . . 0.0 111.502 171.018 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.38 -43.77 98.3 Favored 'General case' 0 CA--C 1.536 0.423 0 O-C-N 121.547 -0.721 . . . . 0.0 111.448 177.48 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 21.3 mt -58.24 -44.32 88.22 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 123.626 0.771 . . . . 0.0 111.535 176.516 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 14.8 m-85 -63.03 -45.36 92.65 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 119.107 0.867 . . . . 0.0 112.755 174.116 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 9.0 mp -72.75 -41.17 65.41 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 123.799 0.839 . . . . 0.0 113.063 -176.512 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 55.5 t -70.5 -43.48 77.9 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 C-N-CA 124.644 1.178 . . . . 0.0 110.934 -177.741 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 68.7 m -79.82 -15.95 56.42 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 113.412 0.893 . . . . 0.0 113.412 -178.565 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 59.12 -120.72 23.94 Favored Glycine 0 N--CA 1.469 0.884 0 C-N-CA 125.09 1.328 . . . . 0.0 113.427 168.842 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -59.93 -24.07 64.05 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.409 1.484 . . . . 0.0 113.418 -178.332 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 79.9 mtp180 -63.83 -30.36 71.46 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.084 0.954 . . . . 0.0 112.276 173.331 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.22 -155.19 51.38 Favored Glycine 0 CA--C 1.534 1.257 0 C-N-CA 124.461 1.029 . . . . 0.0 111.495 -168.904 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 58.3 t80 -149.36 148.01 29.0 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.431 1.492 . . . . 0.0 109.969 174.923 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 46.6 t80 -159.06 64.69 0.41 Allowed 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 124.234 1.014 . . . . 0.0 111.631 -169.28 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 67.7 t80 -156.97 155.92 32.12 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.713 1.605 . . . . 0.0 111.116 176.336 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 22.9 p -118.96 99.88 50.92 Favored Pre-proline 0 N--CA 1.475 0.785 0 C-N-CA 125.428 1.491 . . . . 0.0 110.557 -179.825 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -63.61 170.44 8.37 Favored 'Trans proline' 0 CA--C 1.539 0.768 0 C-N-CA 123.528 2.819 . . . . 0.0 113.441 173.842 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -59.3 -26.5 65.04 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 114.172 1.175 . . . . 0.0 114.172 -178.384 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 2.4 t -114.21 103.22 10.88 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 126.298 1.839 . . . . 0.0 108.077 169.774 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 28.2 tptp -74.1 124.63 26.66 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 125.479 1.512 . . . . 0.0 112.35 -175.133 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.12 0 C-N-CA 125.619 1.568 . . . . 0.0 112.018 169.983 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.193 0 N-CA-C 110.842 -0.903 . . . . 0.0 110.842 . . . . . . . . . 0 0 . 1 . 031 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 6.3 tp 169.75 -41.62 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.379 0 C-N-CA 130.812 3.645 . . . . 0.0 110.116 171.992 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 7.2 p -61.09 -32.41 52.64 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 O-C-N 121.408 -0.808 . . . . 0.0 112.335 179.46 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.7 pm0 -73.15 -18.98 61.22 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.371 1.068 . . . . 0.0 113.505 175.421 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 25.5 tp60 -88.74 -44.05 10.83 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.226 1.01 . . . . 0.0 110.3 172.445 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 21.4 m -78.82 -32.1 46.11 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 115.254 1.575 . . . . 0.0 115.254 -177.37 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 42.6 t -93.16 -59.24 2.08 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-N 119.825 1.193 . . . . 0.0 112.12 -175.487 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 19.2 m -67.84 -44.58 76.87 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.746 1.218 . . . . 0.0 110.62 -176.525 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.3 t -103.04 -163.16 0.97 Allowed 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.623 1.169 . . . . 0.0 110.832 169.119 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 82.0 mt -109.21 138.91 34.25 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 125.835 1.654 . . . . 0.0 109.471 -179.001 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 10.2 p -129.87 170.54 13.77 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.779 0.832 . . . . 0.0 113.149 173.565 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 81.9 p -120.22 167.13 12.58 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 125.962 1.705 . . . . 0.0 112.562 -175.43 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 51.0 mt -62.16 -30.94 71.4 Favored 'General case' 0 CA--C 1.539 0.554 0 O-C-N 121.751 -0.593 . . . . 0.0 111.954 173.989 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 89.7 t80 -64.81 -36.72 85.25 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 121.416 -0.802 . . . . 0.0 112.739 171.891 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -70.82 -26.16 63.18 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 118.632 -0.699 . . . . 0.0 111.815 173.011 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 74.4 mt -73.95 -43.62 57.62 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 119.423 1.01 . . . . 0.0 112.182 169.728 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -55.51 -34.87 65.02 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 123.575 0.75 . . . . 0.0 112.777 175.11 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 15.1 t30 -58.81 -27.77 65.38 Favored 'General case' 0 CA--C 1.55 0.969 0 N-CA-C 113.679 0.992 . . . . 0.0 113.679 176.551 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 49.9 m-85 -98.3 0.44 45.59 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 125.482 1.513 . . . . 0.0 113.751 179.339 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 37.9 t -75.37 167.74 21.32 Favored 'General case' 0 CA--C 1.544 0.745 0 O-C-N 120.846 -1.159 . . . . 0.0 112.116 169.917 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 25.9 m120 . . . . . 0 C--O 1.251 1.177 0 C-N-CA 126.356 1.862 . . . . 0.0 112.094 177.643 . . . . . . . . 0 0 . 1 . 031 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 33.9 t80 . . . . . 0 N--CA 1.487 1.399 0 CA-C-O 117.985 -1.007 . . . . 0.0 110.106 . . . . . . . . . 0 0 . 1 . 031 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 4.8 p -173.75 102.84 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 C-N-CA 126.601 1.96 . . . . 0.0 107.793 178.13 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 10.4 m120 -144.8 135.77 24.88 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.623 1.169 . . . . 0.0 111.292 -167.156 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 2.8 mm-40 -161.48 170.04 20.69 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.842 1.257 . . . . 0.0 112.542 -177.27 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 86.5 m-70 -86.04 135.02 33.8 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.327 1.051 . . . . 0.0 109.647 167.62 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 82.5 mt -139.85 119.38 13.1 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 125.892 1.677 . . . . 0.0 109.926 178.576 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 72.1 m -123.29 130.63 53.0 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 124.911 1.284 . . . . 0.0 112.243 -174.352 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 56.31 -120.65 20.74 Favored Glycine 0 N--CA 1.472 1.072 0 C-N-CA 124.729 1.156 . . . . 0.0 113.733 169.344 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 22.2 m -54.24 -33.24 57.98 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 124.562 1.145 . . . . 0.0 112.912 177.459 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 34.7 m80 -71.24 -41.11 70.54 Favored 'General case' 0 CA--C 1.539 0.551 0 O-C-N 120.895 -1.128 . . . . 0.0 111.34 178.07 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 60.4 tp -63.79 -45.27 90.44 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 123.637 0.775 . . . . 0.0 111.024 172.648 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 31.8 t -60.33 -46.12 95.43 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 C-N-CA 124.33 1.052 . . . . 0.0 110.77 177.808 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -63.87 -45.92 87.27 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 123.198 0.599 . . . . 0.0 111.767 176.409 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.27 -42.18 96.58 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 118.638 0.654 . . . . 0.0 111.897 179.235 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 27.1 tp -66.14 -37.75 86.46 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.075 0.95 . . . . 0.0 111.292 178.825 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 11.8 m-85 -64.67 -42.97 94.99 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 119.248 0.931 . . . . 0.0 112.448 169.109 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 70.2 mt -63.88 -39.09 93.38 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 119.08 0.855 . . . . 0.0 112.226 177.872 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 39.3 t -68.59 -45.55 81.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 124.052 0.941 . . . . 0.0 112.212 174.353 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 16.8 t -84.96 -23.21 28.85 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 114.238 1.199 . . . . 0.0 114.238 -171.915 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 77.38 -157.59 46.44 Favored Glycine 0 CA--C 1.533 1.165 0 C-N-CA 124.857 1.217 . . . . 0.0 112.372 -174.845 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -69.36 -10.86 59.83 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.034 1.334 . . . . 0.0 114.44 -175.083 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 71.1 mtm-85 -67.7 -25.56 65.74 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.698 1.199 . . . . 0.0 113.883 -175.975 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.17 155.18 12.36 Favored Glycine 0 CA--C 1.533 1.204 0 C-N-CA 124.856 1.217 . . . . 0.0 112.74 -175.02 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 22.2 p90 -115.15 170.89 8.03 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.64 1.576 . . . . 0.0 112.619 -177.591 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 45.2 p90 -108.74 152.06 25.36 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.705 1.202 . . . . 0.0 110.003 167.41 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 49.9 t80 -156.98 144.94 19.28 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 123.563 0.745 . . . . 0.0 112.742 -169.59 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 53.8 m -141.1 134.32 14.55 Favored Pre-proline 0 N--CA 1.473 0.707 0 C-N-CA 126.268 1.827 . . . . 0.0 108.361 173.755 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_endo -76.0 -170.48 0.86 Allowed 'Trans proline' 0 CA--C 1.542 0.91 0 C-N-CA 123.261 2.641 . . . . 0.0 111.896 178.339 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 28.4 ttpp -56.11 -34.26 65.89 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 114.489 1.292 . . . . 0.0 114.489 -175.336 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 9.6 t -162.44 -137.56 0.04 OUTLIER 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 126.726 2.01 . . . . 0.0 108.696 -173.461 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 65.1 pttt -68.6 -15.27 63.47 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.759 1.624 . . . . 0.0 114.358 177.206 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 . . . . . 0 C--O 1.251 1.173 0 C-N-CA 128.686 2.795 . . . . 0.0 110.525 177.159 . . . . . . . . 0 0 . 1 . 032 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.678 0 N-CA-C 111.988 -0.445 . . . . 0.0 111.988 . . . . . . . . . 0 0 . 1 . 032 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 19.5 tt -87.72 -31.04 5.7 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 N-CA-C 114.498 1.296 . . . . 0.0 114.498 -177.924 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 58.0 t -67.68 -39.45 82.17 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.099 0 C-N-CA 123.712 0.805 . . . . 0.0 111.977 -168.16 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.7 pm0 -75.24 -35.49 61.42 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.436 1.094 . . . . 0.0 111.928 171.464 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 11.0 tp60 -74.26 -43.72 55.78 Favored 'General case' 0 CA--C 1.537 0.471 0 O-C-N 121.363 -0.835 . . . . 0.0 111.962 -172.396 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 33.3 m -65.58 -21.08 66.56 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 123.706 0.802 . . . . 0.0 113.072 172.947 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 48.7 t -91.49 -45.75 8.36 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 118.701 0.682 . . . . 0.0 112.09 -178.622 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 49.2 p -76.33 -20.59 57.11 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 125.234 1.413 . . . . 0.0 113.838 179.932 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 7.8 t -143.63 -167.82 2.68 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.733 1.213 . . . . 0.0 110.991 173.653 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 70.3 mt -93.55 132.23 38.29 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 C-N-CA 124.689 1.196 . . . . 0.0 109.052 172.953 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 27.0 p -114.46 164.74 13.55 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.364 1.066 . . . . 0.0 113.305 178.238 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 36.8 t -94.69 152.52 18.41 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 124.802 1.241 . . . . 0.0 112.813 -175.855 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 48.7 mt -60.82 -30.64 70.21 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 121.457 -0.777 . . . . 0.0 111.84 173.724 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 90.9 t80 -60.84 -36.81 80.08 Favored 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 171.788 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 64.6 mt-30 -70.32 -44.56 67.98 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.322 0.649 . . . . 0.0 110.061 176.886 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 98.6 mt -57.77 -42.98 85.2 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.7 0.8 . . . . 0.0 111.958 176.667 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -72.12 -35.09 69.04 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 113.981 1.104 . . . . 0.0 113.981 175.276 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -72.66 -34.77 67.45 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 119.104 0.865 . . . . 0.0 112.958 -177.628 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 27.5 m-85 -80.75 -5.83 57.66 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 113.741 1.015 . . . . 0.0 113.741 173.868 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 8.3 t -76.8 173.32 11.82 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 123.961 0.905 . . . . 0.0 112.785 172.401 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 . . . . . 0 C--O 1.253 1.268 0 C-N-CA 125.363 1.465 . . . . 0.0 114.022 -175.403 . . . . . . . . 0 0 . 1 . 032 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 54.9 p90 . . . . . 0 N--CA 1.483 1.193 0 N-CA-C 111.232 0.086 . . . . 0.0 111.232 . . . . . . . . . 0 0 . 1 . 032 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 17.5 m -71.28 145.97 12.12 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.33 0 C-N-CA 123.909 0.884 . . . . 0.0 112.334 -177.308 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 58.91 70.71 0.63 Allowed 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 125.546 1.538 . . . . 0.0 110.98 178.803 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -141.96 166.12 25.59 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 126.869 2.068 . . . . 0.0 110.228 -168.713 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 24.3 m-70 -68.08 131.87 46.21 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 165.008 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 74.9 mt -140.24 115.75 10.06 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 126.224 1.81 . . . . 0.0 109.072 -173.615 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 78.2 m -121.57 143.82 49.08 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.084 1.353 . . . . 0.0 111.544 -178.649 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 48.62 -124.12 11.46 Favored Glycine 0 N--CA 1.473 1.118 0 C-N-CA 125.298 1.428 . . . . 0.0 114.529 169.338 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 18.7 m -53.6 -39.89 65.26 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.444 1.098 . . . . 0.0 113.338 178.559 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 18.6 t60 -72.4 -31.23 65.35 Favored 'General case' 0 CA--C 1.543 0.677 0 O-C-N 120.971 -1.08 . . . . 0.0 112.058 179.655 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 50.3 tp -67.17 -42.87 83.53 Favored 'General case' 0 C--O 1.224 -0.253 0 O-C-N 121.503 -0.748 . . . . 0.0 110.924 168.885 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 77.2 t -60.81 -43.45 95.45 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 CA-C-N 119.029 0.831 . . . . 0.0 111.241 175.983 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 67.2 mt-10 -54.75 -50.91 67.24 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 118.927 0.785 . . . . 0.0 111.087 171.166 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.02 -44.4 92.68 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.681 0.792 . . . . 0.0 112.11 -177.821 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 33.1 mt -56.22 -48.01 77.32 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 124.169 0.988 . . . . 0.0 110.892 176.338 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 14.2 m-85 -65.41 -43.77 89.53 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 119.074 0.852 . . . . 0.0 112.851 177.201 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 76.9 mt -66.85 -42.93 84.87 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 123.608 0.763 . . . . 0.0 112.552 -179.87 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 71.0 t -77.14 -36.65 24.86 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 C-N-CA 124.557 1.143 . . . . 0.0 111.602 -176.741 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 49.8 t -77.57 -31.48 53.17 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 113.875 1.065 . . . . 0.0 113.875 178.017 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 76.95 -140.37 24.78 Favored Glycine 0 CA--C 1.531 1.054 0 C-N-CA 124.072 0.844 . . . . 0.0 112.886 178.041 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 3.6 pm0 -66.46 -16.67 64.29 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 115.416 1.635 . . . . 0.0 115.416 -169.499 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 49.2 mtm180 -62.74 -37.24 85.82 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 118.785 0.721 . . . . 0.0 112.106 174.957 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.62 139.15 1.51 Allowed Glycine 0 CA--C 1.531 1.07 0 C-N-CA 125.809 1.671 . . . . 0.0 113.147 179.139 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 50.1 t80 -71.48 156.86 38.96 Favored 'General case' 0 CA--C 1.545 0.762 0 O-C-N 122.066 -0.667 . . . . 0.0 112.494 177.701 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 89.7 t80 -156.42 -32.29 0.09 Allowed 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 114.723 1.379 . . . . 0.0 114.723 -168.882 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 79.1 t80 -60.78 131.53 50.99 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.281 1.033 . . . . 0.0 113.285 -176.102 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 39.7 p -74.74 145.92 82.38 Favored Pre-proline 0 N--CA 1.477 0.899 0 O-C-N 121.27 -0.894 . . . . 0.0 111.697 -176.807 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -73.32 137.84 26.47 Favored 'Trans proline' 0 N--CA 1.456 -0.706 0 C-N-CA 122.955 2.437 . . . . 0.0 111.332 -178.537 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 45.3 mmtm -105.24 -20.6 13.45 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 113.628 0.973 . . . . 0.0 113.628 -177.69 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 17.0 m -69.06 -39.16 79.3 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 125.778 1.631 . . . . 0.0 111.476 178.248 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 64.9 tttm -154.11 135.83 14.43 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.789 1.635 . . . . 0.0 110.506 176.152 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.184 0 C-N-CA 127.975 2.51 . . . . 0.0 111.967 -177.503 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.294 0 CA-C-O 118.834 -0.981 . . . . 0.0 111.039 . . . . . . . . . 0 0 . 1 . 033 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 7.1 tp 164.47 -39.1 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.45 0 C-N-CA 130.791 3.636 . . . . 0.0 110.399 172.747 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 48.4 t -59.21 -35.91 60.29 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 C-N-CA 124.188 0.995 . . . . 0.0 110.957 178.437 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 13.0 pm0 -69.67 -9.28 53.66 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.79 1.236 . . . . 0.0 114.047 177.207 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 25.7 tt0 -99.68 -66.41 0.91 Allowed 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.17 0.988 . . . . 0.0 109.152 169.505 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 50.8 m -71.99 -26.53 62.27 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 115.464 1.654 . . . . 0.0 115.464 -168.928 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 13.4 t -85.43 -44.54 12.66 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 119.304 0.956 . . . . 0.0 110.992 176.924 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 27.3 m -65.63 -40.13 92.21 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 126.086 1.754 . . . . 0.0 111.893 -179.743 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 67.3 m -138.25 172.25 13.19 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.232 1.413 . . . . 0.0 112.0 -174.866 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 43.4 mt -64.98 136.17 27.1 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 O-C-N 120.748 -1.22 . . . . 0.0 110.179 170.666 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 9.6 p -134.51 176.72 8.37 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.235 1.414 . . . . 0.0 111.673 170.793 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 22.9 t -138.03 161.78 35.83 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.556 1.143 . . . . 0.0 112.708 -179.936 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.499 HD22 ' H ' ' A' ' 13' ' ' LEU . 1.2 mm? -61.18 -28.88 69.45 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.927 1.291 . . . . 0.0 111.783 -179.932 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 79.9 t80 -63.27 -24.25 67.78 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.68 1.192 . . . . 0.0 113.439 172.954 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 62.8 mt-30 -85.1 -37.43 20.28 Favored 'General case' 0 N--CA 1.469 0.517 0 O-C-N 121.549 -0.719 . . . . 0.0 110.638 171.884 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 27.5 mt -60.97 -33.33 73.04 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 118.965 0.802 . . . . 0.0 113.001 175.532 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.7 mm-40 -50.93 -30.97 16.23 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 124.637 1.175 . . . . 0.0 113.714 169.175 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 -73.93 -19.86 60.55 Favored 'General case' 0 CA--C 1.546 0.82 0 O-C-N 121.09 -1.006 . . . . 0.0 113.101 177.037 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 79.9 m-85 -93.35 -7.19 45.45 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.593 1.557 . . . . 0.0 113.191 176.944 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 33.1 m -74.16 136.44 42.87 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.477 1.111 . . . . 0.0 109.236 167.598 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 9.3 p30 . . . . . 0 C--O 1.253 1.268 0 CA-C-O 118.026 -0.988 . . . . 0.0 113.364 179.293 . . . . . . . . 0 0 . 1 . 033 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 63.7 m-85 . . . . . 0 N--CA 1.488 1.464 0 CA-C-O 119.051 -0.5 . . . . 0.0 110.299 . . . . . . . . . 0 0 . 1 . 033 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 27.6 m -61.02 -34.71 61.07 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.367 0 CA-C-N 119.97 1.259 . . . . 0.0 112.616 179.227 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 24.6 m120 -83.87 120.42 26.05 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.429 1.091 . . . . 0.0 109.737 168.93 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 5.4 tt0 -166.76 163.47 16.52 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 124.172 0.989 . . . . 0.0 111.646 -177.014 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 26.4 m-70 -77.48 142.5 39.11 Favored 'General case' 0 CA--C 1.548 0.87 0 N-CA-C 107.631 -1.248 . . . . 0.0 107.631 163.932 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 58.5 mt -139.72 132.53 29.15 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 125.719 1.607 . . . . 0.0 108.557 175.251 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.6 t -144.04 149.33 36.5 Favored 'General case' 0 N--CA 1.47 0.569 0 O-C-N 121.439 -0.788 . . . . 0.0 112.391 -175.054 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.32 -128.01 43.19 Favored Glycine 0 N--CA 1.469 0.855 0 C-N-CA 124.702 1.144 . . . . 0.0 113.515 172.611 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 27.2 p -53.41 -44.99 69.17 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.437 1.095 . . . . 0.0 112.923 177.363 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 12.8 m-70 -67.38 -31.27 71.39 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 120.941 -1.099 . . . . 0.0 113.352 179.255 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 40.6 tp -70.53 -44.34 67.73 Favored 'General case' 0 N--CA 1.466 0.343 0 O-C-N 121.616 -0.677 . . . . 0.0 110.892 171.517 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 54.0 t -59.02 -43.04 88.03 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 C-N-CA 123.585 0.754 . . . . 0.0 111.168 173.692 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -59.43 -44.5 92.9 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 123.864 0.866 . . . . 0.0 111.819 172.229 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.53 -42.44 99.52 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-N 119.062 0.846 . . . . 0.0 111.982 176.467 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -58.48 -46.04 87.45 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 118.79 0.723 . . . . 0.0 111.599 173.162 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 9.5 m-85 -59.12 -46.09 89.23 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 119.024 0.829 . . . . 0.0 112.339 174.28 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 67.8 mt -68.13 -39.64 82.66 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.196 0.998 . . . . 0.0 112.495 -178.229 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 71.9 t -72.23 -53.49 19.54 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 C-N-CA 123.629 0.772 . . . . 0.0 111.213 177.249 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 65.5 m -79.64 -31.69 41.55 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 113.579 0.955 . . . . 0.0 113.579 -170.729 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.5 -133.97 41.76 Favored Glycine 0 CA--C 1.528 0.871 0 C-N-CA 124.094 0.854 . . . . 0.0 111.815 178.09 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -65.32 -14.57 61.09 Favored 'General case' 0 CA--C 1.543 0.673 0 N-CA-C 114.633 1.346 . . . . 0.0 114.633 -179.632 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 88.0 mtm180 -66.43 -40.03 89.25 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 118.775 0.716 . . . . 0.0 112.216 177.981 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.93 170.74 45.0 Favored Glycine 0 CA--C 1.536 1.377 0 C-N-CA 124.225 0.917 . . . . 0.0 112.67 -168.795 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 54.6 p90 -148.03 166.49 27.6 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 114.835 1.42 . . . . 0.0 114.835 -169.272 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -99.65 141.78 32.0 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.495 1.518 . . . . 0.0 110.418 168.49 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 34.7 t80 -158.24 129.54 6.55 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.049 1.34 . . . . 0.0 111.47 177.893 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 29.5 p -149.22 154.51 39.11 Favored Pre-proline 0 N--CA 1.476 0.863 0 C-N-CA 126.403 1.881 . . . . 0.0 110.613 170.556 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_endo -72.05 176.63 8.16 Favored 'Trans proline' 0 C--N 1.354 0.839 0 C-N-CA 124.272 3.315 . . . . 0.0 112.434 178.154 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 77.8 mttt -58.74 -40.17 83.06 Favored 'General case' 0 CA--C 1.544 0.739 0 N-CA-C 114.43 1.27 . . . . 0.0 114.43 -169.6 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 41.8 m -144.58 -80.42 0.18 Allowed 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 125.62 1.568 . . . . 0.0 110.438 -174.613 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 39.7 ttpt -85.64 128.94 34.92 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.12 0.968 . . . . 0.0 111.989 -176.023 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 51.0 tpt85 . . . . . 0 C--O 1.252 1.211 0 C-N-CA 125.69 1.596 . . . . 0.0 112.85 175.966 . . . . . . . . 0 0 . 1 . 034 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.799 0 N-CA-C 110.911 -0.876 . . . . 0.0 110.911 . . . . . . . . . 0 0 . 1 . 034 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 12.1 tt -64.0 -26.25 40.07 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.088 0 N-CA-C 115.676 1.732 . . . . 0.0 115.676 -169.065 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 2.7 p -64.46 -29.86 48.56 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.193 0 CA-C-N 120.187 1.358 . . . . 0.0 112.735 175.396 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -73.8 -36.4 64.99 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 118.501 0.591 . . . . 0.0 111.394 173.08 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 32.1 tt0 -76.94 -57.96 3.55 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 124.75 1.22 . . . . 0.0 111.952 -174.988 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 21.0 m -67.14 -21.5 65.82 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 113.892 1.071 . . . . 0.0 113.892 -177.27 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 8.1 t -87.82 -30.15 20.43 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.804 0.841 . . . . 0.0 112.702 179.949 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 28.9 m -88.47 -46.49 9.08 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 125.095 1.358 . . . . 0.0 110.949 177.359 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 49.1 m -113.39 167.66 10.38 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 125.714 1.606 . . . . 0.0 111.473 -176.482 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 62.9 mt -75.08 137.17 23.53 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 O-C-N 120.96 -1.088 . . . . 0.0 108.705 170.429 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.4 p -132.87 173.34 11.49 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.61 1.164 . . . . 0.0 112.816 178.01 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 23.2 t -131.88 166.29 21.94 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 125.313 1.445 . . . . 0.0 112.459 -175.67 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 60.0 mt -57.64 -29.16 64.34 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.781 1.233 . . . . 0.0 112.455 177.94 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 86.9 t80 -61.03 -31.31 70.95 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 124.387 1.075 . . . . 0.0 113.317 173.584 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 33.4 mt-30 -79.19 -33.3 44.02 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 123.731 0.812 . . . . 0.0 110.856 175.309 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 88.2 mt -63.61 -42.72 98.2 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 118.779 0.718 . . . . 0.0 111.553 171.728 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -56.38 -34.81 67.05 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.676 0.79 . . . . 0.0 113.027 174.698 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 17.3 t30 -64.14 -26.63 68.62 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 113.109 0.781 . . . . 0.0 113.109 179.76 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 54.7 m-85 -98.37 1.67 47.2 Favored 'General case' 0 CA--C 1.551 1.007 0 C-N-CA 125.363 1.465 . . . . 0.0 113.826 179.475 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 46.4 t -84.53 174.11 10.28 Favored 'General case' 0 CA--C 1.55 0.942 0 C-N-CA 124.886 1.274 . . . . 0.0 111.223 168.151 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 8.3 p30 . . . . . 0 C--O 1.253 1.251 0 C-N-CA 125.177 1.391 . . . . 0.0 112.042 170.535 . . . . . . . . 0 0 . 1 . 034 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 15.2 t80 . . . . . 0 N--CA 1.488 1.439 0 CA-C-O 118.912 -0.566 . . . . 0.0 110.03 . . . . . . . . . 0 0 . 1 . 034 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 30.2 m -65.06 -22.44 31.39 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.341 0 CA-C-N 120.621 1.555 . . . . 0.0 114.433 -174.431 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 23.0 m120 -78.75 118.76 21.13 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.589 1.155 . . . . 0.0 111.545 176.773 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 16.7 tt0 -162.81 164.68 26.05 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.804 1.242 . . . . 0.0 111.096 -179.808 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 97.5 m-70 -79.02 146.62 33.23 Favored 'General case' 0 CA--C 1.544 0.726 0 O-C-N 120.782 -1.199 . . . . 0.0 110.058 167.9 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 83.5 mt -141.24 133.43 27.96 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 125.039 1.335 . . . . 0.0 110.075 175.525 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 5.0 t -153.47 143.26 21.95 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 121.526 -0.734 . . . . 0.0 112.211 -177.319 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 60.36 -133.38 50.37 Favored Glycine 0 CA--C 1.531 1.069 0 C-N-CA 124.377 0.989 . . . . 0.0 112.981 177.375 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.0 m -54.84 -32.76 60.92 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 124.676 1.19 . . . . 0.0 113.16 178.473 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 20.1 m80 -67.71 -43.82 79.15 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.225 -0.922 . . . . 0.0 111.182 177.874 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 59.2 tp -65.1 -44.37 89.04 Favored 'General case' 0 C--N 1.342 0.262 0 C-N-CA 123.587 0.755 . . . . 0.0 111.244 174.072 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 41.0 t -60.45 -45.56 96.64 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 124.173 0.989 . . . . 0.0 110.925 178.431 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -62.98 -47.33 83.63 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 123.469 0.708 . . . . 0.0 111.597 175.65 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.8 -41.9 97.81 Favored 'General case' 0 CA--C 1.542 0.649 0 O-C-N 121.391 -0.818 . . . . 0.0 112.326 179.439 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 30.8 tp -66.76 -37.61 84.96 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.176 0.99 . . . . 0.0 111.086 178.776 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 11.6 m-85 -65.91 -40.93 91.94 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 119.395 0.998 . . . . 0.0 112.45 169.523 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 65.1 mt -64.13 -41.14 97.33 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 119.178 0.899 . . . . 0.0 112.155 176.891 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 41.2 t -70.34 -44.14 77.75 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.954 0 C-N-CA 123.4 0.68 . . . . 0.0 112.468 175.31 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 9.5 t -80.52 -18.29 48.96 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 113.757 1.021 . . . . 0.0 113.757 -175.81 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 71.8 -149.65 45.08 Favored Glycine 0 CA--C 1.527 0.838 0 C-N-CA 125.495 1.521 . . . . 0.0 112.897 174.506 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -62.96 -22.04 66.52 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.21 1.404 . . . . 0.0 113.182 -175.993 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 88.3 mtm-85 -64.46 -33.66 76.39 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.021 0.929 . . . . 0.0 113.126 -179.553 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.29 141.47 0.87 Allowed Glycine 0 CA--C 1.531 1.065 0 C-N-CA 125.323 1.44 . . . . 0.0 112.071 -172.524 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 32.8 p90 -76.06 153.0 36.71 Favored 'General case' 0 CA--C 1.542 0.67 0 O-C-N 121.636 -0.92 . . . . 0.0 113.199 -178.11 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 78.3 t80 -84.97 -24.7 28.19 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.073 1.349 . . . . 0.0 112.641 -179.012 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 52.0 t80 -63.22 158.33 20.35 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 126.42 1.888 . . . . 0.0 115.085 -177.128 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 17.7 p -137.88 132.52 17.25 Favored Pre-proline 0 N--CA 1.471 0.615 0 C-N-CA 126.274 1.83 . . . . 0.0 108.765 168.315 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -79.57 162.33 24.71 Favored 'Trans proline' 0 N--CA 1.46 -0.483 0 C-N-CA 122.936 2.424 . . . . 0.0 111.948 -177.057 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 59.5 mtpt -57.21 -19.44 20.98 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 124.872 1.269 . . . . 0.0 114.41 179.956 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 67.7 p -80.27 -16.37 54.84 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 125.903 1.681 . . . . 0.0 113.297 177.251 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 44.1 mmtm -114.13 -25.99 8.26 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.914 1.285 . . . . 0.0 113.625 -179.393 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 72.0 mtp85 . . . . . 0 C--O 1.251 1.179 0 C-N-CA 125.277 1.431 . . . . 0.0 112.824 175.882 . . . . . . . . 0 0 . 1 . 035 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.681 0 N-CA-C 111.83 -0.508 . . . . 0.0 111.83 . . . . . . . . . 0 0 . 1 . 035 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.409 ' HB ' ' CD2' ' A' ' 19' ' ' TYR . 7.7 tp -73.57 -30.2 28.98 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 N-CA-C 114.716 1.376 . . . . 0.0 114.716 -169.415 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 11.0 p -58.81 -57.1 12.65 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 N-CA-C 112.878 0.696 . . . . 0.0 112.878 -168.44 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 67.0 mt-10 -73.33 -30.23 63.2 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 119.854 1.206 . . . . 0.0 112.205 177.013 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 26.5 tt0 -62.59 -32.62 73.65 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.957 0.903 . . . . 0.0 112.114 -178.934 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 62.0 m -94.61 -27.05 16.11 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 114.505 1.298 . . . . 0.0 114.505 170.701 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 60.8 m -72.37 -64.81 0.87 Allowed 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 120.229 1.377 . . . . 0.0 112.181 178.99 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 40.4 p -87.8 -15.29 37.31 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.131 0.972 . . . . 0.0 113.538 -171.523 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 68.6 m -122.03 167.78 12.71 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.967 1.307 . . . . 0.0 111.72 171.86 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 72.3 mt -79.61 135.35 25.75 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 124.275 1.03 . . . . 0.0 109.352 173.753 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 11.9 p -130.69 163.83 26.37 Favored 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 113.905 1.076 . . . . 0.0 113.905 178.15 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 35.1 t -111.23 159.3 18.03 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.99 1.716 . . . . 0.0 112.346 179.726 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 53.6 mt -60.47 -27.97 67.96 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.81 0.844 . . . . 0.0 111.555 174.108 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 85.9 t80 -62.24 -30.56 71.19 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.283 1.033 . . . . 0.0 113.088 172.456 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 68.3 mt-30 -81.55 -31.06 32.85 Favored 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 123.548 0.739 . . . . 0.0 110.969 174.877 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 66.3 mt -63.74 -43.15 97.35 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 118.968 0.804 . . . . 0.0 111.494 169.657 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -55.98 -35.26 66.55 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.665 1.186 . . . . 0.0 113.526 175.025 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -60.31 -31.08 69.93 Favored 'General case' 0 CA--C 1.547 0.836 0 O-C-N 121.505 -0.747 . . . . 0.0 112.38 178.112 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.409 ' CD2' ' HB ' ' A' ' 2' ' ' ILE . 92.0 m-85 -103.39 10.11 37.52 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.762 1.225 . . . . 0.0 114.163 -177.721 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 76.0 m -73.46 150.74 41.41 Favored 'General case' 0 N--CA 1.468 0.452 0 O-C-N 121.462 -0.774 . . . . 0.0 110.977 167.89 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 21.9 t-20 . . . . . 0 C--O 1.254 1.318 0 C-N-CA 124.385 1.074 . . . . 0.0 113.132 176.336 . . . . . . . . 0 0 . 1 . 035 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 83.1 m-85 . . . . . 0 N--CA 1.487 1.376 0 CA-C-O 117.993 -1.003 . . . . 0.0 110.916 . . . . . . . . . 0 0 . 1 . 035 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 8.7 p -66.39 145.97 13.53 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.276 0 CA-C-N 120.576 1.534 . . . . 0.0 112.051 179.67 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 2.2 t30 58.57 63.8 1.61 Allowed 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 126.177 1.791 . . . . 0.0 111.311 175.874 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 -151.87 160.87 43.39 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.943 0.897 . . . . 0.0 111.83 -169.528 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 68.5 m-70 -76.59 138.14 39.95 Favored 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 164.824 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 66.3 mt -142.37 123.26 14.39 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 126.018 1.727 . . . . 0.0 108.759 177.484 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 5.6 t -141.36 149.92 41.77 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 121.36 -0.837 . . . . 0.0 112.729 -175.082 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.69 -128.42 44.86 Favored Glycine 0 N--CA 1.47 0.916 0 C-N-CA 124.261 0.934 . . . . 0.0 112.718 174.964 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.5 m -53.63 -37.98 63.61 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.681 1.192 . . . . 0.0 112.986 176.782 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 42.4 m-70 -70.59 -35.59 73.11 Favored 'General case' 0 CA--C 1.539 0.521 0 O-C-N 120.977 -1.077 . . . . 0.0 112.242 179.421 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 44.2 tp -67.62 -40.98 84.66 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 123.297 0.639 . . . . 0.0 111.28 171.724 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 25.5 t -59.52 -46.79 92.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 124.338 1.055 . . . . 0.0 111.266 172.789 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -61.19 -46.19 91.48 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 123.773 0.829 . . . . 0.0 111.567 175.077 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.06 -41.06 99.37 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 121.61 -0.681 . . . . 0.0 112.017 179.021 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 43.6 mt -65.92 -40.3 91.34 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 118.487 -0.768 . . . . 0.0 111.81 175.1 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 16.6 m-85 -61.57 -38.78 88.75 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 120.381 1.446 . . . . 0.0 112.765 171.41 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 76.4 mt -68.09 -44.54 76.01 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.801 0.84 . . . . 0.0 112.297 176.422 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 55.2 t -74.07 -45.68 47.57 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 C-N-CA 123.479 0.712 . . . . 0.0 112.232 -179.027 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 49.6 m -84.58 -26.59 27.86 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 113.786 1.032 . . . . 0.0 113.786 -173.789 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 71.81 -149.21 44.4 Favored Glycine 0 CA--C 1.531 1.076 0 C-N-CA 124.576 1.084 . . . . 0.0 112.092 -174.435 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -62.28 -19.82 63.64 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.116 1.366 . . . . 0.0 113.419 -178.815 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 62.7 mtm180 -58.79 -35.55 73.0 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.536 1.134 . . . . 0.0 113.21 178.495 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.68 -173.09 55.32 Favored Glycine 0 CA--C 1.53 1.011 0 C-N-CA 124.282 0.944 . . . . 0.0 113.199 -172.333 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 37.6 p90 -146.69 162.79 37.76 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 126.078 1.751 . . . . 0.0 112.571 -169.114 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 61.6 m-85 -89.95 -27.67 19.66 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 114.193 1.182 . . . . 0.0 114.193 -177.042 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 4.1 t80 57.03 31.46 19.95 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 125.059 1.344 . . . . 0.0 113.183 -179.633 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 38.4 m -47.17 123.12 8.16 Favored Pre-proline 0 CA--C 1.543 0.682 0 C-N-CA 126.276 1.83 . . . . 0.0 112.324 -168.959 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_exo -61.35 178.05 0.69 Allowed 'Trans proline' 0 C--N 1.352 0.714 0 C-N-CA 124.754 3.636 . . . . 0.0 115.292 179.216 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 17.3 ptmt -61.61 -15.95 43.94 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 114.956 1.465 . . . . 0.0 114.956 174.801 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 19.0 m -78.68 81.37 4.99 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 126.193 1.797 . . . . 0.0 109.972 -179.531 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 65.3 mttm 59.88 -140.7 0.62 Allowed 'General case' 0 CA--C 1.554 1.124 0 C-N-CA 125.846 1.658 . . . . 0.0 112.465 174.715 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 17.1 ptm180 . . . . . 0 C--O 1.252 1.216 0 C-N-CA 128.331 2.652 . . . . 0.0 111.685 175.744 . . . . . . . . 0 0 . 1 . 036 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.324 0 N-CA-C 110.205 -1.158 . . . . 0.0 110.205 . . . . . . . . . 0 0 . 1 . 036 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 19.1 tt -75.23 -33.32 28.05 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 CA-C-N 118.183 0.992 . . . . 0.0 112.44 174.513 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 72.2 t -56.31 -58.73 4.24 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 123.743 0.817 . . . . 0.0 111.878 -169.289 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.42 ' CD ' ' H ' ' A' ' 4' ' ' GLU . 0.8 OUTLIER -81.47 -20.47 40.18 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 -179.526 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 11.9 tp60 -69.2 -43.95 73.11 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 119.413 1.006 . . . . 0.0 111.338 177.268 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 46.8 m -67.23 -26.7 66.72 Favored 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 172.732 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 77.5 m -71.83 -56.54 5.55 Favored 'General case' 0 CA--C 1.543 0.675 0 O-C-N 121.016 -1.052 . . . . 0.0 111.193 172.985 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 46.6 p -75.16 -22.79 57.85 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 125.264 1.426 . . . . 0.0 113.98 -170.715 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 6.2 t -144.13 178.99 7.49 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 122.641 1.21 . . . . 0.0 112.411 175.586 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 17.6 mm -70.19 129.49 34.38 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.676 0 C-N-CA 125.439 1.496 . . . . 0.0 109.188 174.353 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 10.2 p -128.54 155.87 44.19 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.157 0.983 . . . . 0.0 112.448 174.576 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 75.3 p -103.84 164.04 11.95 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 114.946 1.462 . . . . 0.0 114.946 -169.741 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 10.5 mp -65.39 -27.56 68.65 Favored 'General case' 0 CA--C 1.539 0.551 0 O-C-N 121.185 -0.947 . . . . 0.0 111.651 172.09 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 89.6 t80 -64.52 -34.05 77.32 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 121.653 -0.654 . . . . 0.0 112.568 170.788 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 67.2 mt-30 -72.6 -39.52 67.25 Favored 'General case' 0 N--CA 1.47 0.543 0 O-C-N 121.62 -0.675 . . . . 0.0 111.289 171.581 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 94.5 mt -61.22 -43.73 98.41 Favored 'General case' 0 CA--C 1.545 0.757 0 CA-C-N 119.322 0.965 . . . . 0.0 111.727 174.089 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 40.0 mm-40 -55.5 -40.82 72.22 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 125.538 1.535 . . . . 0.0 112.806 171.551 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 17.0 t-20 -63.46 -23.02 67.22 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 113.419 0.896 . . . . 0.0 113.419 -177.965 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 64.2 m-85 -102.22 3.26 38.11 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 125.455 1.502 . . . . 0.0 114.194 176.785 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 85.2 m -66.64 146.77 54.12 Favored 'General case' 0 CA--C 1.544 0.732 0 O-C-N 121.235 -0.916 . . . . 0.0 110.402 167.934 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 . . . . . 0 C--O 1.255 1.386 0 C-N-CA 124.758 1.223 . . . . 0.0 113.083 -174.511 . . . . . . . . 0 0 . 1 . 036 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 72.1 m-85 . . . . . 0 N--CA 1.484 1.238 0 CA-C-O 119.39 -0.338 . . . . 0.0 110.725 . . . . . . . . . 0 0 . 1 . 036 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 13.4 p -84.36 115.97 27.3 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.012 0 C-N-CA 123.834 0.854 . . . . 0.0 111.08 -178.134 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -174.0 143.68 0.95 Allowed 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.566 1.546 . . . . 0.0 111.978 -171.956 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 29.3 mm-40 -154.58 169.27 24.24 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 125.503 1.521 . . . . 0.0 111.017 -174.307 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 51.5 m-70 -77.91 135.13 37.82 Favored 'General case' 0 CA--C 1.548 0.868 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 166.273 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 86.1 mt -140.54 124.75 17.57 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 125.404 1.482 . . . . 0.0 109.273 -179.485 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 5.2 t -142.21 142.41 32.65 Favored 'General case' 0 N--CA 1.469 0.494 0 O-C-N 121.485 -0.76 . . . . 0.0 112.84 -174.908 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 56.94 -126.61 42.42 Favored Glycine 0 CA--C 1.53 1.005 0 C-N-CA 124.598 1.094 . . . . 0.0 113.148 175.527 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 22.1 p -54.68 -38.07 66.52 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.411 1.085 . . . . 0.0 112.934 176.46 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 20.3 t-160 -68.95 -36.39 77.88 Favored 'General case' 0 CA--C 1.543 0.701 0 O-C-N 120.832 -1.168 . . . . 0.0 111.55 179.235 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 58.9 tp -67.99 -43.18 79.48 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 123.524 0.73 . . . . 0.0 111.361 172.083 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 28.8 t -59.26 -45.82 92.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 C-N-CA 124.31 1.044 . . . . 0.0 110.769 175.517 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -63.57 -44.05 95.23 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 118.621 0.646 . . . . 0.0 112.106 174.385 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.36 -41.71 94.24 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 119.254 0.934 . . . . 0.0 112.096 176.619 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 58.1 mt -63.58 -41.61 98.35 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 123.419 0.687 . . . . 0.0 111.749 174.546 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 14.0 m-85 -59.04 -45.94 89.49 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 119.761 1.164 . . . . 0.0 112.445 171.247 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 9.0 mp -67.55 -43.78 79.86 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.785 0.834 . . . . 0.0 112.35 -179.626 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 52.7 t -70.93 -49.37 50.44 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 CA-C-N 118.549 0.613 . . . . 0.0 111.456 -179.959 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 63.3 m -77.35 -33.23 55.43 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 113.371 0.878 . . . . 0.0 113.371 -174.189 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 65.36 -135.4 36.51 Favored Glycine 0 CA--C 1.529 0.907 0 C-N-CA 124.211 0.91 . . . . 0.0 111.781 178.573 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -64.09 -15.33 59.39 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 114.287 1.218 . . . . 0.0 114.287 -179.398 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 89.3 mtm180 -67.17 -36.6 82.14 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.896 0.878 . . . . 0.0 112.596 177.622 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.99 -177.41 50.23 Favored Glycine 0 CA--C 1.533 1.172 0 C-N-CA 124.391 0.996 . . . . 0.0 112.406 -169.657 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 46.5 p90 -159.85 174.45 14.43 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 125.058 1.343 . . . . 0.0 113.556 -172.039 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 27.9 t80 -142.89 125.03 15.35 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.189 0.996 . . . . 0.0 110.206 168.761 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 48.7 p90 -90.31 132.22 35.67 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 124.989 1.315 . . . . 0.0 112.096 -179.121 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 64.1 m -122.85 122.82 27.0 Favored Pre-proline 0 N--CA 1.479 0.996 0 C-N-CA 123.887 0.875 . . . . 0.0 111.648 -172.585 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_endo -91.46 177.56 1.89 Allowed 'Trans proline' 0 CA--C 1.539 0.767 0 C-N-CA 125.126 3.884 . . . . 0.0 112.263 172.959 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -62.42 -28.24 69.66 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 126.08 1.752 . . . . 0.0 113.805 174.896 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 22.8 p -72.13 -14.58 61.87 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 125.371 1.469 . . . . 0.0 112.828 172.934 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 30.8 ttpt 78.09 157.58 0.18 Allowed 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 128.103 2.561 . . . . 0.0 113.967 169.473 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 74.3 ttt180 . . . . . 0 C--O 1.254 1.313 0 C-N-CA 126.012 1.725 . . . . 0.0 112.007 175.311 . . . . . . . . 0 0 . 1 . 037 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.673 0 N-CA-C 112.526 -0.229 . . . . 0.0 112.526 . . . . . . . . . 0 0 . 1 . 037 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 19.1 tt -61.64 -26.97 41.15 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.082 0 O-C-N 121.457 -1.025 . . . . 0.0 113.629 -174.223 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 55.9 t -57.54 -29.38 33.84 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 172.805 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -89.96 -35.48 15.54 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 118.978 0.808 . . . . 0.0 112.463 169.656 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -69.27 -41.21 77.18 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 121.84 -0.538 . . . . 0.0 112.299 -171.93 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.3 m -74.75 -21.98 59.04 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 113.118 0.784 . . . . 0.0 113.118 172.174 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 17.1 t -89.38 -46.81 8.45 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.427 0.691 . . . . 0.0 112.489 -171.585 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 85.7 m -82.72 -44.35 15.74 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 125.393 1.477 . . . . 0.0 111.326 178.039 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 68.8 m -106.09 172.95 6.53 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 124.4 1.08 . . . . 0.0 111.813 177.53 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 22.6 mm -73.91 144.55 12.41 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 O-C-N 120.89 -1.131 . . . . 0.0 110.108 171.285 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 11.8 p -134.9 -177.03 4.44 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 113.751 1.019 . . . . 0.0 113.751 170.601 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 79.3 p -147.76 164.58 33.17 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 125.382 1.473 . . . . 0.0 112.5 -169.172 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 10.9 mp -61.89 -29.33 70.13 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 121.416 -0.803 . . . . 0.0 112.423 -177.416 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 90.3 t80 -63.01 -37.0 85.45 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 123.44 0.696 . . . . 0.0 112.483 172.773 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 58.6 mt-30 -74.9 -36.56 62.23 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 123.786 0.835 . . . . 0.0 111.052 175.461 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 94.9 mt -61.83 -48.48 80.38 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 118.728 0.695 . . . . 0.0 111.279 172.97 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 19.6 mm-40 -60.97 -34.56 74.95 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.208 1.003 . . . . 0.0 113.268 176.691 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 17.0 t30 -57.76 -28.01 63.56 Favored 'General case' 0 CA--C 1.547 0.85 0 O-C-N 121.013 -1.054 . . . . 0.0 113.028 178.209 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 71.0 m-85 -103.08 6.89 38.88 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.183 1.393 . . . . 0.0 113.906 177.445 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 98.9 m -92.27 160.64 15.05 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.134 0.974 . . . . 0.0 112.994 171.12 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 . . . . . 0 C--O 1.253 1.267 0 N-CA-C 113.55 0.944 . . . . 0.0 113.55 -173.078 . . . . . . . . 0 0 . 1 . 037 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 62.5 t80 . . . . . 0 N--CA 1.488 1.456 0 N-CA-C 110.175 -0.305 . . . . 0.0 110.175 . . . . . . . . . 0 0 . 1 . 037 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 9.4 p -66.23 145.99 13.52 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.2 0 O-C-N 121.344 -0.847 . . . . 0.0 111.891 179.119 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 1.9 t30 61.33 58.63 2.11 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.186 1.394 . . . . 0.0 111.288 177.091 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -150.43 164.17 36.57 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.022 1.329 . . . . 0.0 110.473 -176.088 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 97.7 m-70 -80.08 145.54 32.38 Favored 'General case' 0 CA--C 1.549 0.908 0 O-C-N 121.224 -0.923 . . . . 0.0 111.044 170.658 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 80.8 mt -142.57 139.71 31.47 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.988 1.715 . . . . 0.0 110.069 173.78 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.0 t -151.65 145.77 25.32 Favored 'General case' 0 N--CA 1.471 0.604 0 O-C-N 121.316 -0.865 . . . . 0.0 112.056 -177.345 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 54.42 -124.22 30.5 Favored Glycine 0 CA--C 1.529 0.964 0 C-N-CA 124.549 1.071 . . . . 0.0 113.385 172.829 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 71.8 p -55.09 -35.61 64.77 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 124.892 1.277 . . . . 0.0 113.463 177.458 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 4.2 m80 -75.52 -37.18 60.25 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 121.503 -0.748 . . . . 0.0 111.112 -179.078 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 54.3 tp -64.98 -45.38 85.9 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 123.437 0.695 . . . . 0.0 111.308 171.573 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 22.2 t -59.37 -46.81 92.28 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.913 0 C-N-CA 124.747 1.219 . . . . 0.0 111.275 175.555 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -63.61 -43.52 96.63 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.315 0.646 . . . . 0.0 111.767 177.105 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.17 -44.35 96.81 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.35 0.66 . . . . 0.0 111.837 176.65 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 44.4 mt -58.76 -43.66 90.41 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 123.024 0.53 . . . . 0.0 111.635 175.808 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 20.4 m-85 -63.95 -43.68 95.1 Favored 'General case' 0 CA--C 1.544 0.717 0 O-C-N 121.343 -0.848 . . . . 0.0 112.629 174.2 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 76.5 mt -67.44 -41.28 85.0 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 123.674 0.79 . . . . 0.0 112.641 179.589 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 61.6 t -73.55 -46.96 46.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 124.359 1.064 . . . . 0.0 111.58 -178.159 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 58.8 m -98.9 -16.47 18.8 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 115.389 1.626 . . . . 0.0 115.389 -169.312 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 73.97 -148.5 39.73 Favored Glycine 0 CA--C 1.531 1.061 0 C-N-CA 124.309 0.957 . . . . 0.0 113.431 177.896 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 2.9 pm0 -67.02 -11.42 56.99 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.633 1.573 . . . . 0.0 114.541 -176.35 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 40.2 mtp180 -57.71 -36.03 71.45 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 125.02 1.328 . . . . 0.0 112.789 172.359 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.5 175.48 30.77 Favored Glycine 0 CA--C 1.529 0.928 0 C-N-CA 124.288 0.947 . . . . 0.0 113.663 -176.935 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 37.6 p90 -120.52 153.45 36.67 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.967 1.307 . . . . 0.0 113.064 -176.801 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 57.1 m-85 -127.59 38.55 4.03 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 127.74 2.416 . . . . 0.0 109.327 -179.119 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.84 151.1 43.27 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.899 1.68 . . . . 0.0 115.348 -170.405 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 18.9 p -97.86 134.79 21.92 Favored Pre-proline 0 N--CA 1.473 0.7 0 C-N-CA 124.72 1.208 . . . . 0.0 111.76 -175.215 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -76.55 173.84 13.82 Favored 'Trans proline' 0 C--N 1.351 0.68 0 C-N-CA 124.442 3.428 . . . . 0.0 112.17 -175.093 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -73.76 -38.05 64.84 Favored 'General case' 0 CA--C 1.546 0.794 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 173.619 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 18.8 m -155.78 -66.9 0.12 Allowed 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 125.211 1.404 . . . . 0.0 111.366 -169.21 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 32.1 mmmt -83.19 154.97 23.98 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.333 1.053 . . . . 0.0 113.12 -172.329 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.19 0 C-N-CA 126.777 2.031 . . . . 0.0 111.55 179.638 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.648 0 N-CA-C 112.337 -0.305 . . . . 0.0 112.337 . . . . . . . . . 0 0 . 1 . 038 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 10.8 tp -58.92 -34.17 51.88 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.389 0 O-C-N 121.249 -1.148 . . . . 0.0 113.951 -170.939 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 6.4 t -70.11 -21.11 23.49 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.276 0 C-N-CA 124.593 1.157 . . . . 0.0 112.682 -179.819 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -86.98 -48.03 8.46 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 123.784 0.834 . . . . 0.0 109.227 167.789 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 33.5 tt0 -65.33 -43.47 90.82 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 124.968 1.307 . . . . 0.0 113.87 -167.569 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 67.2 m -73.83 -12.7 60.76 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 113.545 0.942 . . . . 0.0 113.545 173.959 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 15.1 t -104.66 -43.55 5.1 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.955 1.302 . . . . 0.0 113.353 -168.863 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 81.5 p -85.84 -28.36 24.5 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 124.951 1.3 . . . . 0.0 112.279 175.328 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 5.5 t -126.39 -169.55 2.04 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.319 1.447 . . . . 0.0 111.035 170.107 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 6.5 tt -98.37 147.73 6.56 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.513 0 C-N-CA 125.08 1.352 . . . . 0.0 110.719 177.353 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 17.5 p -133.63 150.36 51.58 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 113.889 1.07 . . . . 0.0 113.889 -178.698 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 34.2 t -91.59 160.92 15.15 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 125.826 1.65 . . . . 0.0 112.276 178.195 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 10.0 mp -59.09 -29.18 67.16 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.357 1.063 . . . . 0.0 111.54 171.303 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 94.6 t80 -60.99 -37.72 83.47 Favored 'General case' 0 CA--C 1.54 0.56 0 O-C-N 121.55 -0.719 . . . . 0.0 112.786 171.546 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 37.0 mt-30 -74.73 -38.33 62.3 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 123.413 0.685 . . . . 0.0 110.45 177.618 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 95.5 mt -60.71 -43.77 97.4 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 123.467 0.707 . . . . 0.0 111.795 173.579 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -68.63 -35.28 77.09 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 113.518 0.932 . . . . 0.0 113.518 173.314 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -63.68 -32.18 73.58 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-N 119.535 1.061 . . . . 0.0 113.105 -177.627 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 41.4 m-85 -86.61 -1.97 58.11 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 124.786 1.234 . . . . 0.0 113.89 172.491 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 6.5 t -86.95 172.44 10.03 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 124.27 1.028 . . . . 0.0 112.542 171.47 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 19.8 m120 . . . . . 0 C--O 1.253 1.265 0 C-N-CA 125.68 1.592 . . . . 0.0 112.878 176.564 . . . . . . . . 0 0 . 1 . 038 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 65.2 m-85 . . . . . 0 N--CA 1.489 1.51 0 N-CA-C 111.343 0.127 . . . . 0.0 111.343 . . . . . . . . . 0 0 . 1 . 038 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 32.6 m -76.13 -6.11 8.32 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.388 0 C-N-CA 124.65 1.18 . . . . 0.0 114.08 -179.829 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 4.0 m120 -63.37 146.37 53.67 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.739 1.216 . . . . 0.0 113.036 -174.399 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 44.2 mt-30 -142.4 157.92 44.26 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.159 1.384 . . . . 0.0 111.868 -177.833 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 84.9 m-70 -95.03 126.47 40.39 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 108.166 -1.05 . . . . 0.0 108.166 167.197 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 54.5 mt -144.58 138.68 27.63 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 125.137 1.375 . . . . 0.0 109.862 -172.395 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 1.8 t -154.99 151.99 29.13 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 123.358 0.663 . . . . 0.0 111.664 -179.169 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 57.69 -133.11 52.8 Favored Glycine 0 CA--C 1.532 1.106 0 C-N-CA 124.336 0.969 . . . . 0.0 113.434 175.303 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 23.3 p -54.22 -43.22 70.62 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.734 1.214 . . . . 0.0 112.968 179.03 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 15.7 m-70 -67.15 -32.37 73.42 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 120.848 -1.157 . . . . 0.0 112.912 179.446 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 57.4 tp -68.91 -41.88 77.61 Favored 'General case' 0 N--CA 1.468 0.438 0 O-C-N 121.742 -0.599 . . . . 0.0 111.473 170.343 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 55.6 t -60.39 -44.59 96.4 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 CA-C-N 118.813 0.733 . . . . 0.0 110.864 175.457 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -58.4 -50.67 72.83 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 123.879 0.872 . . . . 0.0 111.354 172.049 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.91 -42.36 99.76 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.705 0.802 . . . . 0.0 112.432 -177.677 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 60.5 mt -57.73 -45.5 85.71 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 119.035 0.834 . . . . 0.0 111.087 175.399 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 25.8 m-85 -66.96 -41.0 87.65 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 118.868 0.758 . . . . 0.0 112.763 176.152 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 75.8 mt -67.42 -43.99 79.84 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 123.808 0.843 . . . . 0.0 112.417 178.793 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 67.7 t -76.68 -38.83 31.06 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 124.417 1.087 . . . . 0.0 111.749 -175.923 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 28.8 t -80.86 -26.22 37.1 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 113.266 0.839 . . . . 0.0 113.266 178.665 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 79.2 -153.85 38.12 Favored Glycine 0 CA--C 1.528 0.881 0 C-N-CA 124.731 1.158 . . . . 0.0 112.78 179.311 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -61.35 -14.29 26.23 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 115.196 1.554 . . . . 0.0 115.196 -174.228 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 49.8 mtp180 -54.22 -48.64 70.85 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 125.159 1.384 . . . . 0.0 112.24 171.192 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.74 145.85 0.9 Allowed Glycine 0 CA--C 1.533 1.21 0 C-N-CA 125.217 1.389 . . . . 0.0 112.604 -174.881 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 14.9 p90 -98.08 166.48 11.4 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 123.924 0.89 . . . . 0.0 112.2 175.797 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 69.9 t80 -151.87 119.36 6.03 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.356 1.462 . . . . 0.0 109.295 170.314 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 54.7 t80 -161.53 148.06 14.27 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 124.142 0.977 . . . . 0.0 112.39 -172.519 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 38.2 m -86.2 117.19 68.28 Favored Pre-proline 0 N--CA 1.474 0.733 0 C-N-CA 125.191 1.397 . . . . 0.0 109.639 178.103 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -74.63 165.58 31.26 Favored 'Trans proline' 0 CA--C 1.537 0.645 0 C-N-CA 123.375 2.717 . . . . 0.0 111.869 -176.84 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 64.4 pttt -59.49 -27.99 66.63 Favored 'General case' 0 N--CA 1.477 0.894 0 N-CA-C 114.23 1.196 . . . . 0.0 114.23 -176.597 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 58.5 m -92.02 88.59 6.62 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 105.545 -2.02 . . . . 0.0 105.545 168.392 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 15.4 ttpp -53.18 127.71 25.28 Favored 'General case' 0 CA--C 1.548 0.888 0 N-CA-C 114.291 1.219 . . . . 0.0 114.291 -167.604 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 34.9 ptt180 . . . . . 0 C--O 1.253 1.271 0 C-N-CA 125.827 1.651 . . . . 0.0 113.07 170.06 . . . . . . . . 0 0 . 1 . 039 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.685 0 N-CA-C 110.816 -0.913 . . . . 0.0 110.816 . . . . . . . . . 0 0 . 1 . 039 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 8.5 tp -46.67 -42.27 5.51 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.269 0 N-CA-C 116.257 1.947 . . . . 0.0 116.257 -166.972 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 67.6 t -68.71 -43.49 82.99 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 CA-C-N 118.619 0.645 . . . . 0.0 112.253 -171.896 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -75.45 -38.22 59.82 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 118.109 0.413 . . . . 0.0 111.505 170.372 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 52.3 tt0 -67.24 -43.53 81.73 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 125.129 1.372 . . . . 0.0 113.587 -171.058 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 41.6 m -70.04 -20.4 63.25 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 173.166 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 23.1 t -99.36 -38.2 8.93 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 118.929 0.786 . . . . 0.0 112.592 -171.972 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 67.5 p -86.74 -20.46 27.64 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 125.496 1.518 . . . . 0.0 113.416 176.412 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.5 t -138.88 -170.68 2.91 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.238 1.415 . . . . 0.0 110.725 174.361 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 78.0 mt -91.58 135.31 27.38 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 C-N-CA 124.884 1.273 . . . . 0.0 108.987 176.229 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 15.2 p -121.97 -176.11 3.26 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.217 1.007 . . . . 0.0 112.016 172.189 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 95.7 p -143.48 165.39 27.68 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 125.046 1.339 . . . . 0.0 112.294 -172.671 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 43.0 mt -58.17 -33.23 69.01 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.238 0.615 . . . . 0.0 112.106 177.731 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 71.9 t80 -65.75 -28.94 69.4 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.139 0.976 . . . . 0.0 113.23 174.25 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 54.2 mt-30 -80.1 -32.7 39.15 Favored 'General case' 0 CA--C 1.538 0.483 0 O-C-N 121.509 -0.744 . . . . 0.0 111.321 173.175 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 91.0 mt -65.94 -44.32 85.43 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 118.888 0.767 . . . . 0.0 111.495 171.763 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.0 mm-40 -52.14 -38.04 56.31 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 125.661 1.584 . . . . 0.0 112.959 172.648 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.9 t30 -62.05 -24.38 67.05 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 113.373 0.879 . . . . 0.0 113.373 -178.64 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 79.0 m-85 -105.6 12.63 30.99 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.441 1.496 . . . . 0.0 113.929 179.456 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 78.3 m -82.14 164.58 21.2 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 123.855 0.862 . . . . 0.0 110.722 167.201 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 13.8 m120 . . . . . 0 C--O 1.254 1.295 0 CA-C-O 118.243 -0.884 . . . . 0.0 112.432 170.917 . . . . . . . . 0 0 . 1 . 039 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 47.9 t80 . . . . . 0 N--CA 1.486 1.351 0 CA-C-O 119.705 -0.188 . . . . 0.0 110.612 . . . . . . . . . 0 0 . 1 . 039 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 27.6 m -64.35 -24.4 35.58 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 N-CA-C 114.513 1.301 . . . . 0.0 114.513 -173.147 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 16.8 m120 -128.19 127.74 43.49 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 126.167 1.787 . . . . 0.0 109.095 169.825 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 3.3 tt0 -169.92 166.35 9.43 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 119.139 0.881 . . . . 0.0 112.948 -170.283 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 99.4 m-70 -85.97 142.74 28.58 Favored 'General case' 0 CA--C 1.549 0.931 0 N-CA-C 108.412 -0.959 . . . . 0.0 108.412 164.198 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 75.9 mt -145.73 126.75 14.6 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 126.092 1.757 . . . . 0.0 109.477 176.098 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 92.4 m -124.92 146.04 49.54 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 125.135 1.374 . . . . 0.0 111.253 179.474 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 45.95 -122.11 5.71 Favored Glycine 0 N--CA 1.473 1.127 0 C-N-CA 125.314 1.435 . . . . 0.0 115.021 168.568 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 67.8 p -52.42 -40.11 61.78 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 125.034 1.334 . . . . 0.0 113.301 -179.931 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 2.2 m80 -70.84 -37.92 73.18 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.217 -0.927 . . . . 0.0 111.019 -177.933 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 60.6 tp -66.11 -45.0 82.66 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.346 0.658 . . . . 0.0 111.49 171.915 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 53.2 t -61.54 -43.42 96.89 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 C-N-CA 123.802 0.841 . . . . 0.0 110.99 178.766 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -65.58 -41.66 92.64 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 118.767 0.712 . . . . 0.0 112.332 173.016 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.76 -41.79 96.14 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 119.667 1.122 . . . . 0.0 112.111 174.938 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 54.8 mt -61.21 -44.24 97.6 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 123.524 0.729 . . . . 0.0 111.317 173.627 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 13.9 m-30 -58.86 -43.41 90.84 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 119.495 1.043 . . . . 0.0 112.025 175.138 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 8.3 mp -67.46 -45.45 75.94 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 124.083 0.953 . . . . 0.0 112.427 177.28 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 45.5 t -69.4 -48.71 65.62 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 C-N-CA 123.351 0.661 . . . . 0.0 111.637 -178.506 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 62.6 m -70.6 -39.0 74.06 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 118.53 0.605 . . . . 0.0 112.281 -176.936 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.58 -137.76 42.38 Favored Glycine 0 CA--C 1.527 0.815 0 C-N-CA 124.281 0.944 . . . . 0.0 112.347 176.863 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -63.94 -15.84 60.09 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 114.549 1.314 . . . . 0.0 114.549 -177.861 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 91.6 mtm180 -67.1 -35.13 79.13 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 123.818 0.847 . . . . 0.0 112.727 175.994 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 94.44 154.2 30.8 Favored Glycine 0 CA--C 1.533 1.212 0 C-N-CA 125.34 1.448 . . . . 0.0 113.322 -172.401 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 53.7 p90 -93.41 153.84 18.28 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 125.946 1.698 . . . . 0.0 111.326 176.962 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 20.4 t80 -144.06 21.12 1.76 Allowed 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 124.302 1.041 . . . . 0.0 112.953 -173.483 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 17.3 p90 -65.89 147.25 53.66 Favored 'General case' 0 CA--C 1.55 0.951 0 O-C-N 120.715 -1.241 . . . . 0.0 113.181 178.067 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . 0.583 ' H ' ' CD ' ' B' ' 28' ' ' PRO . 74.3 p -139.81 -26.98 0.01 OUTLIER Pre-proline 0 N--CA 1.479 1.009 0 CA-C-O 115.532 -2.175 . . . . 0.0 116.105 178.436 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . 0.583 ' CD ' ' H ' ' B' ' 27' ' ' THR . 94.5 Cg_exo -54.72 144.61 64.41 Favored 'Trans proline' 0 C--N 1.361 1.201 0 C-N-CA 122.969 2.446 . . . . 0.0 114.277 -177.207 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 58.0 tttt 53.16 2.22 0.02 OUTLIER 'General case' 0 CA--C 1.557 1.235 0 C-N-CA 127.818 2.447 . . . . 0.0 116.509 178.992 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 20.0 p -127.28 -57.88 1.29 Allowed 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 125.753 1.621 . . . . 0.0 111.411 -171.92 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 29.4 mtpp -105.05 -25.03 12.7 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 124.955 1.302 . . . . 0.0 112.927 179.362 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.134 0 C-N-CA 125.846 1.658 . . . . 0.0 113.147 176.488 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.709 0 N-CA-C 111.92 -0.472 . . . . 0.0 111.92 . . . . . . . . . 0 0 . 1 . 040 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 10.3 tp -80.09 -44.04 22.5 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.109 0 N-CA-C 113.997 1.11 . . . . 0.0 113.997 -172.387 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 9.9 p -64.82 -34.49 70.59 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.295 0 CA-C-N 119.54 1.064 . . . . 0.0 112.587 -176.338 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 26.6 pt-20 -71.57 -3.69 22.82 Favored 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 113.95 1.092 . . . . 0.0 113.95 174.472 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 53.6 tp60 -104.05 -58.62 1.85 Allowed 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.165 0.986 . . . . 0.0 109.042 167.906 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 58.9 m -68.99 -25.99 64.79 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 114.701 1.371 . . . . 0.0 114.701 -169.524 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 11.7 t -80.85 -39.89 25.76 Favored 'General case' 0 N--CA 1.472 0.631 0 O-C-N 121.57 -0.706 . . . . 0.0 112.22 -175.744 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 24.5 p -95.1 -31.09 13.72 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 126.238 1.815 . . . . 0.0 112.686 -177.498 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 10.7 t -129.35 -169.75 2.16 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.975 1.71 . . . . 0.0 110.761 178.27 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 33.2 mm -87.92 146.71 5.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 C-N-CA 125.049 1.34 . . . . 0.0 111.273 -174.381 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 4.1 m -124.27 159.23 30.69 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 122.637 1.208 . . . . 0.0 114.006 170.742 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 17.7 t -130.78 157.23 43.4 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 127.598 2.359 . . . . 0.0 110.533 173.884 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 17.5 mt -59.7 -26.05 65.28 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 114.284 1.216 . . . . 0.0 114.284 -169.552 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 92.7 t80 -59.8 -33.69 72.06 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 121.548 -0.72 . . . . 0.0 112.572 173.227 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 68.3 mt-30 -78.88 -32.48 45.91 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.768 1.227 . . . . 0.0 111.122 179.376 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -63.02 -50.48 70.51 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.755 0.822 . . . . 0.0 109.681 170.489 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -60.33 -33.54 72.54 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 113.499 0.925 . . . . 0.0 113.499 178.308 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 19.1 t-20 -61.16 -24.0 65.97 Favored 'General case' 0 CA--C 1.548 0.889 0 N-CA-C 114.146 1.165 . . . . 0.0 114.146 -177.577 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 58.7 m-85 -106.73 3.84 27.06 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.612 1.565 . . . . 0.0 114.132 179.081 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 89.4 m -84.34 165.75 17.99 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.112 0.965 . . . . 0.0 113.422 173.652 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.252 1.228 0 C-N-CA 125.28 1.432 . . . . 0.0 110.731 -176.342 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 78.4 t80 . . . . . 0 N--CA 1.489 1.495 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 . . . . . . . . . 0 0 . 1 . 040 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 14.3 p -67.93 131.04 33.48 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.246 0 CA-C-N 119.085 0.857 . . . . 0.0 111.796 -176.294 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 19.1 t30 -166.83 102.15 0.56 Allowed 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.142 1.777 . . . . 0.0 108.143 -169.843 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -163.78 167.05 21.39 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 123.483 0.713 . . . . 0.0 111.664 -166.545 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 96.2 m-70 -70.79 146.18 49.91 Favored 'General case' 0 CA--C 1.549 0.916 0 O-C-N 121.06 -1.025 . . . . 0.0 111.489 168.918 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 74.5 mt -145.2 134.27 22.67 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 125.768 1.627 . . . . 0.0 109.848 174.113 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 5.5 t -148.08 153.11 38.47 Favored 'General case' 0 N--CA 1.47 0.553 0 O-C-N 121.198 -0.938 . . . . 0.0 112.76 179.366 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 54.18 -128.18 40.54 Favored Glycine 0 N--CA 1.471 0.99 0 C-N-CA 124.635 1.112 . . . . 0.0 113.54 172.68 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 76.4 p -53.13 -37.08 61.49 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 125.036 1.335 . . . . 0.0 113.065 177.436 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 5.3 m80 -74.88 -36.41 62.27 Favored 'General case' 0 CA--C 1.54 0.581 0 O-C-N 121.486 -0.759 . . . . 0.0 111.24 -178.851 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 56.1 tp -67.61 -43.99 79.11 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 123.304 0.642 . . . . 0.0 111.48 172.646 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 46.8 t -59.85 -46.65 93.54 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 C-N-CA 124.351 1.06 . . . . 0.0 110.659 175.437 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -63.3 -42.97 99.08 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.154 0.582 . . . . 0.0 111.462 175.561 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.15 -42.13 98.0 Favored 'General case' 0 CA--C 1.536 0.415 0 O-C-N 121.255 -0.903 . . . . 0.0 112.166 176.999 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 43.5 mt -59.08 -42.67 90.97 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 118.796 0.725 . . . . 0.0 111.219 175.736 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 36.9 m-85 -68.64 -37.4 79.66 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 113.554 0.946 . . . . 0.0 113.554 173.796 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 65.2 mt -67.77 -42.75 81.24 Favored 'General case' 0 N--CA 1.473 0.715 0 O-C-N 121.066 -1.021 . . . . 0.0 112.178 176.663 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 74.6 t -72.26 -48.92 46.3 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 124.484 1.114 . . . . 0.0 111.27 -179.271 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 61.9 m -97.82 -7.99 29.33 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 114.702 1.371 . . . . 0.0 114.702 -169.777 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 83.37 -161.32 38.99 Favored Glycine 0 N--CA 1.469 0.864 0 C-N-CA 125.451 1.501 . . . . 0.0 113.179 179.627 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 2.9 pm0 -63.92 -12.39 36.67 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.445 1.498 . . . . 0.0 114.167 -178.879 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 57.8 mtm180 -57.4 -38.16 73.84 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 124.923 1.289 . . . . 0.0 112.675 171.607 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 69.83 -150.47 49.27 Favored Glycine 0 CA--C 1.532 1.095 0 C-N-CA 124.171 0.891 . . . . 0.0 112.326 -172.302 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 53.5 p90 -141.42 155.81 45.84 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.988 1.315 . . . . 0.0 113.226 -170.206 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 74.2 t80 -90.03 -25.71 20.68 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.649 1.18 . . . . 0.0 113.12 -175.989 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 63.2 t80 -65.71 148.77 51.22 Favored 'General case' 0 CA--C 1.543 0.676 0 N-CA-C 114.765 1.395 . . . . 0.0 114.765 -173.034 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 20.8 p -115.66 114.92 42.0 Favored Pre-proline 0 N--CA 1.476 0.85 0 C-N-CA 126.042 1.737 . . . . 0.0 109.511 171.962 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -57.25 136.25 75.18 Favored 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 123.632 2.888 . . . . 0.0 112.719 178.279 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 19.9 ptmt -66.37 -15.7 63.49 Favored 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 114.004 1.112 . . . . 0.0 114.004 -178.478 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 22.8 p -81.58 -32.47 32.09 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 127.216 2.207 . . . . 0.0 112.238 172.614 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 16.5 tppt? -90.59 -37.89 13.51 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.267 1.427 . . . . 0.0 113.232 -178.241 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 76.6 ttt-85 . . . . . 0 C--O 1.252 1.198 0 C-N-CA 126.106 1.762 . . . . 0.0 112.445 -179.196 . . . . . . . . 0 0 . 1 . 041 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.555 0 N-CA-C 111.532 -0.627 . . . . 0.0 111.532 . . . . . . . . . 0 0 . 1 . 041 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 18.1 tt -54.93 -33.91 29.88 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.074 0 C-N-CA 125.434 1.493 . . . . 0.0 114.675 -170.171 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 4.9 p -61.68 -26.91 41.02 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 C-N-CA 123.747 0.819 . . . . 0.0 112.411 178.827 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -73.0 -5.08 36.43 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.17 0.988 . . . . 0.0 112.649 177.099 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 24.2 tt0 -113.78 -56.64 2.38 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.265 1.026 . . . . 0.0 110.06 170.441 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 12.4 m -67.36 -24.1 65.67 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 115.393 1.627 . . . . 0.0 115.393 -173.361 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 34.5 t -91.73 -47.95 7.08 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 119.608 1.095 . . . . 0.0 112.214 -178.977 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 5.3 t -71.19 -29.95 65.8 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.429 1.092 . . . . 0.0 113.131 -178.946 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.2 t -131.76 -173.36 3.11 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.855 1.262 . . . . 0.0 111.231 175.758 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 61.8 mt -84.03 140.56 15.98 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 C-N-CA 124.639 1.176 . . . . 0.0 109.885 177.209 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 12.9 p -136.38 154.89 50.68 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 122.207 1.003 . . . . 0.0 113.165 170.136 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 8.4 t -119.04 173.09 7.11 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 126.047 1.739 . . . . 0.0 111.776 178.823 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 62.9 mt -56.46 -33.81 66.28 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.255 1.422 . . . . 0.0 112.946 -171.13 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 90.5 t80 -60.89 -34.61 74.9 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 123.817 0.847 . . . . 0.0 112.784 175.121 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -79.09 -28.84 43.08 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 124.527 1.131 . . . . 0.0 111.036 177.927 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 58.8 mt -67.29 -50.16 61.43 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 123.356 0.662 . . . . 0.0 110.404 170.466 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -63.9 -27.04 68.88 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.067 0.947 . . . . 0.0 113.147 178.129 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 17.6 t30 -61.35 -35.23 76.87 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 124.319 1.048 . . . . 0.0 113.292 -179.376 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 26.0 m-85 -81.21 -24.64 37.31 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 113.652 0.982 . . . . 0.0 113.652 177.479 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 69.2 m -71.83 149.34 45.33 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.051 1.34 . . . . 0.0 112.502 -178.689 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.251 1.165 0 C-N-CA 128.112 2.565 . . . . 0.0 112.439 -172.309 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 80.2 m-85 . . . . . 0 N--CA 1.487 1.4 0 CA-C-O 119.599 -0.238 . . . . 0.0 111.142 . . . . . . . . . 0 0 . 1 . 041 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 22.7 t 86.82 -58.6 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.287 0 C-N-CA 129.077 2.951 . . . . 0.0 110.264 177.064 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 16.1 p-10 -86.03 104.06 15.29 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 123.317 0.647 . . . . 0.0 109.402 168.828 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -146.06 171.08 15.42 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.136 1.374 . . . . 0.0 111.412 -169.099 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 48.2 m-70 -80.82 138.64 36.23 Favored 'General case' 0 CA--C 1.549 0.912 0 O-C-N 121.044 -1.035 . . . . 0.0 108.923 167.113 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 30.8 mt -138.9 135.61 34.63 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 125.778 1.631 . . . . 0.0 109.335 175.305 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 1.8 t -141.63 148.82 39.8 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 -174.65 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 53.95 -135.37 43.2 Favored Glycine 0 N--CA 1.47 0.94 0 C-N-CA 124.765 1.174 . . . . 0.0 114.127 169.94 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 5.6 m -59.12 -26.3 64.58 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 177.008 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -70.24 -36.89 74.79 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 120.239 1.381 . . . . 0.0 111.77 174.123 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 53.1 tp -70.33 -42.11 72.34 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.058 0.943 . . . . 0.0 111.675 172.763 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 78.2 t -60.65 -42.52 92.13 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.888 0 C-N-CA 123.096 0.558 . . . . 0.0 110.628 174.381 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -67.77 -39.17 84.16 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.855 0.862 . . . . 0.0 112.301 175.239 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -57.96 -42.27 84.66 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 121.359 -0.838 . . . . 0.0 111.234 171.633 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 6.7 mp -65.36 -39.07 91.87 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 118.815 0.734 . . . . 0.0 112.137 173.787 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 22.0 m-30 -59.66 -39.91 86.02 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-N 119.71 1.141 . . . . 0.0 112.08 174.372 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 88.4 mt -74.34 -51.27 15.63 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.58 1.152 . . . . 0.0 111.961 178.145 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 76.2 t -75.79 -37.07 34.71 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 C-N-CA 124.221 1.008 . . . . 0.0 112.133 -171.43 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 72.2 m -105.89 19.41 20.58 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.496 1.119 . . . . 0.0 113.695 -176.2 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -58.06 -29.05 61.88 Favored Glycine 0 CA--C 1.535 1.296 0 CA-C-N 119.149 0.886 . . . . 0.0 113.97 -179.268 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -94.38 -33.36 13.19 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.93 1.292 . . . . 0.0 112.979 172.475 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 35.6 mmt180 -68.93 -28.62 66.82 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 124.156 0.982 . . . . 0.0 113.284 178.948 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 86.08 107.25 0.75 Allowed Glycine 0 CA--C 1.529 0.957 0 N-CA-C 108.81 -1.716 . . . . 0.0 108.81 -167.293 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 13.4 p90 -74.23 152.92 39.64 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 -177.466 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 86.6 t80 -151.34 80.12 1.3 Allowed 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 125.142 1.377 . . . . 0.0 108.702 177.452 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 43.4 p90 -79.89 141.69 35.88 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.285 1.434 . . . . 0.0 112.859 -176.443 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 27.9 p -134.61 66.87 70.69 Favored Pre-proline 0 N--CA 1.477 0.9 0 C-N-CA 125.179 1.391 . . . . 0.0 113.142 -176.406 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -73.34 139.08 28.46 Favored 'Trans proline' 0 C--N 1.351 0.701 0 C-N-CA 123.06 2.507 . . . . 0.0 109.461 168.487 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 78.2 tttt -74.47 -46.15 41.51 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 113.26 0.837 . . . . 0.0 113.26 -170.24 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 38.7 m -150.31 -61.16 0.2 Allowed 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 125.915 1.686 . . . . 0.0 110.236 -175.507 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 29.4 tptp -81.61 141.7 33.47 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.471 1.108 . . . . 0.0 112.761 -176.203 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 31.3 mtp180 . . . . . 0 C--O 1.252 1.194 0 C-N-CA 126.535 1.934 . . . . 0.0 111.269 168.741 . . . . . . . . 0 0 . 1 . 042 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.585 0 N-CA-C 111.589 -0.604 . . . . 0.0 111.589 . . . . . . . . . 0 0 . 1 . 042 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 3.8 tt -105.61 -20.7 5.78 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.069 0 N-CA-C 115.051 1.5 . . . . 0.0 115.051 -176.882 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 3.9 p -62.03 -29.05 45.61 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.349 0 CA-C-N 121.325 1.875 . . . . 0.0 110.968 179.249 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -65.6 -10.37 34.97 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 126.254 1.822 . . . . 0.0 113.519 174.592 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 36.9 tt0 -111.29 -53.01 2.75 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.334 1.454 . . . . 0.0 109.9 169.152 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 85.2 m -60.73 -31.52 70.82 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 114.265 1.209 . . . . 0.0 114.265 -173.267 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 8.7 t -91.24 -20.82 21.51 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 113.253 0.835 . . . . 0.0 113.253 -173.894 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 30.0 p -104.14 -27.44 12.07 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 126.368 1.867 . . . . 0.0 112.715 179.988 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 10.3 t -144.01 -165.94 2.24 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.895 2.078 . . . . 0.0 110.163 -177.943 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 29.2 mm -87.65 144.23 9.66 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 C-N-CA 124.963 1.305 . . . . 0.0 110.804 178.082 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.8 p -138.44 179.07 6.68 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.518 1.527 . . . . 0.0 110.65 168.966 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 7.4 t -152.49 166.96 30.35 Favored 'General case' 0 N--CA 1.474 0.755 0 O-C-N 120.733 -1.23 . . . . 0.0 113.925 -174.045 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 26.9 mt -61.11 -34.48 75.02 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.647 1.579 . . . . 0.0 112.286 -170.625 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 87.1 t80 -60.74 -28.08 68.42 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.454 1.102 . . . . 0.0 112.993 175.553 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 41.8 mt-30 -82.96 -38.35 22.84 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 123.748 0.819 . . . . 0.0 111.23 173.276 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 84.9 mt -61.31 -34.5 75.34 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.908 0.883 . . . . 0.0 112.608 177.017 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -54.72 -32.21 59.33 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 113.423 0.898 . . . . 0.0 113.423 171.857 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 16.5 t-20 -68.18 -19.1 64.75 Favored 'General case' 0 CA--C 1.547 0.834 0 CA-C-N 118.92 0.782 . . . . 0.0 113.073 179.469 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 97.4 m-85 -98.1 4.55 49.13 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.568 1.547 . . . . 0.0 113.659 178.347 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 17.5 t -77.41 173.9 11.43 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 124.903 1.281 . . . . 0.0 111.312 168.481 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.049 0 C-N-CA 125.105 1.362 . . . . 0.0 111.531 169.634 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 75.8 m-85 . . . . . 0 N--CA 1.487 1.392 0 N-CA-C 107.757 -1.201 . . . . 0.0 107.757 . . . . . . . . . 0 0 . 1 . 042 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . 0.47 HG12 ' H ' ' B' ' 3' ' ' ASN . 4.2 t 69.28 176.9 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.706 0 C-N-CA 125.42 1.488 . . . . 0.0 108.934 -168.167 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . 0.47 ' H ' HG12 ' B' ' 2' ' ' VAL . 7.2 p30 -62.24 131.9 50.94 Favored 'General case' 0 CA--C 1.546 0.811 0 O-C-N 120.357 -1.464 . . . . 0.0 111.533 174.523 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 70.4 mt-30 -160.75 173.42 15.44 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.968 1.307 . . . . 0.0 111.032 -169.345 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 99.3 m-70 -87.49 139.24 30.75 Favored 'General case' 0 CA--C 1.549 0.915 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 165.093 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 5.0 mp -143.03 145.48 32.95 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 124.969 1.308 . . . . 0.0 111.116 177.717 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 1.8 t -156.35 151.3 26.2 Favored 'General case' 0 N--CA 1.468 0.445 0 O-C-N 121.212 -0.93 . . . . 0.0 112.022 178.935 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 53.52 -129.49 40.9 Favored Glycine 0 N--CA 1.472 1.053 0 C-N-CA 124.326 0.965 . . . . 0.0 114.044 172.625 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.5 m -57.16 -31.99 65.95 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 124.481 1.113 . . . . 0.0 113.79 178.854 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -71.42 -38.08 71.42 Favored 'General case' 0 CA--C 1.544 0.737 0 O-C-N 120.983 -1.073 . . . . 0.0 111.492 176.164 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 42.4 tp -67.85 -41.29 83.14 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 123.485 0.714 . . . . 0.0 110.844 174.183 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 40.4 t -59.31 -45.86 92.88 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.975 0 C-N-CA 124.542 1.137 . . . . 0.0 111.306 172.599 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -63.09 -43.51 98.31 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.456 0.702 . . . . 0.0 111.447 177.033 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -65.13 -39.85 93.62 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 121.35 -0.844 . . . . 0.0 112.406 177.075 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 48.7 mt -61.18 -42.54 98.75 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 118.521 0.6 . . . . 0.0 111.351 174.098 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 17.0 m-85 -62.26 -41.54 98.54 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 119.079 0.854 . . . . 0.0 112.613 172.291 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 73.3 mt -67.25 -43.12 82.7 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 123.668 0.787 . . . . 0.0 112.193 178.498 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 55.1 t -72.53 -44.55 61.17 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 C-N-CA 123.896 0.878 . . . . 0.0 112.384 -179.149 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 35.5 t -82.86 -24.98 32.99 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 113.397 0.888 . . . . 0.0 113.397 -177.914 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 74.35 -155.23 48.59 Favored Glycine 0 CA--C 1.529 0.962 0 C-N-CA 124.65 1.119 . . . . 0.0 112.422 -178.334 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -62.69 -12.16 21.87 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 114.455 1.279 . . . . 0.0 114.455 179.471 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 56.1 mtp85 -61.3 -31.04 70.87 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.939 1.296 . . . . 0.0 112.683 175.007 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.39 139.48 1.5 Allowed Glycine 0 CA--C 1.533 1.218 0 C-N-CA 125.56 1.552 . . . . 0.0 112.945 -178.706 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 7.1 p90 -74.7 160.61 30.55 Favored 'General case' 0 CA--C 1.541 0.626 0 O-C-N 121.933 -0.745 . . . . 0.0 112.97 177.48 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 76.8 t80 -91.24 -27.67 18.3 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 125.21 1.404 . . . . 0.0 112.79 175.352 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 18.3 t80 -117.44 139.8 50.42 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 126.196 1.799 . . . . 0.0 113.069 -170.99 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 26.2 p -110.57 155.28 42.39 Favored Pre-proline 0 N--CA 1.478 0.926 0 C-N-CA 125.149 1.38 . . . . 0.0 108.54 167.509 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_exo -50.82 129.16 26.64 Favored 'Trans proline' 0 C--N 1.351 0.696 0 C-N-CA 123.558 2.839 . . . . 0.0 112.636 -177.06 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 7.0 mtmp? 82.03 -3.81 1.5 Allowed 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 128.272 2.629 . . . . 0.0 113.452 179.946 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 39.4 p 98.05 -18.65 0.05 OUTLIER 'General case' 0 N--CA 1.493 1.725 1 C-N-CA 133.044 4.538 . . . . 0.0 111.907 -173.413 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -147.68 123.19 10.4 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 126.109 1.763 . . . . 0.0 109.926 172.357 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.215 0 C-N-CA 125.909 1.684 . . . . 0.0 114.387 -173.728 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.83 0 N-CA-C 111.763 -0.535 . . . . 0.0 111.763 . . . . . . . . . 0 0 . 1 . 043 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 11.7 pt -68.36 -18.64 23.59 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.392 0 N-CA-C 114.347 1.24 . . . . 0.0 114.347 -169.297 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 7.1 p -57.84 -34.14 47.45 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 C-N-CA 124.973 1.309 . . . . 0.0 112.695 -174.977 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -70.38 -47.82 59.1 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 118.252 0.478 . . . . 0.0 110.863 172.172 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -71.2 -43.9 66.47 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.674 0.789 . . . . 0.0 111.837 -171.414 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 67.8 m -58.92 -28.34 66.12 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 123.991 0.916 . . . . 0.0 112.415 172.932 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 8.7 t -83.09 -54.33 5.12 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.706 0.803 . . . . 0.0 111.466 -178.86 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 81.3 p -77.66 -21.66 51.82 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 124.517 1.127 . . . . 0.0 113.739 -177.03 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.7 t -143.49 -165.39 2.08 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.386 1.474 . . . . 0.0 111.126 -178.508 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 37.6 mt -99.39 132.82 44.09 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 C-N-CA 125.295 1.438 . . . . 0.0 109.887 -174.531 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 7.8 p -132.8 159.19 40.48 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.247 1.019 . . . . 0.0 112.858 178.962 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 77.3 p -108.94 163.39 13.34 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 114.661 1.356 . . . . 0.0 114.661 -169.687 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 75.2 mt -59.55 -30.26 68.5 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 121.398 -0.814 . . . . 0.0 112.567 174.781 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 94.0 t80 -63.79 -33.43 75.64 Favored 'General case' 0 N--CA 1.473 0.688 0 O-C-N 121.383 -0.823 . . . . 0.0 112.603 173.802 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 58.3 mt-30 -74.1 -37.5 64.12 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 123.414 0.685 . . . . 0.0 110.868 173.617 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 41.2 mt -60.8 -43.74 97.76 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 118.336 0.516 . . . . 0.0 112.156 171.465 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -59.07 -38.91 80.55 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.033 0.933 . . . . 0.0 112.538 172.465 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 -65.1 -22.68 66.98 Favored 'General case' 0 CA--C 1.552 1.048 0 O-C-N 121.436 -0.79 . . . . 0.0 112.981 174.368 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -90.58 -1.81 57.88 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 125.953 1.701 . . . . 0.0 114.271 173.482 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 78.2 m -71.95 158.84 35.27 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 119.973 1.26 . . . . 0.0 112.112 171.418 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 . . . . . 0 C--O 1.255 1.35 0 C-N-CA 125.155 1.382 . . . . 0.0 113.497 179.669 . . . . . . . . 0 0 . 1 . 043 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . 0.25 48.7 p90 . . . . . 0 N--CA 1.481 1.12 0 CA-C-O 117.107 -1.425 . . . . 0.0 113.267 . . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 3.5 p -176.29 -51.47 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 CA-C-N 121.228 1.831 . . . . 0.0 113.512 178.066 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 63.7 t30 -120.48 99.76 6.75 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 123.945 0.898 . . . . 0.0 110.158 -169.84 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 8.5 mt-30 -143.45 168.38 19.98 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 124.795 1.238 . . . . 0.0 113.056 -166.255 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 26.2 m-70 -77.54 135.34 38.19 Favored 'General case' 0 CA--C 1.549 0.926 0 N-CA-C 108.339 -0.985 . . . . 0.0 108.339 166.159 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 87.8 mt -144.1 128.51 17.93 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 125.961 1.704 . . . . 0.0 109.343 177.874 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 5.6 t -145.8 145.29 30.74 Favored 'General case' 0 N--CA 1.469 0.504 0 O-C-N 121.335 -0.853 . . . . 0.0 112.174 -179.495 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.08 -125.85 36.99 Favored Glycine 0 N--CA 1.469 0.842 0 C-N-CA 124.395 0.998 . . . . 0.0 113.354 175.926 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 28.9 p -56.4 -35.79 68.16 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.763 1.225 . . . . 0.0 113.448 178.487 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 94.8 m-70 -68.26 -39.71 82.11 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 120.78 -1.2 . . . . 0.0 111.945 176.872 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 38.4 tp -68.13 -42.7 79.8 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 123.734 0.813 . . . . 0.0 111.308 174.41 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 40.9 t -61.37 -42.21 92.82 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.973 0 C-N-CA 124.095 0.958 . . . . 0.0 111.315 174.878 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -63.93 -44.9 91.47 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 123.829 0.852 . . . . 0.0 111.528 174.537 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.79 -39.33 91.31 Favored 'General case' 0 CA--C 1.541 0.599 0 O-C-N 121.466 -0.771 . . . . 0.0 112.117 175.988 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 70.1 mt -66.08 -40.05 90.54 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 118.526 -0.749 . . . . 0.0 112.194 174.039 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 19.4 m-85 -60.18 -40.42 89.94 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 120.363 1.438 . . . . 0.0 112.236 170.943 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 81.0 mt -68.07 -44.69 75.73 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.632 0.773 . . . . 0.0 112.47 177.336 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 53.0 t -73.46 -47.82 44.03 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 123.725 0.81 . . . . 0.0 112.181 -179.258 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 56.7 m -80.84 -32.07 35.26 Favored 'General case' 0 N--CA 1.47 0.544 0 N-CA-C 113.227 0.825 . . . . 0.0 113.227 -174.205 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 66.75 -138.34 35.33 Favored Glycine 0 CA--C 1.53 1.0 0 C-N-CA 124.137 0.875 . . . . 0.0 111.999 -177.934 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -62.26 -21.39 65.15 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 124.775 1.23 . . . . 0.0 113.258 -178.684 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 89.4 mtm180 -61.79 -35.75 79.08 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.151 0.981 . . . . 0.0 112.939 178.326 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.68 -175.73 49.39 Favored Glycine 0 CA--C 1.533 1.21 0 C-N-CA 124.131 0.872 . . . . 0.0 113.033 -171.232 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 2.0 p90 -130.03 167.68 17.91 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.146 1.378 . . . . 0.0 114.48 -170.442 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 58.1 t80 -93.38 1.53 56.87 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 127.303 2.241 . . . . 0.0 113.125 176.837 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 76.7 t80 -52.05 141.46 18.2 Favored 'General case' 0 CA--C 1.546 0.798 0 N-CA-C 115.753 1.761 . . . . 0.0 115.753 -171.902 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -162.97 127.37 1.96 Allowed Pre-proline 0 N--CA 1.47 0.573 0 C-N-CA 127.347 2.259 . . . . 0.0 108.0 170.463 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -70.5 145.66 53.47 Favored 'Trans proline' 0 C--N 1.35 0.641 0 C-N-CA 123.2 2.6 . . . . 0.0 113.434 -169.033 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 35.9 mmtm -128.91 1.41 5.34 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 125.579 1.552 . . . . 0.0 113.056 173.481 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 12.7 p -97.27 -60.93 1.48 Allowed 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 127.52 2.328 . . . . 0.0 110.156 -178.483 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 23.0 ptmt -82.81 -3.61 56.93 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 125.662 1.585 . . . . 0.0 114.43 176.447 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 79.1 ttt180 . . . . . 0 C--O 1.252 1.203 0 C-N-CA 127.278 2.231 . . . . 0.0 110.867 -175.93 . . . . . . . . 0 0 . 1 . 044 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.353 0 N-CA-C 112.216 -0.353 . . . . 0.0 112.216 . . . . . . . . . 0 0 . 1 . 044 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 9.6 tp -92.62 -36.52 7.71 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 C-N-CA 124.33 1.052 . . . . 0.0 113.647 -175.488 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 41.5 t -68.49 -35.33 70.03 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.107 0 CA-C-N 120.02 1.282 . . . . 0.0 111.092 -172.625 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.3 pm0 -69.97 -9.9 56.74 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 113.64 0.978 . . . . 0.0 113.64 174.884 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 60.5 mt-30 -93.96 -58.48 2.23 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 118.706 0.684 . . . . 0.0 109.199 169.716 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 86.7 m -76.42 -27.93 56.44 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 115.689 1.736 . . . . 0.0 115.689 -169.395 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 16.3 t -85.41 -49.51 8.05 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 118.404 0.547 . . . . 0.0 110.726 179.65 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 15.3 m -64.75 -38.23 90.29 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 126.248 1.819 . . . . 0.0 111.924 -178.197 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 65.8 m -142.92 -176.0 4.73 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 125.592 1.557 . . . . 0.0 111.405 -173.898 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 95.6 mt -79.38 122.77 35.27 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 O-C-N 120.252 -1.53 . . . . 0.0 108.174 168.057 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 20.8 p -100.77 157.08 16.97 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.934 0.893 . . . . 0.0 111.407 170.627 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 37.5 t -79.97 152.9 29.25 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 120.948 -1.095 . . . . 0.0 112.067 175.51 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.432 HD22 ' H ' ' A' ' 13' ' ' LEU . 2.6 mm? -62.11 -28.43 69.62 Favored 'General case' 0 CA--C 1.543 0.709 0 O-C-N 121.038 -1.039 . . . . 0.0 110.721 170.77 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.7 t80 -66.8 -30.96 71.28 Favored 'General case' 0 CA--C 1.542 0.654 0 O-C-N 121.324 -0.86 . . . . 0.0 112.996 170.435 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 94.7 mt-30 -76.16 -33.96 59.37 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 121.453 -0.779 . . . . 0.0 110.879 175.361 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 93.9 mt -59.2 -49.87 76.19 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 119.192 0.906 . . . . 0.0 110.19 168.479 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -62.79 -29.5 70.75 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 114.249 1.203 . . . . 0.0 114.249 176.48 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -63.01 -24.83 68.1 Favored 'General case' 0 CA--C 1.548 0.868 0 CA-C-N 119.527 1.058 . . . . 0.0 113.012 -179.306 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 52.9 m-85 -95.15 2.95 55.16 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.427 1.491 . . . . 0.0 113.624 173.732 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 95.4 m -103.76 124.72 49.41 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 121.218 -0.926 . . . . 0.0 112.966 179.753 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.252 1.225 0 C-N-CA 127.254 2.221 . . . . 0.0 112.843 -169.262 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 45.6 p90 . . . . . 0 N--CA 1.485 1.294 0 CA-C-O 119.745 -0.169 . . . . 0.0 110.887 . . . . . . . . . 0 0 . 1 . 044 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 22.4 m -138.03 151.14 25.08 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 C-N-CA 124.983 1.313 . . . . 0.0 111.093 171.638 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 60.8 t30 -77.92 179.69 6.58 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 124.233 1.013 . . . . 0.0 111.61 170.447 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 15.8 mp0 -107.68 169.89 8.32 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.828 1.651 . . . . 0.0 110.914 177.838 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 15.1 m-70 -71.28 139.62 50.05 Favored 'General case' 0 CA--C 1.545 0.763 0 O-C-N 121.376 -0.827 . . . . 0.0 109.013 167.481 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 73.7 mt -135.03 126.23 28.09 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 125.478 1.511 . . . . 0.0 108.875 179.699 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.6 t -144.36 150.02 37.1 Favored 'General case' 0 N--CA 1.47 0.538 0 O-C-N 121.691 -0.63 . . . . 0.0 112.02 -176.903 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 56.83 -128.79 47.94 Favored Glycine 0 CA--C 1.529 0.908 0 C-N-CA 124.344 0.973 . . . . 0.0 113.588 174.244 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 26.5 p -56.43 -37.48 70.27 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.853 1.261 . . . . 0.0 113.044 177.516 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 68.4 m-70 -73.51 -29.26 62.37 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 119.615 1.098 . . . . 0.0 112.689 177.452 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 39.5 tp -71.93 -42.42 66.7 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 121.144 -0.973 . . . . 0.0 111.402 170.654 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 21.7 t -57.64 -47.91 84.48 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 C-N-CA 124.285 1.034 . . . . 0.0 110.896 171.286 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -58.37 -47.56 83.42 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.542 1.537 . . . . 0.0 111.677 174.589 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.86 -43.68 98.14 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 118.671 0.669 . . . . 0.0 112.21 177.778 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 44.8 mt -61.04 -42.75 99.06 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 118.619 0.645 . . . . 0.0 111.454 176.384 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 16.8 m-85 -61.22 -45.28 95.22 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.046 0.839 . . . . 0.0 112.491 172.776 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 78.2 mt -68.06 -42.6 80.21 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.788 0.835 . . . . 0.0 112.966 -179.5 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 54.6 t -73.99 -44.69 50.44 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 124.524 1.13 . . . . 0.0 111.606 -178.079 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 65.9 m -99.71 -18.93 17.01 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 114.984 1.475 . . . . 0.0 114.984 -169.896 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 61.72 -133.07 47.11 Favored Glycine 0 CA--C 1.533 1.158 0 CA-C-N 118.973 0.806 . . . . 0.0 112.633 177.571 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 5.3 pm0 -66.93 -11.97 58.05 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.7 1.6 . . . . 0.0 115.223 -176.799 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 69.8 mtp180 -60.22 -38.01 82.05 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.859 0.863 . . . . 0.0 112.478 176.134 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.62 166.62 9.6 Favored Glycine 0 CA--C 1.536 1.362 0 C-N-CA 124.087 0.851 . . . . 0.0 112.364 -170.393 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 47.6 p90 -130.83 147.79 52.53 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.019 1.328 . . . . 0.0 112.98 -174.479 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 39.4 t80 -94.37 91.43 6.68 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 125.789 1.636 . . . . 0.0 109.457 172.424 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 15.9 t80 -71.36 127.81 33.82 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 121.718 -0.614 . . . . 0.0 111.597 -177.156 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 3.9 p -136.83 108.02 9.06 Favored Pre-proline 0 N--CA 1.477 0.908 0 C-N-CA 124.974 1.31 . . . . 0.0 110.394 -172.934 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -81.87 170.96 13.51 Favored 'Trans proline' 0 C--N 1.355 0.881 0 C-N-CA 124.481 3.454 . . . . 0.0 113.654 -170.355 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 27.4 mtpp -61.79 -23.5 66.24 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 124.529 1.132 . . . . 0.0 113.917 176.064 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 2.2 t -88.0 -2.93 58.91 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 126.424 1.89 . . . . 0.0 113.243 174.413 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 82.3 tttt 76.64 -49.97 0.57 Allowed 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 128.926 2.891 . . . . 0.0 113.354 177.479 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 72.9 ttp85 . . . . . 0 C--O 1.252 1.233 0 C-N-CA 126.793 2.037 . . . . 0.0 111.667 -179.998 . . . . . . . . 0 0 . 1 . 045 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.44 0 N-CA-C 110.512 -1.035 . . . . 0.0 110.512 . . . . . . . . . 0 0 . 1 . 045 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 20.1 tt -165.35 -47.17 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.219 0 C-N-CA 124.493 1.117 . . . . 0.0 112.474 -177.292 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . 0.562 HG21 ' HA ' ' B' ' 28' ' ' PRO . 58.0 t -58.74 -44.92 91.18 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.058 0 C-N-CA 124.367 1.067 . . . . 0.0 110.408 -177.003 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.0 pm0 -66.63 -11.31 53.08 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.633 1.573 . . . . 0.0 113.819 177.671 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 26.3 mm100 -95.27 -53.11 3.9 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.457 1.103 . . . . 0.0 109.561 168.833 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 84.8 m -61.06 -34.91 75.64 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.939 1.296 . . . . 0.0 114.153 -174.749 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 72.7 m -72.79 -46.08 55.17 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 121.244 -0.91 . . . . 0.0 111.147 174.995 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 21.7 m -77.15 -32.33 56.23 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 126.723 2.009 . . . . 0.0 112.849 -170.442 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.4 t -150.91 -168.96 3.25 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 126.069 1.748 . . . . 0.0 110.865 -176.167 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 62.5 mt -79.45 136.08 24.35 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 O-C-N 120.681 -1.262 . . . . 0.0 110.322 175.658 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.6 p -127.28 160.69 30.56 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.311 1.044 . . . . 0.0 112.402 173.731 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 33.5 t -101.26 154.02 19.12 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 114.194 1.183 . . . . 0.0 114.194 -168.848 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 32.2 mt -62.21 -30.64 71.23 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.139 0.976 . . . . 0.0 111.702 174.121 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 87.5 t80 -61.6 -34.72 76.12 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 123.695 0.798 . . . . 0.0 112.716 171.985 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 58.8 mt-30 -72.1 -43.74 64.31 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.423 0.689 . . . . 0.0 109.797 176.363 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 95.3 mt -57.23 -49.45 76.0 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 122.979 0.512 . . . . 0.0 111.734 174.411 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -62.77 -28.35 69.92 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 113.243 0.831 . . . . 0.0 113.243 178.166 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -81.19 -38.94 26.24 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 124.221 1.008 . . . . 0.0 112.942 179.039 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 20.7 m-85 -84.58 -6.46 59.37 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 114.55 1.315 . . . . 0.0 114.55 179.64 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 39.4 t -70.72 174.38 6.05 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 124.45 1.1 . . . . 0.0 112.07 168.076 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 14.6 t-20 . . . . . 0 C--O 1.251 1.178 0 C-N-CA 125.304 1.442 . . . . 0.0 113.313 -176.645 . . . . . . . . 0 0 . 1 . 045 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 34.1 t80 . . . . . 0 N--CA 1.487 1.381 0 CA-C-O 119.884 -0.103 . . . . 0.0 111.017 . . . . . . . . . 0 0 . 1 . 045 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 19.1 t -79.37 -19.92 12.6 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.362 0 O-C-N 120.784 -1.198 . . . . 0.0 113.049 -169.75 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 24.2 t30 -60.92 94.85 0.03 OUTLIER 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 125.586 1.554 . . . . 0.0 111.424 174.955 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -153.03 -170.69 3.7 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 126.415 1.886 . . . . 0.0 110.516 -168.804 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 19.9 m-70 -75.3 146.26 41.14 Favored 'General case' 0 CA--C 1.546 0.814 0 O-C-N 120.846 -1.159 . . . . 0.0 109.54 167.442 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 61.2 mt -146.5 133.02 19.73 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 126.535 1.934 . . . . 0.0 109.201 174.874 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.1 t -145.46 150.47 36.56 Favored 'General case' 0 N--CA 1.468 0.438 0 O-C-N 121.189 -0.944 . . . . 0.0 113.013 179.928 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 57.04 -129.99 50.29 Favored Glycine 0 N--CA 1.469 0.884 0 C-N-CA 124.929 1.252 . . . . 0.0 113.864 172.4 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 17.4 p -54.72 -43.28 72.46 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 124.348 1.059 . . . . 0.0 112.409 175.566 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -65.48 -34.83 79.19 Favored 'General case' 0 CA--C 1.542 0.666 0 O-C-N 121.117 -0.989 . . . . 0.0 112.256 178.919 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 62.2 tp -67.34 -44.87 78.03 Favored 'General case' 0 C--O 1.222 -0.371 0 CA-C-O 118.033 -0.984 . . . . 0.0 111.259 171.203 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 54.3 t -62.24 -43.41 97.93 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.078 0 CA-C-N 119.643 1.111 . . . . 0.0 111.25 178.975 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.1 mm-40 -60.79 -51.28 70.01 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 123.689 0.795 . . . . 0.0 111.224 173.8 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.89 -43.44 92.9 Favored 'General case' 0 CA--C 1.534 0.339 0 O-C-N 121.551 -0.718 . . . . 0.0 111.934 -177.5 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 62.0 tp -55.25 -47.14 75.85 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 125.339 1.456 . . . . 0.0 111.184 177.697 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -72.69 -39.34 67.12 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 119.134 0.879 . . . . 0.0 112.365 177.996 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 74.9 mt -66.92 -41.21 87.44 Favored 'General case' 0 N--CA 1.474 0.754 0 CA-C-N 118.95 0.796 . . . . 0.0 112.816 179.845 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 54.7 t -68.39 -34.86 68.17 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 C-N-CA 124.992 1.317 . . . . 0.0 111.566 176.33 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 42.7 t -80.97 -34.07 33.38 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 114.261 1.208 . . . . 0.0 114.261 -179.15 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 86.03 -145.34 20.64 Favored Glycine 0 CA--C 1.533 1.182 0 C-N-CA 125.197 1.38 . . . . 0.0 113.42 179.786 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -59.27 -22.75 61.63 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 126.232 1.813 . . . . 0.0 114.593 -169.593 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 71.3 mtp180 -52.33 -38.33 58.36 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 125.419 1.487 . . . . 0.0 113.176 175.496 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.04 148.84 3.02 Favored Glycine 0 CA--C 1.533 1.186 0 C-N-CA 125.101 1.334 . . . . 0.0 112.263 -174.085 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 27.2 p90 -71.56 168.29 17.92 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 113.993 1.108 . . . . 0.0 113.993 -175.079 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 73.5 t80 -136.96 -60.34 0.69 Allowed 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.854 1.262 . . . . 0.0 111.96 -177.486 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 15.6 t80 -74.16 114.15 12.17 Favored 'General case' 0 CA--C 1.546 0.814 0 O-C-N 121.75 -0.594 . . . . 0.0 112.373 -172.672 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 23.3 p -78.29 155.43 79.37 Favored Pre-proline 0 N--CA 1.48 1.029 0 C-N-CA 125.85 1.66 . . . . 0.0 112.167 -178.686 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . 0.562 ' HA ' HG21 ' A' ' 3' ' ' VAL . 60.1 Cg_endo -73.27 108.04 2.52 Favored 'Trans proline' 0 C--N 1.352 0.723 0 C-N-CA 123.537 2.825 . . . . 0.0 111.47 -176.88 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt -76.56 -24.83 53.56 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 114.223 1.194 . . . . 0.0 114.223 -169.69 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 6.2 t -92.54 -30.57 15.6 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 125.119 1.368 . . . . 0.0 113.027 -177.077 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm -91.02 -19.85 22.75 Favored 'General case' 0 CA--C 1.547 0.857 0 N-CA-C 114.461 1.282 . . . . 0.0 114.461 -178.226 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 32.0 tpt180 . . . . . 0 C--O 1.252 1.221 0 C-N-CA 124.751 1.22 . . . . 0.0 112.133 176.566 . . . . . . . . 0 0 . 1 . 046 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.296 0 N-CA-C 111.239 -0.744 . . . . 0.0 111.239 . . . . . . . . . 0 0 . 1 . 046 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 11.3 tt -72.32 -41.54 65.62 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.988 0 N-CA-C 113.042 0.756 . . . . 0.0 113.042 -173.379 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 9.8 p -68.78 -28.12 38.58 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 O-C-N 121.64 -0.662 . . . . 0.0 111.827 -176.596 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 37.2 mp0 -68.75 -12.9 61.99 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 123.853 0.861 . . . . 0.0 113.045 173.018 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 5.5 tp60 -97.99 -58.35 2.0 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.022 0.929 . . . . 0.0 110.347 169.199 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 34.7 m -70.77 -27.13 63.69 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 114.675 1.361 . . . . 0.0 114.675 -170.095 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 10.6 t -81.28 -38.8 26.24 Favored 'General case' 0 N--CA 1.472 0.646 0 O-C-N 120.868 -1.145 . . . . 0.0 111.105 175.288 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 28.7 m -69.61 -38.99 77.49 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 126.881 2.072 . . . . 0.0 112.586 -177.614 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 21.5 m -143.52 166.41 24.88 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 124.711 1.205 . . . . 0.0 111.304 -178.035 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 70.0 mt -58.93 128.78 20.2 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 O-C-N 121.129 -0.982 . . . . 0.0 109.326 169.447 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 15.1 p -120.37 154.6 34.86 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 122.066 0.936 . . . . 0.0 112.29 175.926 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 47.4 t -98.01 153.85 18.1 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 124.497 1.119 . . . . 0.0 112.621 -174.103 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 10.7 mp -61.61 -26.94 68.3 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.861 0.864 . . . . 0.0 111.503 174.21 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 93.5 t80 -59.31 -37.92 78.95 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 123.574 0.75 . . . . 0.0 112.669 169.582 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 68.9 mt-30 -75.62 -39.81 57.3 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 124.155 0.982 . . . . 0.0 110.567 178.418 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 78.6 mt -58.68 -53.76 54.71 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.128 0.971 . . . . 0.0 111.201 172.702 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -66.13 -30.34 70.82 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 -179.98 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 20.1 t30 -66.15 -33.03 74.84 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 118.927 0.785 . . . . 0.0 112.326 172.678 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -73.96 -33.23 63.8 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.03 0.932 . . . . 0.0 112.652 172.856 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 87.5 m -71.17 177.15 3.97 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 125.451 1.5 . . . . 0.0 114.655 176.866 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 31.2 m120 . . . . . 0 C--O 1.256 1.431 0 C-N-CA 125.549 1.54 . . . . 0.0 112.021 170.44 . . . . . . . . 0 0 . 1 . 046 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 41.2 t80 . . . . . 0 N--CA 1.487 1.41 0 CA-C-O 119.549 -0.262 . . . . 0.0 111.044 . . . . . . . . . 0 0 . 1 . 046 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 27.4 m -75.32 -36.37 36.08 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.42 0 O-C-N 121.209 -0.932 . . . . 0.0 113.366 -174.785 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -84.02 104.63 14.24 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.673 1.189 . . . . 0.0 108.022 169.268 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -169.73 -177.11 2.58 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.712 1.205 . . . . 0.0 110.336 -167.905 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 26.2 m-70 -71.83 136.74 47.14 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 164.472 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 84.4 mt -138.84 128.83 25.21 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 126.142 1.777 . . . . 0.0 109.176 -179.831 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.3 t -141.48 133.67 27.89 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 112.77 0.656 . . . . 0.0 112.77 -171.407 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 60.05 -126.88 42.81 Favored Glycine 0 CA--C 1.528 0.845 0 C-N-CA 124.361 0.982 . . . . 0.0 113.241 175.059 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 18.8 m -55.21 -32.81 62.53 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.281 1.032 . . . . 0.0 113.069 177.769 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 32.4 m80 -68.46 -39.0 81.58 Favored 'General case' 0 CA--C 1.542 0.662 0 O-C-N 121.043 -1.036 . . . . 0.0 111.732 177.465 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 32.1 tp -71.38 -41.26 69.87 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 124.255 1.022 . . . . 0.0 111.086 175.618 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 64.5 t -60.74 -43.29 94.86 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 123.597 0.759 . . . . 0.0 110.953 173.004 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -64.66 -41.77 95.86 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 123.643 0.777 . . . . 0.0 111.922 174.305 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.37 -45.26 94.14 Favored 'General case' 0 CA--C 1.535 0.399 0 O-C-N 121.568 -0.708 . . . . 0.0 111.483 174.396 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 51.6 mt -58.69 -44.1 90.19 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 123.627 0.771 . . . . 0.0 111.838 174.893 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 4.6 m-85 -56.01 -50.77 69.96 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.514 0.726 . . . . 0.0 112.126 172.593 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 8.4 mp -71.03 -42.23 69.79 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 123.522 0.729 . . . . 0.0 112.649 -176.573 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 69.2 t -76.02 -40.19 37.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 C-N-CA 124.624 1.17 . . . . 0.0 111.886 -174.224 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 58.5 m -95.61 -18.21 20.74 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 113.697 0.999 . . . . 0.0 113.697 -174.828 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 62.45 -140.32 46.19 Favored Glycine 0 CA--C 1.532 1.136 0 C-N-CA 124.761 1.172 . . . . 0.0 114.073 168.928 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -68.22 -13.95 62.62 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 124.951 1.3 . . . . 0.0 114.153 -174.111 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 57.0 mtm-85 -67.68 -26.08 66.01 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 123.867 0.867 . . . . 0.0 112.663 176.662 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.2 168.38 44.21 Favored Glycine 0 CA--C 1.531 1.051 0 C-N-CA 125.059 1.314 . . . . 0.0 112.908 -171.458 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 39.9 p90 -135.02 170.6 15.66 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.267 1.427 . . . . 0.0 112.437 -179.199 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 65.6 t80 -129.52 148.87 51.46 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.344 1.458 . . . . 0.0 110.169 172.021 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 63.2 t80 -156.8 125.21 5.7 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.743 1.217 . . . . 0.0 110.956 -174.437 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 50.3 m -152.17 124.41 3.92 Favored Pre-proline 0 N--CA 1.474 0.753 0 C-N-CA 124.869 1.268 . . . . 0.0 109.782 177.534 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -84.39 161.44 12.97 Favored 'Trans proline' 0 CA--C 1.536 0.618 0 C-N-CA 123.937 3.091 . . . . 0.0 111.056 169.401 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 58.2 tptt -59.16 -26.34 64.68 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.308 1.043 . . . . 0.0 113.245 177.522 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 31.2 p -72.02 -26.99 62.43 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 125.85 1.66 . . . . 0.0 113.624 178.001 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -109.36 -11.33 14.86 Favored 'General case' 0 N--CA 1.477 0.894 0 N-CA-C 114.563 1.32 . . . . 0.0 114.563 -176.848 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 75.6 ttt180 . . . . . 0 C--O 1.252 1.223 0 C-N-CA 124.859 1.263 . . . . 0.0 112.19 177.135 . . . . . . . . 0 0 . 1 . 047 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.42 0 N-CA-C 110.467 -1.053 . . . . 0.0 110.467 . . . . . . . . . 0 0 . 1 . 047 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 19.4 tt -166.21 -53.94 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 C-N-CA 125.687 1.595 . . . . 0.0 112.756 178.919 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 13.4 p -63.07 -31.91 54.31 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.129 0 CA-C-N 119.156 0.889 . . . . 0.0 112.523 -176.177 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 6.0 pm0 -72.46 -5.09 34.29 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.854 1.261 . . . . 0.0 113.618 175.768 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 47.2 tp60 -107.82 -52.83 2.71 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.257 1.423 . . . . 0.0 109.211 168.183 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 95.3 m -59.59 -35.1 73.63 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 114.238 1.199 . . . . 0.0 114.238 -175.423 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 19.0 t -82.74 -33.11 27.56 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 113.14 0.793 . . . . 0.0 113.14 -172.689 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 27.5 p -100.48 -26.85 13.71 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 126.388 1.875 . . . . 0.0 112.875 -175.701 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.7 t -138.98 -160.74 1.1 Allowed 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 126.114 1.766 . . . . 0.0 110.137 179.632 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 72.1 mt -97.81 140.03 18.8 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.71 0 O-C-N 120.546 -1.347 . . . . 0.0 110.109 -177.535 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 15.1 p -134.51 161.85 33.91 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 124.595 1.158 . . . . 0.0 112.66 173.983 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 60.1 p -109.16 165.64 11.45 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 115.174 1.546 . . . . 0.0 115.174 -170.647 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 11.0 mp -65.3 -30.25 71.09 Favored 'General case' 0 N--CA 1.47 0.549 0 O-C-N 121.454 -0.779 . . . . 0.0 111.726 171.831 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 80.1 t80 -63.63 -31.73 72.99 Favored 'General case' 0 CA--C 1.543 0.698 0 O-C-N 121.462 -0.774 . . . . 0.0 112.717 172.54 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 84.9 mt-30 -75.4 -36.34 60.86 Favored 'General case' 0 CA--C 1.537 0.46 0 O-C-N 121.483 -0.761 . . . . 0.0 111.495 172.593 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 86.7 mt -62.11 -42.11 98.9 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 119.374 0.988 . . . . 0.0 111.866 171.778 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -58.61 -27.11 64.37 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.748 1.219 . . . . 0.0 113.807 176.856 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.8 t30 -59.24 -28.01 66.3 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-N 119.125 0.875 . . . . 0.0 113.27 179.155 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 82.2 m-85 -100.55 6.98 44.33 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.508 1.523 . . . . 0.0 113.959 -178.522 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 54.2 m -89.39 153.42 20.86 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.194 0.998 . . . . 0.0 112.573 172.814 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.254 1.313 0 C-N-CA 126.589 1.956 . . . . 0.0 112.349 178.679 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . 0.263 12.0 p90 . . . . . 0 N--CA 1.486 1.352 0 CA-C-O 118.45 -0.786 . . . . 0.0 110.591 . . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 73.1 t -82.36 142.58 13.45 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.287 0 CA-C-N 120.203 1.365 . . . . 0.0 110.079 171.541 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -158.14 147.5 19.57 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 126.039 1.736 . . . . 0.0 112.551 177.57 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -162.54 170.62 18.32 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.825 1.25 . . . . 0.0 111.644 -170.304 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 96.6 m-70 -80.01 139.3 37.04 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 108.334 -0.988 . . . . 0.0 108.334 165.389 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 83.1 mt -148.76 133.81 18.19 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 125.24 1.416 . . . . 0.0 110.367 -179.581 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.6 t -152.36 147.64 26.54 Favored 'General case' 0 N--CA 1.473 0.693 0 O-C-N 121.112 -0.993 . . . . 0.0 113.078 178.183 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 57.88 -129.97 50.32 Favored Glycine 0 CA--C 1.528 0.861 0 C-N-CA 124.517 1.056 . . . . 0.0 112.79 176.174 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.4 m -54.29 -32.36 56.18 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 124.784 1.233 . . . . 0.0 113.335 177.46 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 24.0 m80 -70.81 -41.06 72.09 Favored 'General case' 0 CA--C 1.539 0.52 0 O-C-N 121.33 -0.857 . . . . 0.0 111.628 178.24 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 52.2 tp -67.84 -44.84 76.25 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 123.796 0.839 . . . . 0.0 110.52 174.395 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 25.6 t -56.37 -44.94 81.29 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.99 0 C-N-CA 124.499 1.12 . . . . 0.0 111.22 173.804 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -63.99 -41.77 97.41 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.174 0.59 . . . . 0.0 111.903 174.376 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.34 -41.0 98.21 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 118.881 0.764 . . . . 0.0 112.495 176.05 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -60.6 -46.26 90.93 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 119.234 0.925 . . . . 0.0 111.047 171.084 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 21.5 m-85 -61.81 -34.86 76.68 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 119.978 1.263 . . . . 0.0 113.137 176.117 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 71.9 mt -70.71 -43.99 67.84 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 123.783 0.833 . . . . 0.0 112.195 175.359 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 72.0 t -75.86 -40.9 39.31 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 CA-C-N 118.634 0.652 . . . . 0.0 112.021 -178.057 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 50.8 m -85.2 -23.31 28.35 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 114.011 1.115 . . . . 0.0 114.011 -179.104 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 79.53 -162.47 47.47 Favored Glycine 0 CA--C 1.53 0.999 0 C-N-CA 124.85 1.214 . . . . 0.0 112.673 -173.801 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -61.98 -11.84 15.44 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 125.053 1.341 . . . . 0.0 114.513 -178.58 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 87.9 mtm180 -60.02 -27.54 66.99 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 125.04 1.336 . . . . 0.0 113.537 173.786 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.05 -167.01 54.2 Favored Glycine 0 CA--C 1.533 1.182 0 C-N-CA 124.224 0.916 . . . . 0.0 112.05 -169.727 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 22.9 p90 -138.94 157.65 45.64 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.713 1.205 . . . . 0.0 113.969 -169.871 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 59.4 t80 -87.66 -14.46 39.91 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 126.265 1.826 . . . . 0.0 113.098 174.029 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 18.4 t80 -54.2 143.97 21.31 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 125.285 1.434 . . . . 0.0 113.562 178.27 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 15.3 t -153.89 141.21 13.46 Favored Pre-proline 0 CA--C 1.541 0.632 0 C-N-CA 127.382 2.273 . . . . 0.0 108.335 172.717 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -68.65 152.95 74.27 Favored 'Trans proline' 0 C--N 1.35 0.631 0 C-N-CA 122.637 2.225 . . . . 0.0 112.708 -171.923 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.15 -16.67 62.37 Favored 'General case' 0 CA--C 1.549 0.942 0 N-CA-C 114.691 1.367 . . . . 0.0 114.691 -174.432 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 12.9 m -67.53 -41.99 83.47 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 127.178 2.191 . . . . 0.0 111.645 -173.31 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 2.2 mtmm 172.86 150.46 0.07 Allowed 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 128.754 2.822 . . . . 0.0 111.485 178.175 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 40.7 ptt180 . . . . . 0 C--O 1.253 1.286 0 C-N-CA 125.382 1.473 . . . . 0.0 113.335 175.744 . . . . . . . . 0 0 . 1 . 048 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.647 0 N-CA-C 112.436 -0.265 . . . . 0.0 112.436 . . . . . . . . . 0 0 . 1 . 048 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 11.0 tp -74.44 -43.55 49.0 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.297 0 N-CA-C 114.031 1.123 . . . . 0.0 114.031 -170.581 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 70.3 t -57.53 -52.87 51.73 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.331 0 C-N-CA 124.622 1.169 . . . . 0.0 110.096 -177.876 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 25.6 pt-20 -66.55 0.76 2.05 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 125.468 1.507 . . . . 0.0 114.968 -179.098 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 17.9 tt0 -115.9 -50.81 2.67 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 119.097 0.862 . . . . 0.0 111.365 168.725 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 58.8 m -60.97 -28.41 68.98 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 114.283 1.216 . . . . 0.0 114.283 -177.565 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 87.8 m -73.1 -31.02 64.08 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 179.331 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 29.4 p -112.05 -44.83 3.37 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 125.579 1.552 . . . . 0.0 112.527 -169.055 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 63.2 m -101.99 168.15 9.59 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 125.908 1.683 . . . . 0.0 111.054 172.854 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 7.0 tt -81.57 132.31 31.82 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 O-C-N 120.822 -1.174 . . . . 0.0 109.151 170.865 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 17.0 p -121.61 158.65 28.14 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.447 1.099 . . . . 0.0 112.441 -176.133 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 34.1 t -98.08 151.93 19.85 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 124.322 1.049 . . . . 0.0 112.763 -173.923 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 39.8 mt -59.68 -29.7 68.26 Favored 'General case' 0 N--CA 1.471 0.585 0 O-C-N 121.632 -0.668 . . . . 0.0 111.46 171.597 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.6 t80 -62.23 -32.36 73.02 Favored 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 113.147 0.795 . . . . 0.0 113.147 172.231 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 64.9 mt-30 -78.08 -34.0 50.48 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 123.617 0.767 . . . . 0.0 111.084 175.558 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 81.5 mt -60.38 -47.88 84.17 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 118.639 0.654 . . . . 0.0 110.753 169.876 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -62.0 -32.32 72.78 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 175.191 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 15.5 t30 -59.23 -33.01 70.49 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 119.464 1.029 . . . . 0.0 113.03 179.446 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 67.6 m-85 -92.99 -0.63 57.16 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.708 1.203 . . . . 0.0 113.925 177.283 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 92.9 m -82.9 154.25 24.69 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 121.249 -0.907 . . . . 0.0 112.907 173.131 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.25 1.082 0 C-N-CA 125.819 1.648 . . . . 0.0 112.908 -176.646 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 65.8 m-85 . . . . . 0 N--CA 1.488 1.447 0 CA-C-O 118.617 -0.706 . . . . 0.0 109.403 . . . . . . . . . 0 0 . 1 . 048 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 5.9 m -82.58 83.81 1.69 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 CA-C-N 120.149 1.34 . . . . 0.0 110.079 175.127 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 27.9 m120 -124.88 140.71 52.68 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.092 1.357 . . . . 0.0 112.462 -170.869 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -148.06 160.78 42.51 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.45 1.5 . . . . 0.0 111.99 -178.804 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 90.7 m-70 -99.49 130.05 45.71 Favored 'General case' 0 CA--C 1.543 0.673 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 166.506 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 54.3 mt -148.16 136.54 21.41 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 124.89 1.276 . . . . 0.0 110.077 -171.682 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.3 t -147.34 150.8 35.45 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 113.035 0.754 . . . . 0.0 113.035 -178.376 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 53.55 -130.4 42.14 Favored Glycine 0 N--CA 1.469 0.853 0 C-N-CA 124.523 1.059 . . . . 0.0 113.181 173.167 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 39.0 m -59.11 -34.14 71.68 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 123.556 0.742 . . . . 0.0 112.931 -179.365 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 18.1 m-70 -70.41 -32.17 69.69 Favored 'General case' 0 CA--C 1.538 0.483 0 O-C-N 120.621 -1.299 . . . . 0.0 113.172 175.446 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 42.9 tp -69.6 -40.07 76.88 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 118.688 0.676 . . . . 0.0 111.24 171.16 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 78.5 t -60.83 -45.8 97.38 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.078 0 C-N-CA 123.947 0.899 . . . . 0.0 110.911 172.739 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -58.42 -48.17 81.55 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 123.558 0.743 . . . . 0.0 111.4 172.757 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.7 -41.81 99.32 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 123.631 0.772 . . . . 0.0 112.229 -178.655 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 31.0 mt -58.45 -43.97 89.02 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 118.558 0.617 . . . . 0.0 111.412 174.929 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 9.4 m-85 -70.88 -31.9 68.71 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 113.764 1.024 . . . . 0.0 113.764 174.898 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 64.4 mt -71.62 -41.41 68.89 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 119.382 0.992 . . . . 0.0 112.017 175.478 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 54.5 t -73.15 -47.8 45.9 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 C-N-CA 124.527 1.131 . . . . 0.0 111.501 179.97 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 66.8 m -94.73 -10.58 31.19 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 114.815 1.413 . . . . 0.0 114.815 -172.996 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 82.03 -164.53 44.48 Favored Glycine 0 CA--C 1.53 1.001 0 C-N-CA 124.867 1.222 . . . . 0.0 112.836 -177.372 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -61.68 -11.32 11.31 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 114.801 1.408 . . . . 0.0 114.801 -178.601 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 53.6 mtm180 -56.34 -33.49 65.69 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 125.056 1.342 . . . . 0.0 112.878 171.811 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 66.04 -154.51 51.3 Favored Glycine 0 CA--C 1.535 1.299 0 C-N-CA 123.692 0.663 . . . . 0.0 112.07 -172.422 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 54.5 p90 -141.69 155.41 45.67 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.802 1.241 . . . . 0.0 113.276 -172.159 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 75.1 t80 -87.47 -28.53 22.01 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.831 1.252 . . . . 0.0 113.185 -172.939 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 50.7 t80 -62.36 149.45 42.31 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.808 1.243 . . . . 0.0 113.14 179.841 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 13.5 t -111.61 126.12 29.14 Favored Pre-proline 0 N--CA 1.474 0.727 0 C-N-CA 124.216 1.007 . . . . 0.0 109.363 171.359 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -75.47 138.52 22.03 Favored 'Trans proline' 0 N--CA 1.455 -0.753 0 C-N-CA 122.674 2.249 . . . . 0.0 111.31 -171.118 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 18.9 ptmt -69.18 -15.7 63.46 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 113.362 0.875 . . . . 0.0 113.362 176.009 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 5.5 t -101.8 90.61 4.07 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 126.375 1.87 . . . . 0.0 107.831 168.182 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -83.56 132.82 34.89 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 123.601 0.76 . . . . 0.0 111.09 178.444 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 13.8 mtm105 . . . . . 0 N--CA 1.483 1.212 0 C-N-CA 126.488 1.915 . . . . 0.0 111.245 -173.098 . . . . . . . . 0 0 . 1 . 049 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.698 0 N-CA-C 110.71 -0.956 . . . . 0.0 110.71 . . . . . . . . . 0 0 . 1 . 049 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 20.7 tt -56.16 -34.86 40.3 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.13 0 N-CA-C 114.783 1.401 . . . . 0.0 114.783 -170.287 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 74.1 t -59.94 -40.86 84.15 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.028 0 C-N-CA 123.253 0.621 . . . . 0.0 111.166 -175.638 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -81.86 -2.75 52.16 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 113.149 0.796 . . . . 0.0 113.149 -179.509 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 20.8 tt0 -94.55 -58.72 2.11 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 123.56 0.744 . . . . 0.0 109.706 169.351 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 85.8 m -72.19 -30.37 64.9 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 113.962 1.097 . . . . 0.0 113.962 -170.054 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 71.2 m -69.93 -46.45 65.31 Favored 'General case' 0 N--CA 1.473 0.701 0 O-C-N 120.752 -1.218 . . . . 0.0 110.706 173.371 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 21.0 m -76.86 -37.95 54.62 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 126.756 2.023 . . . . 0.0 112.871 -170.084 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.7 t -144.19 -169.19 3.06 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.963 1.305 . . . . 0.0 111.77 -174.897 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 61.2 mt -79.91 127.27 39.37 Favored 'Isoleucine or valine' 0 C--O 1.238 0.448 0 O-C-N 120.818 -1.176 . . . . 0.0 111.707 -172.719 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 4.2 m -112.5 171.33 7.58 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 127.013 2.125 . . . . 0.0 110.832 168.166 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 35.4 t -163.34 163.26 25.22 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 126.422 1.889 . . . . 0.0 108.21 -170.715 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 9.8 mp -56.98 -33.71 67.35 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 119.231 0.923 . . . . 0.0 111.976 -176.092 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 73.2 t80 -61.11 -33.09 72.82 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 124.294 1.038 . . . . 0.0 113.572 173.4 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 36.9 mt-30 -86.8 -32.25 20.44 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 125.196 1.398 . . . . 0.0 111.333 177.682 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 96.1 mt -65.46 -50.56 64.88 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.624 1.17 . . . . 0.0 110.679 173.567 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -66.48 -23.23 66.23 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 113.35 0.87 . . . . 0.0 113.35 179.416 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 19.4 t30 -59.93 -29.74 68.59 Favored 'General case' 0 CA--C 1.545 0.788 0 O-C-N 121.118 -0.989 . . . . 0.0 113.031 177.427 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 51.9 m-85 -94.47 5.5 51.62 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.565 1.546 . . . . 0.0 113.717 176.946 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 75.0 m -101.09 129.1 46.92 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.016 0.927 . . . . 0.0 112.7 -179.646 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.252 1.211 0 C-N-CA 128.086 2.554 . . . . 0.0 112.393 -169.495 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 . . . . . 0 N--CA 1.486 1.338 0 CA-C-O 119.75 -0.167 . . . . 0.0 111.109 . . . . . . . . . 0 0 . 1 . 049 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 88.1 t -78.01 141.12 15.94 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.207 0 C-N-CA 124.721 1.208 . . . . 0.0 109.583 172.437 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 5.8 p-10 -134.0 158.36 43.71 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 124.919 1.288 . . . . 0.0 113.614 -174.427 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 2.6 mm-40 -176.2 -172.7 0.5 Allowed 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 127.417 2.287 . . . . 0.0 108.779 -173.052 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 5.9 m-70 -83.44 -105.37 0.04 OUTLIER 'General case' 0 CA--C 1.549 0.923 0 O-C-N 120.457 -1.402 . . . . 0.0 107.912 166.497 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 57.2 mt 113.17 124.48 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.946 1 C-N-CA 131.879 4.072 . . . . 0.0 109.425 171.478 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 5.8 t -146.31 154.12 41.32 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.194 0.598 . . . . 0.0 112.431 -175.285 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 59.58 -136.29 50.58 Favored Glycine 0 N--CA 1.471 0.99 0 C-N-CA 123.801 0.715 . . . . 0.0 113.278 172.557 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 14.4 p -54.08 -36.99 63.75 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 124.541 1.136 . . . . 0.0 112.988 173.49 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 -69.67 -33.28 72.34 Favored 'General case' 0 CA--C 1.544 0.731 0 O-C-N 121.139 -0.975 . . . . 0.0 112.384 -179.751 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 53.7 tp -68.88 -42.48 76.92 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 118.562 0.619 . . . . 0.0 110.945 171.197 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 60.3 t -59.15 -46.77 91.79 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 C-N-CA 124.053 0.941 . . . . 0.0 111.064 174.488 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -65.69 -41.54 92.29 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 123.703 0.801 . . . . 0.0 112.137 176.679 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.75 -43.74 97.59 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 119.279 0.945 . . . . 0.0 111.529 174.823 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 62.5 mt -64.25 -40.22 95.55 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 118.299 0.499 . . . . 0.0 112.155 177.035 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 7.2 m-85 -58.14 -47.88 81.98 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.107 0.867 . . . . 0.0 111.86 170.744 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 78.5 mt -69.8 -41.63 74.78 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 124.146 0.979 . . . . 0.0 112.661 -177.156 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 60.6 t -76.82 -44.1 32.92 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 C-N-CA 123.754 0.822 . . . . 0.0 111.892 -177.268 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 73.7 m -95.9 -27.56 15.11 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 114.73 1.381 . . . . 0.0 114.73 -172.654 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 66.16 -134.76 34.14 Favored Glycine 0 N--CA 1.469 0.866 0 C-N-CA 124.216 0.913 . . . . 0.0 112.676 176.318 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -63.96 -17.92 63.76 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.248 1.419 . . . . 0.0 113.636 -177.847 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 84.9 mtm180 -61.66 -29.25 69.95 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 179.286 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.59 157.98 9.66 Favored Glycine 0 CA--C 1.534 1.234 0 C-N-CA 124.662 1.125 . . . . 0.0 113.144 -177.862 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 51.6 p90 -137.37 152.55 49.8 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.246 1.418 . . . . 0.0 113.334 -172.078 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 24.7 t80 -105.69 68.94 0.81 Allowed 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.748 1.619 . . . . 0.0 111.282 -179.749 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 50.5 t80 -67.34 117.71 9.7 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.469 1.108 . . . . 0.0 110.975 173.331 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 6.9 t -173.96 151.07 1.72 Allowed Pre-proline 0 N--CA 1.48 1.049 0 C-N-CA 125.637 1.575 . . . . 0.0 112.75 -175.656 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -89.5 -174.39 0.9 Allowed 'Trans proline' 0 CA--C 1.547 1.173 0 C-N-CA 124.493 3.462 . . . . 0.0 109.565 166.661 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 32.1 mtmm -76.85 -25.92 53.71 Favored 'General case' 0 N--CA 1.481 1.075 0 O-C-N 120.282 -1.511 . . . . 0.0 112.43 170.007 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 38.2 p -78.7 -24.41 45.02 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 126.604 1.962 . . . . 0.0 114.292 -170.305 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 60.6 tptt -74.76 112.89 11.43 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 123.633 0.773 . . . . 0.0 111.02 179.024 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 51.1 tpt85 . . . . . 0 C--O 1.252 1.209 0 C-N-CA 126.815 2.046 . . . . 0.0 111.678 -174.169 . . . . . . . . 0 0 . 1 . 050 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.69 0 N-CA-C 110.82 -0.912 . . . . 0.0 110.82 . . . . . . . . . 0 0 . 1 . 050 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 8.1 tp -57.12 -34.28 44.89 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 N-CA-C 114.243 1.201 . . . . 0.0 114.243 -170.196 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 40.1 t -65.22 -47.35 87.77 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 CA-C-N 118.452 0.569 . . . . 0.0 110.845 -179.14 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -64.34 -41.0 97.0 Favored 'General case' 0 CA--C 1.539 0.542 0 O-C-N 121.449 -0.782 . . . . 0.0 111.591 174.098 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 34.6 mt-30 -66.09 -35.74 81.31 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 118.374 -0.822 . . . . 0.0 112.955 -177.472 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 99.7 m -93.4 -31.18 14.73 Favored 'General case' 0 N--CA 1.47 0.525 0 N-CA-C 114.63 1.344 . . . . 0.0 114.63 179.281 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 78.2 m -86.76 -52.75 5.32 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 119.457 1.026 . . . . 0.0 111.602 -177.004 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 27.3 m -83.07 -40.8 19.4 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.731 1.212 . . . . 0.0 110.578 -174.067 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 7.9 t -112.5 -171.85 1.94 Allowed 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.398 1.079 . . . . 0.0 112.039 170.827 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 90.4 mt -96.24 128.68 47.22 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 C-N-CA 126.029 1.732 . . . . 0.0 108.522 175.596 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 21.1 p -107.9 -157.96 0.63 Allowed 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.987 0.915 . . . . 0.0 112.1 178.025 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 92.8 p -155.1 164.53 38.73 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 125.776 1.63 . . . . 0.0 111.387 -179.153 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 44.9 mt -62.01 -33.32 74.13 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 122.957 0.503 . . . . 0.0 111.601 174.381 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 93.2 t80 -63.29 -36.93 85.3 Favored 'General case' 0 CA--C 1.539 0.551 0 O-C-N 121.532 -0.73 . . . . 0.0 112.727 171.409 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -71.86 -34.58 69.34 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 118.757 -0.64 . . . . 0.0 111.739 174.687 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 95.5 mt -59.29 -49.57 77.32 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 119.503 1.047 . . . . 0.0 110.703 169.829 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -61.88 -34.37 75.91 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 113.562 0.949 . . . . 0.0 113.562 176.316 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 15.3 t30 -61.78 -27.78 68.99 Favored 'General case' 0 CA--C 1.546 0.821 0 O-C-N 121.129 -0.982 . . . . 0.0 112.79 177.92 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 66.3 m-85 -104.7 29.34 6.27 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.78 1.632 . . . . 0.0 112.814 176.008 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 93.7 m -125.59 172.97 9.3 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 126.681 1.992 . . . . 0.0 112.635 168.869 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 . . . . . 0 C--O 1.251 1.137 0 C-N-CA 124.551 1.141 . . . . 0.0 112.407 175.97 . . . . . . . . 0 0 . 1 . 050 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 66.3 m-85 . . . . . 0 N--CA 1.488 1.46 0 CA-C-O 118.896 -0.573 . . . . 0.0 109.999 . . . . . . . . . 0 0 . 1 . 050 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 9.1 p -62.28 -28.89 45.45 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.345 0 CA-C-N 120.145 1.338 . . . . 0.0 112.435 174.439 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 28.9 m120 -92.46 144.67 25.13 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.068 1.347 . . . . 0.0 111.94 171.54 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -175.22 167.77 3.4 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 125.699 1.599 . . . . 0.0 111.723 178.326 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 83.8 m-70 -87.51 143.15 27.36 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 124.628 1.171 . . . . 0.0 108.967 166.049 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 73.9 mt -146.63 138.07 24.4 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 125.636 1.574 . . . . 0.0 109.346 174.825 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 1.8 t -150.09 157.6 43.3 Favored 'General case' 0 N--CA 1.469 0.491 0 O-C-N 121.291 -0.881 . . . . 0.0 113.214 176.337 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.99 -136.44 48.07 Favored Glycine 0 CA--C 1.531 1.037 0 C-N-CA 124.741 1.163 . . . . 0.0 113.388 175.038 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 21.0 m -53.58 -37.4 62.92 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.99 0.916 . . . . 0.0 112.69 177.049 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -69.7 -36.13 75.68 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 120.793 -1.192 . . . . 0.0 112.104 179.401 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 65.6 tp -64.59 -47.16 79.71 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 118.684 0.675 . . . . 0.0 110.721 170.579 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 59.0 t -61.78 -44.3 98.57 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 C-N-CA 123.91 0.884 . . . . 0.0 110.942 -179.221 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -64.12 -45.67 87.54 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 118.589 0.631 . . . . 0.0 112.18 174.408 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.94 -44.87 94.89 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 119.39 0.995 . . . . 0.0 111.747 178.388 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 28.0 tp -58.07 -47.01 84.46 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.009 1.324 . . . . 0.0 110.885 177.089 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 8.2 m-30 -63.54 -43.43 97.1 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 123.6 0.76 . . . . 0.0 112.312 176.721 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 73.9 mt -67.95 -39.37 83.41 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 123.719 0.807 . . . . 0.0 112.446 179.029 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 40.8 t -70.15 -45.94 74.13 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 123.972 0.909 . . . . 0.0 111.868 177.897 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 68.8 m -88.93 -21.64 23.48 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 114.831 1.419 . . . . 0.0 114.831 -172.343 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.24 -141.2 45.89 Favored Glycine 0 CA--C 1.53 0.97 0 C-N-CA 124.504 1.05 . . . . 0.0 113.646 170.981 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -66.11 -19.93 66.0 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.083 1.353 . . . . 0.0 113.588 -175.462 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 78.0 mtp85 -62.24 -33.71 75.11 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.827 0.851 . . . . 0.0 112.897 178.068 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.46 161.54 37.31 Favored Glycine 0 CA--C 1.534 1.259 0 C-N-CA 124.685 1.136 . . . . 0.0 113.734 -178.227 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 55.0 p90 -97.52 165.79 11.82 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.881 1.673 . . . . 0.0 112.899 -176.558 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 46.3 t80 -115.94 -36.94 3.99 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 124.82 1.248 . . . . 0.0 111.314 168.74 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 81.0 t80 52.74 98.27 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 127.45 2.3 . . . . 0.0 115.163 169.587 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 92.3 m -111.65 111.17 54.63 Favored Pre-proline 0 N--CA 1.477 0.88 0 C-N-CA 123.953 0.901 . . . . 0.0 110.836 -176.871 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -82.14 -153.21 0.04 OUTLIER 'Trans proline' 0 CA--C 1.539 0.743 0 C-N-CA 124.729 3.619 . . . . 0.0 110.391 169.89 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -51.6 -33.47 33.03 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 124.537 1.135 . . . . 0.0 113.583 170.904 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 25.5 m -134.05 -99.43 0.25 Allowed 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 126.558 1.943 . . . . 0.0 109.135 176.967 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 16.2 tppt? -168.65 -48.52 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 126.046 1.738 . . . . 0.0 111.561 -177.657 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 32.9 ptt-85 . . . . . 0 C--O 1.253 1.264 0 C-N-CA 125.443 1.497 . . . . 0.0 113.085 171.221 . . . . . . . . 0 0 . 1 stop_ save_